smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)[C@H]([NH3+])C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001117953185 780961069 /nfs/dbraw/zinc/96/10/69/780961069.db2.gz CBIUFSDZKBHXKT-MRXNPFEDSA-N 3 2 308.445 1.650 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]([NH3+])C3CC3)cc2F)CC1 ZINC001327414925 862157524 /nfs/dbraw/zinc/15/75/24/862157524.db2.gz FLVYAVUBABJDFH-MRXNPFEDSA-N 3 2 306.429 1.404 20 10 DDCDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001205136140 871388924 /nfs/dbraw/zinc/38/89/24/871388924.db2.gz QOSAJWZLUPBQMD-NWDGAFQWSA-N 2 2 302.374 1.834 20 10 DDCDLP Cc1cc(=O)oc2c1ccc(O)c2C[N@@H+]1C[C@H](C)[C@H](C[NH3+])C1 ZINC001205136140 871388945 /nfs/dbraw/zinc/38/89/45/871388945.db2.gz QOSAJWZLUPBQMD-NWDGAFQWSA-N 2 2 302.374 1.834 20 10 DDCDLP COC(=O)Cc1ccc(C[N@@H+]2C[C@@H](C)CC[C@@H]2C[NH3+])c(O)c1 ZINC001205855863 871865841 /nfs/dbraw/zinc/86/58/41/871865841.db2.gz PXUVGFPBWYBSPT-SWLSCSKDSA-N 2 2 306.406 1.667 20 10 DDCDLP COC(=O)Cc1ccc(C[N@H+]2C[C@@H](C)CC[C@@H]2C[NH3+])c(O)c1 ZINC001205855863 871865856 /nfs/dbraw/zinc/86/58/56/871865856.db2.gz PXUVGFPBWYBSPT-SWLSCSKDSA-N 2 2 306.406 1.667 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC001222427652 880458541 /nfs/dbraw/zinc/45/85/41/880458541.db2.gz VWMOYPQMCBQLRV-IBGZPJMESA-N 3 2 314.477 1.814 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CC[C@]2(C1)CCCC[NH2+]2 ZINC001222427652 880458549 /nfs/dbraw/zinc/45/85/49/880458549.db2.gz VWMOYPQMCBQLRV-IBGZPJMESA-N 3 2 314.477 1.814 20 10 DDCDLP Oc1cc(O)c(C[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)cc1O ZINC001233486624 887021662 /nfs/dbraw/zinc/02/16/62/887021662.db2.gz VHEMSVICUUCCHG-CYBMUJFWSA-N 2 2 302.330 1.852 20 10 DDCDLP Oc1cc(O)c(C[N@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)cc1O ZINC001233486624 887021674 /nfs/dbraw/zinc/02/16/74/887021674.db2.gz VHEMSVICUUCCHG-CYBMUJFWSA-N 2 2 302.330 1.852 20 10 DDCDLP CCC[N@H+](Cc1cc2c(cc1O)OCC[NH2+]C2)[C@H]1CC[NH2+]C1 ZINC001236322993 889185984 /nfs/dbraw/zinc/18/59/84/889185984.db2.gz BGFLUQUYNBLCNE-HNNXBMFYSA-N 3 2 305.422 1.448 20 10 DDCDLP CCC[N@@H+](Cc1cc2c(cc1O)OCC[NH2+]C2)[C@H]1CC[NH2+]C1 ZINC001236322993 889185995 /nfs/dbraw/zinc/18/59/95/889185995.db2.gz BGFLUQUYNBLCNE-HNNXBMFYSA-N 3 2 305.422 1.448 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCC34COC4)c(F)c2)CC1 ZINC001236935272 889430604 /nfs/dbraw/zinc/43/06/04/889430604.db2.gz GGZNSEJZSHWLGI-UHFFFAOYSA-N 2 2 319.424 1.942 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCCC34COC4)c(F)c2)CC1 ZINC001236935272 889430612 /nfs/dbraw/zinc/43/06/12/889430612.db2.gz GGZNSEJZSHWLGI-UHFFFAOYSA-N 2 2 319.424 1.942 20 10 DDCDLP C[N@@H+]1CCC[C@@H]1C[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000237082716 697803756 /nfs/dbraw/zinc/80/37/56/697803756.db2.gz DRXDVIPNKOSNFB-OAHLLOKOSA-N 2 2 307.413 1.846 20 10 DDCDLP C[N@H+]1CCC[C@@H]1C[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000237082716 697803761 /nfs/dbraw/zinc/80/37/61/697803761.db2.gz DRXDVIPNKOSNFB-OAHLLOKOSA-N 2 2 307.413 1.846 20 10 DDCDLP CC[C@H]1C(=O)NCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775676289 698021506 /nfs/dbraw/zinc/02/15/06/698021506.db2.gz PECPPASUDUYXKH-KRWDZBQOSA-N 2 2 316.449 1.149 20 10 DDCDLP C[N@@H+]1CC[C@](O)(C[NH2+]Cc2ccc(Br)cc2O)C1 ZINC000702627666 699230973 /nfs/dbraw/zinc/23/09/73/699230973.db2.gz FMOQACQTVYGXHG-ZDUSSCGKSA-N 2 2 315.211 1.311 20 10 DDCDLP CC[C@H]([NH2+]CC(=O)N1CC[NH+](C)CC1)c1ccc(C)cc1O ZINC000794803777 699831487 /nfs/dbraw/zinc/83/14/87/699831487.db2.gz KGBGKVAJUXNCAR-HNNXBMFYSA-N 2 2 305.422 1.515 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@H]3[NH3+])cc2F)CC1 ZINC000817902687 702514749 /nfs/dbraw/zinc/51/47/49/702514749.db2.gz XCLZUULZTNDWBT-IAGOWNOFSA-N 3 2 320.456 1.937 20 10 DDCDLP CC[NH+]1CCN(c2ccc(CN[C@@H]3CCC[C@H]3[NH3+])cc2F)CC1 ZINC000817902687 702514753 /nfs/dbraw/zinc/51/47/53/702514753.db2.gz XCLZUULZTNDWBT-IAGOWNOFSA-N 2 2 320.456 1.937 20 10 DDCDLP Cc1ccc(C[NH2+][C@@H]2CCN(CC[NH+]3CCOCC3)C2)c(O)c1 ZINC000877032069 705966329 /nfs/dbraw/zinc/96/63/29/705966329.db2.gz YFJYZDYRJUGKOF-QGZVFWFLSA-N 2 2 319.449 1.197 20 10 DDCDLP CCO[C@@H](C[NH2+]Cc1ccc(N2CCOCC2)cc1)C[NH+](C)C ZINC000922759606 714139932 /nfs/dbraw/zinc/13/99/32/714139932.db2.gz ILCDYOLNQOQMKX-SFHVURJKSA-N 2 2 321.465 1.580 20 10 DDCDLP CC[NH+](CC)CCN1CC[NH+](Cc2cccc(F)c2O)CC1 ZINC001138122439 860010054 /nfs/dbraw/zinc/01/00/54/860010054.db2.gz FLBKJZLIWSYBHS-UHFFFAOYSA-N 2 2 309.429 1.991 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+](C)[C@@H](C)C(=O)OC)cc2)CC1 ZINC001140304271 860614721 /nfs/dbraw/zinc/61/47/21/860614721.db2.gz LMWBMHHVUBAFJU-HNNXBMFYSA-N 2 2 319.449 1.822 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+](C)[C@@H](C)C(=O)OC)cc2)CC1 ZINC001140304271 860614725 /nfs/dbraw/zinc/61/47/25/860614725.db2.gz LMWBMHHVUBAFJU-HNNXBMFYSA-N 2 2 319.449 1.822 20 10 DDCDLP COc1cc(C[NH+]2CCN(c3cc[nH+]cc3)CC2)cc(O)c1O ZINC001204340270 871062103 /nfs/dbraw/zinc/06/21/03/871062103.db2.gz KFTASHAABAXOEA-UHFFFAOYSA-N 2 2 315.373 1.824 20 10 DDCDLP O=S1(=O)CC[C@@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)C1 ZINC000372811508 418904007 /nfs/dbraw/zinc/90/40/07/418904007.db2.gz GJORYQASYNKZJB-OAHLLOKOSA-N 2 2 324.446 1.133 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)ccc1[N+](=O)[O-] ZINC000843120320 702823198 /nfs/dbraw/zinc/82/31/98/702823198.db2.gz FHZLSGJRXXPLFF-OAHLLOKOSA-N 2 2 307.350 1.494 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@@]3(CC[NH2+]C3)C2)ccc1[N+](=O)[O-] ZINC000843120320 702823201 /nfs/dbraw/zinc/82/32/01/702823201.db2.gz FHZLSGJRXXPLFF-OAHLLOKOSA-N 2 2 307.350 1.494 20 10 DDCDLP COc1cccc(C[NH+]2CCC([N@@H+]3CC[C@H](O)C3)CC2)c1O ZINC000827700040 706052257 /nfs/dbraw/zinc/05/22/57/706052257.db2.gz OOUROWPEZYVFHU-HNNXBMFYSA-N 2 2 306.406 1.432 20 10 DDCDLP COc1cccc(C[NH+]2CCC([N@H+]3CC[C@H](O)C3)CC2)c1O ZINC000827700040 706052258 /nfs/dbraw/zinc/05/22/58/706052258.db2.gz OOUROWPEZYVFHU-HNNXBMFYSA-N 2 2 306.406 1.432 20 10 DDCDLP COc1ccc(N2CCC([NH2+][C@H]3C[NH2+]CCOC3)CC2)cc1 ZINC000925564673 714888707 /nfs/dbraw/zinc/88/87/07/714888707.db2.gz KCEXBUVCOQNGLV-HNNXBMFYSA-N 2 2 305.422 1.242 20 10 DDCDLP CCOCc1cc(C[NH2+]C[C@H](O)C[NH+]2CCCC2)ccc1OC ZINC001177474391 778603063 /nfs/dbraw/zinc/60/30/63/778603063.db2.gz BKUICMKABMJFRM-KRWDZBQOSA-N 2 2 322.449 1.778 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[NH+]3CC4(CCO4)C3)cc2)CC1 ZINC001140304449 860614664 /nfs/dbraw/zinc/61/46/64/860614664.db2.gz QDAZKHBCHLWMKU-UHFFFAOYSA-N 2 2 301.434 1.803 20 10 DDCDLP COc1ccc(O)c([C@H](C)[NH2+]CCC[N@@H+]2CCC[C@@H]2C(N)=O)c1 ZINC000273595867 295168435 /nfs/dbraw/zinc/16/84/35/295168435.db2.gz QMQCBQWYDVPPNF-SWLSCSKDSA-N 2 2 321.421 1.391 20 10 DDCDLP COc1ccc(O)c([C@H](C)[NH2+]CCC[N@H+]2CCC[C@@H]2C(N)=O)c1 ZINC000273595867 295168439 /nfs/dbraw/zinc/16/84/39/295168439.db2.gz QMQCBQWYDVPPNF-SWLSCSKDSA-N 2 2 321.421 1.391 20 10 DDCDLP CC[NH+](CC)CC(=O)N1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000180066739 520573321 /nfs/dbraw/zinc/57/33/21/520573321.db2.gz PGCVZEGCYHDFOF-UHFFFAOYSA-N 2 2 323.412 1.517 20 10 DDCDLP C[N@@H+]1CC[C@@](O)(C[NH2+]Cc2ccc(Br)cc2O)C1 ZINC000702627664 699231218 /nfs/dbraw/zinc/23/12/18/699231218.db2.gz FMOQACQTVYGXHG-CYBMUJFWSA-N 2 2 315.211 1.311 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1)c1ccc(F)cc1O ZINC000756547781 700627244 /nfs/dbraw/zinc/62/72/44/700627244.db2.gz HKPLXWXFRVPZRS-OLZOCXBDSA-N 2 2 323.412 1.769 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1ccc(F)cc1O ZINC000756547781 700627246 /nfs/dbraw/zinc/62/72/46/700627246.db2.gz HKPLXWXFRVPZRS-OLZOCXBDSA-N 2 2 323.412 1.769 20 10 DDCDLP C[C@@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1cc(F)cc(F)c1O ZINC000756605182 700631195 /nfs/dbraw/zinc/63/11/95/700631195.db2.gz RDCJHGQPYYLWNU-SNVBAGLBSA-N 2 2 300.349 1.778 20 10 DDCDLP COC(=O)C(C)(C)CC[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841042127 702319849 /nfs/dbraw/zinc/31/98/49/702319849.db2.gz KOIDSBIXUROMOG-HNNXBMFYSA-N 2 2 307.438 1.931 20 10 DDCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@@H]2CCC(=O)NC2(C)C)cc1 ZINC000817942529 702531005 /nfs/dbraw/zinc/53/10/05/702531005.db2.gz PKAKFNIKVVHFLN-LSDHHAIUSA-N 2 2 304.438 1.399 20 10 DDCDLP CN(C)c1ccc([C@@H](CNC(=O)Cn2cc[nH+]c2)[NH+](C)C)cc1 ZINC000891247312 710140644 /nfs/dbraw/zinc/14/06/44/710140644.db2.gz IAEDDLGNIBGECN-MRXNPFEDSA-N 2 2 315.421 1.368 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC(F)(F)[C@@H](N)C3)cc2)CC1 ZINC001206668832 865172776 /nfs/dbraw/zinc/17/27/76/865172776.db2.gz VTIJWKJYMQBWAU-INIZCTEOSA-N 2 2 324.419 1.607 20 10 DDCDLP Cn1ccc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)n1 ZINC001319737324 866260789 /nfs/dbraw/zinc/26/07/89/866260789.db2.gz PYTMXAZBJKLKJR-UHFFFAOYSA-N 2 2 317.412 1.601 20 10 DDCDLP CN1CCOc2cc(C[N@@H+]3CCC(F)(F)[C@H](C[NH3+])C3)ccc21 ZINC001205779194 871804187 /nfs/dbraw/zinc/80/41/87/871804187.db2.gz KHBGYSKUMROQJB-CYBMUJFWSA-N 2 2 311.376 1.931 20 10 DDCDLP CN1CCOc2cc(C[N@H+]3CCC(F)(F)[C@H](C[NH3+])C3)ccc21 ZINC001205779194 871804205 /nfs/dbraw/zinc/80/42/05/871804205.db2.gz KHBGYSKUMROQJB-CYBMUJFWSA-N 2 2 311.376 1.931 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3C[C@H]4CC[C@@]4([NH3+])C3)cc2)CC1 ZINC001235997167 889053588 /nfs/dbraw/zinc/05/35/88/889053588.db2.gz VAIOJROSNTVAAE-IEBWSBKVSA-N 3 2 314.477 1.752 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3C[C@H]4CC[C@@]4([NH3+])C3)cc2)CC1 ZINC001235997167 889053606 /nfs/dbraw/zinc/05/36/06/889053606.db2.gz VAIOJROSNTVAAE-IEBWSBKVSA-N 3 2 314.477 1.752 20 10 DDCDLP C[C@@H]1CC[NH2+]C[C@H]1[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000841059872 702329309 /nfs/dbraw/zinc/32/93/09/702329309.db2.gz YFLKHIZQKNHLDD-CZUORRHYSA-N 2 2 307.413 1.750 20 10 DDCDLP CCO[C@@H]1C[N@H+](Cc2cc(F)cc(C(C)=O)c2O)C[C@H]1C[NH3+] ZINC000846225349 703253669 /nfs/dbraw/zinc/25/36/69/703253669.db2.gz NBJCAKFLJOFSBT-IUODEOHRSA-N 2 2 310.369 1.530 20 10 DDCDLP CCO[C@@H]1C[N@@H+](Cc2cc(F)cc(C(C)=O)c2O)C[C@H]1C[NH3+] ZINC000846225349 703253671 /nfs/dbraw/zinc/25/36/71/703253671.db2.gz NBJCAKFLJOFSBT-IUODEOHRSA-N 2 2 310.369 1.530 20 10 DDCDLP COc1cc(C)cc(C[N@H+](CCO)C2CC[NH+](C)CC2)c1O ZINC000893863638 710862400 /nfs/dbraw/zinc/86/24/00/710862400.db2.gz KEVDAGPUXMVSQN-UHFFFAOYSA-N 2 2 308.422 1.598 20 10 DDCDLP COc1cc(C)cc(C[N@@H+](CCO)C2CC[NH+](C)CC2)c1O ZINC000893863638 710862404 /nfs/dbraw/zinc/86/24/04/710862404.db2.gz KEVDAGPUXMVSQN-UHFFFAOYSA-N 2 2 308.422 1.598 20 10 DDCDLP [NH3+]C[C@]1(O)CCC[N@H+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC001205247873 751330056 /nfs/dbraw/zinc/33/00/56/751330056.db2.gz KKYCCAOWXHMTFG-AWEZNQCLSA-N 2 2 302.777 1.860 20 10 DDCDLP [NH3+]C[C@]1(O)CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC001205247873 751330062 /nfs/dbraw/zinc/33/00/62/751330062.db2.gz KKYCCAOWXHMTFG-AWEZNQCLSA-N 2 2 302.777 1.860 20 10 DDCDLP Oc1ccccc1C[N@@H+]1CC[C@H]2CN(CCn3cc[nH+]c3)C[C@H]21 ZINC001275267353 852941234 /nfs/dbraw/zinc/94/12/34/852941234.db2.gz MAYZDEPLZSLMPR-DOTOQJQBSA-N 2 2 312.417 1.795 20 10 DDCDLP Oc1ccccc1C[N@H+]1CC[C@H]2CN(CCn3cc[nH+]c3)C[C@H]21 ZINC001275267353 852941244 /nfs/dbraw/zinc/94/12/44/852941244.db2.gz MAYZDEPLZSLMPR-DOTOQJQBSA-N 2 2 312.417 1.795 20 10 DDCDLP COC[C@@H]1COCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139411182 860389591 /nfs/dbraw/zinc/38/95/91/860389591.db2.gz YFXHIDCXAFAZTR-GOSISDBHSA-N 2 2 319.449 1.286 20 10 DDCDLP COC[C@@H]1COCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139411182 860389601 /nfs/dbraw/zinc/38/96/01/860389601.db2.gz YFXHIDCXAFAZTR-GOSISDBHSA-N 2 2 319.449 1.286 20 10 DDCDLP CCN(CC)c1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](O)C2)c(OC)c1 ZINC001205952881 871949177 /nfs/dbraw/zinc/94/91/77/871949177.db2.gz DSVJMVPYXKVXIV-HZPDHXFCSA-N 2 2 307.438 1.435 20 10 DDCDLP CCN(CC)c1ccc(C[N@H+]2CC[C@@H]([NH3+])[C@H](O)C2)c(OC)c1 ZINC001205952881 871949194 /nfs/dbraw/zinc/94/91/94/871949194.db2.gz DSVJMVPYXKVXIV-HZPDHXFCSA-N 2 2 307.438 1.435 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH+]3CC4(COC4)C3)c(F)c2)CC1 ZINC001236929221 889425041 /nfs/dbraw/zinc/42/50/41/889425041.db2.gz BJIIPIMGHWSJGW-UHFFFAOYSA-N 2 2 305.397 1.410 20 10 DDCDLP COc1ccc(N2CC[NH+](C3CC[NH2+]CC3)CC2)c(OC)c1 ZINC001246947583 893009713 /nfs/dbraw/zinc/00/97/13/893009713.db2.gz MEYJGEFEJSBLPJ-UHFFFAOYSA-N 2 2 305.422 1.578 20 10 DDCDLP CC(C)C[C@@H](C[NH3+])[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000841038634 702318637 /nfs/dbraw/zinc/31/86/37/702318637.db2.gz MOOFRIMRAUTMQE-KRWDZBQOSA-N 3 2 304.482 1.901 20 10 DDCDLP COc1ccc(N2CCC([NH2+]C[C@@H]3C[NH2+]CCO3)CC2)cc1 ZINC000841101353 702347582 /nfs/dbraw/zinc/34/75/82/702347582.db2.gz UNRQEVJMIGWZII-KRWDZBQOSA-N 2 2 305.422 1.242 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[NH2+][C@@H]2CCCC[C@H]2[NH3+])cc1 ZINC000844225003 702996864 /nfs/dbraw/zinc/99/68/64/702996864.db2.gz STDZFCWDEPFOOC-HZPDHXFCSA-N 2 2 304.438 1.228 20 10 DDCDLP C[C@H](CC(=O)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)n1cc[nH+]c1 ZINC000846663931 703310609 /nfs/dbraw/zinc/31/06/09/703310609.db2.gz SGHJWCWADWARAJ-CZUORRHYSA-N 2 2 315.421 1.716 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@@H]3[C@@H](CC[NH+]3C)C2)ccc1[N+](=O)[O-] ZINC000877743566 706195400 /nfs/dbraw/zinc/19/54/00/706195400.db2.gz WVOMPDFEGZVGOE-WCQYABFASA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@@H]3[C@@H](CC[NH+]3C)C2)ccc1[N+](=O)[O-] ZINC000877743566 706195401 /nfs/dbraw/zinc/19/54/01/706195401.db2.gz WVOMPDFEGZVGOE-WCQYABFASA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@@H]3[C@@H](CC[N@@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000877743566 706195403 /nfs/dbraw/zinc/19/54/03/706195403.db2.gz WVOMPDFEGZVGOE-WCQYABFASA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000877743566 706195405 /nfs/dbraw/zinc/19/54/05/706195405.db2.gz WVOMPDFEGZVGOE-WCQYABFASA-N 2 2 321.377 1.835 20 10 DDCDLP C[N@H+](CCCN1CC[NH+](C)CC1)Cc1cc(F)cc(F)c1O ZINC000883184859 707950224 /nfs/dbraw/zinc/95/02/24/707950224.db2.gz HQZZHQQNVKZYKN-UHFFFAOYSA-N 2 2 313.392 1.740 20 10 DDCDLP C[N@@H+](CCCN1CC[NH+](C)CC1)Cc1cc(F)cc(F)c1O ZINC000883184859 707950225 /nfs/dbraw/zinc/95/02/25/707950225.db2.gz HQZZHQQNVKZYKN-UHFFFAOYSA-N 2 2 313.392 1.740 20 10 DDCDLP CCOC(=O)CN(CC[NH3+])c1ccc(Cn2cc[nH+]c2)cc1 ZINC001170995465 772045193 /nfs/dbraw/zinc/04/51/93/772045193.db2.gz MXTDTASQXDAYEK-UHFFFAOYSA-N 2 2 302.378 1.260 20 10 DDCDLP COc1ccc(C[NH2+]CCNC(=O)Cc2[nH]c[nH+]c2C)cc1C ZINC001149122740 772895751 /nfs/dbraw/zinc/89/57/51/772895751.db2.gz AQAZETWBFRXANN-UHFFFAOYSA-N 2 2 316.405 1.484 20 10 DDCDLP [NH3+]C[C@@]1(O)CCCC[N@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001205726526 871752165 /nfs/dbraw/zinc/75/21/65/871752165.db2.gz UEZXCZKCJCUEIF-AWEZNQCLSA-N 2 2 302.777 1.860 20 10 DDCDLP [NH3+]C[C@@]1(O)CCCC[N@@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001205726526 871752171 /nfs/dbraw/zinc/75/21/71/871752171.db2.gz UEZXCZKCJCUEIF-AWEZNQCLSA-N 2 2 302.777 1.860 20 10 DDCDLP Cc1cc(Br)c(O)c(C[N@H+]2C[C@@H](O)[C@@H](C[NH3+])C2)c1 ZINC001206480544 872366778 /nfs/dbraw/zinc/36/67/78/872366778.db2.gz BFRSENSSOORJPI-CMPLNLGQSA-N 2 2 315.211 1.215 20 10 DDCDLP Cc1cc(Br)c(O)c(C[N@@H+]2C[C@@H](O)[C@@H](C[NH3+])C2)c1 ZINC001206480544 872366754 /nfs/dbraw/zinc/36/67/54/872366754.db2.gz BFRSENSSOORJPI-CMPLNLGQSA-N 2 2 315.211 1.215 20 10 DDCDLP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001349673343 875296179 /nfs/dbraw/zinc/29/61/79/875296179.db2.gz DROLQUULOOIVDT-HOCLYGCPSA-N 3 2 320.456 1.889 20 10 DDCDLP C[C@H]1C[C@@H]([NH3+])CC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001349673343 875296191 /nfs/dbraw/zinc/29/61/91/875296191.db2.gz DROLQUULOOIVDT-HOCLYGCPSA-N 3 2 320.456 1.889 20 10 DDCDLP Cc1ccc([C@H](C)[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c(O)c1 ZINC000273361796 130111618 /nfs/dbraw/zinc/11/16/18/130111618.db2.gz ANHPEEPJKHMFJR-ZFWWWQNUSA-N 2 2 305.422 1.691 20 10 DDCDLP COCCn1cc(C[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)cn1 ZINC000841045255 702321655 /nfs/dbraw/zinc/32/16/55/702321655.db2.gz JKDODIWOAMSNAC-QGZVFWFLSA-N 2 2 317.437 1.385 20 10 DDCDLP COCC[NH2+]CC[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000841049028 702323749 /nfs/dbraw/zinc/32/37/49/702323749.db2.gz XKACHQUUNJSVJS-UHFFFAOYSA-N 2 2 307.438 1.490 20 10 DDCDLP COc1ccc(N2CCC([NH2+]C[C@@H]3C[C@H](F)C[NH2+]3)CC2)cc1 ZINC000841080762 702338618 /nfs/dbraw/zinc/33/86/18/702338618.db2.gz YXWVZOVTOMITNF-ZFWWWQNUSA-N 2 2 307.413 1.954 20 10 DDCDLP C[C@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)C(C)(C)n1cncn1 ZINC000817941210 702531671 /nfs/dbraw/zinc/53/16/71/702531671.db2.gz JKCVLKAOVRWYRS-XJKSGUPXSA-N 2 2 316.453 1.757 20 10 DDCDLP Cc1cc(O)c(C[N@H+]2CCN(CC[NH+](C)C)C(=O)C2)cc1C ZINC000844715008 703061667 /nfs/dbraw/zinc/06/16/67/703061667.db2.gz SGXICWQYZZKVDN-UHFFFAOYSA-N 2 2 305.422 1.215 20 10 DDCDLP Cc1cc(O)c(C[N@@H+]2CCN(CC[NH+](C)C)C(=O)C2)cc1C ZINC000844715008 703061670 /nfs/dbraw/zinc/06/16/70/703061670.db2.gz SGXICWQYZZKVDN-UHFFFAOYSA-N 2 2 305.422 1.215 20 10 DDCDLP COc1ccc(N2CC[NH+](CCNC(=[NH2+])NC3CC3)CC2)cc1 ZINC000848999245 703609033 /nfs/dbraw/zinc/60/90/33/703609033.db2.gz ISZVJSQTXRKPHM-UHFFFAOYSA-N 2 2 317.437 1.094 20 10 DDCDLP Cc1cccc(C[NH+]2C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C2)c1O ZINC000877669605 706175866 /nfs/dbraw/zinc/17/58/66/706175866.db2.gz QFHWFZQYOWHHGY-IAGOWNOFSA-N 3 2 305.466 1.872 20 10 DDCDLP CN(C)c1ccc(/C=C/C[NH+]2CCC([NH2+]CCO)CC2)cc1 ZINC000873216226 707772751 /nfs/dbraw/zinc/77/27/51/707772751.db2.gz JRAGFUFLMZLQDF-ONEGZZNKSA-N 2 2 303.450 1.812 20 10 DDCDLP CN(C)c1ccc([C@@H](CNC(=O)Cc2[nH]cc[nH+]2)[NH+](C)C)cc1 ZINC000891246692 710140582 /nfs/dbraw/zinc/14/05/82/710140582.db2.gz FCJNJLKBVYDXEG-OAHLLOKOSA-N 2 2 315.421 1.437 20 10 DDCDLP COc1cc(C)cc(C[NH2+]C[C@H]2C[N@@H+]3CCC[C@@H]3CO2)c1O ZINC000894242718 711031435 /nfs/dbraw/zinc/03/14/35/711031435.db2.gz URFXJSMTBMDFEB-CABCVRRESA-N 2 2 306.406 1.662 20 10 DDCDLP COc1cc(C)cc(C[NH2+]C[C@H]2C[N@H+]3CCC[C@@H]3CO2)c1O ZINC000894242718 711031441 /nfs/dbraw/zinc/03/14/41/711031441.db2.gz URFXJSMTBMDFEB-CABCVRRESA-N 2 2 306.406 1.662 20 10 DDCDLP COc1cc(C[N@@H+]2CCOC3(CC3)C2)cc(C[NH+](C)C)c1O ZINC001139259782 860340634 /nfs/dbraw/zinc/34/06/34/860340634.db2.gz BLKVEAGSXOLLEM-UHFFFAOYSA-N 2 2 306.406 1.827 20 10 DDCDLP COc1cc(C[N@H+]2CCOC3(CC3)C2)cc(C[NH+](C)C)c1O ZINC001139259782 860340640 /nfs/dbraw/zinc/34/06/40/860340640.db2.gz BLKVEAGSXOLLEM-UHFFFAOYSA-N 2 2 306.406 1.827 20 10 DDCDLP COC(=O)Cc1ccc(C[NH+]2CC3(C2)CC[N@H+](C)C3)c(O)c1 ZINC001277420676 884164311 /nfs/dbraw/zinc/16/43/11/884164311.db2.gz FCQGIPJUHLQEEA-UHFFFAOYSA-N 2 2 304.390 1.245 20 10 DDCDLP COC(=O)Cc1ccc(C[NH+]2CC3(C2)CC[N@@H+](C)C3)c(O)c1 ZINC001277420676 884164315 /nfs/dbraw/zinc/16/43/15/884164315.db2.gz FCQGIPJUHLQEEA-UHFFFAOYSA-N 2 2 304.390 1.245 20 10 DDCDLP Cc1noc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)n1 ZINC000792176344 699680604 /nfs/dbraw/zinc/68/06/04/699680604.db2.gz AUJPBMXSNUWYJO-CYBMUJFWSA-N 2 2 315.421 1.981 20 10 DDCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc(C(N)=O)cc2)cc1 ZINC000841044218 702320949 /nfs/dbraw/zinc/32/09/49/702320949.db2.gz ULTDIJYOOPEGAF-QGZVFWFLSA-N 2 2 312.417 1.641 20 10 DDCDLP Fc1cc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)ccc1N1CCOCC1 ZINC000843126999 702825295 /nfs/dbraw/zinc/82/52/95/702825295.db2.gz NTEWNNYEOOCMQT-WBVHZDCISA-N 2 2 319.424 1.846 20 10 DDCDLP Fc1cc(C[N@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)ccc1N1CCOCC1 ZINC000843126999 702825297 /nfs/dbraw/zinc/82/52/97/702825297.db2.gz NTEWNNYEOOCMQT-WBVHZDCISA-N 2 2 319.424 1.846 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@]34CCC[C@H]3[NH2+]CC4)cc2)CC1 ZINC000873229814 707778577 /nfs/dbraw/zinc/77/85/77/707778577.db2.gz GKYJJLMDUDFTKF-MOPGFXCFSA-N 3 2 314.477 1.813 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[NH+]3CCC(=O)CC3)cc2)CC1 ZINC001140302179 860614786 /nfs/dbraw/zinc/61/47/86/860614786.db2.gz LXXJMZUQJLPWSN-UHFFFAOYSA-N 2 2 301.434 1.993 20 10 DDCDLP Cc1cc(Br)c(O)c(C[N@@H+]2C[C@H](O)[C@@H](C[NH3+])C2)c1 ZINC001206534732 872421598 /nfs/dbraw/zinc/42/15/98/872421598.db2.gz BFRSENSSOORJPI-JQWIXIFHSA-N 2 2 315.211 1.215 20 10 DDCDLP Cc1cc(Br)c(O)c(C[N@H+]2C[C@H](O)[C@@H](C[NH3+])C2)c1 ZINC001206534732 872421603 /nfs/dbraw/zinc/42/16/03/872421603.db2.gz BFRSENSSOORJPI-JQWIXIFHSA-N 2 2 315.211 1.215 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3C[C@H]4CC[C@]4([NH3+])C3)cc2)CC1 ZINC001235997168 889053238 /nfs/dbraw/zinc/05/32/38/889053238.db2.gz VAIOJROSNTVAAE-MJGOQNOKSA-N 3 2 314.477 1.752 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3C[C@H]4CC[C@]4([NH3+])C3)cc2)CC1 ZINC001235997168 889053253 /nfs/dbraw/zinc/05/32/53/889053253.db2.gz VAIOJROSNTVAAE-MJGOQNOKSA-N 3 2 314.477 1.752 20 10 DDCDLP CC[NH+]1CCN(c2ccc(CNC(=O)C[NH+](C)C)cc2F)CC1 ZINC000106922437 221506430 /nfs/dbraw/zinc/50/64/30/221506430.db2.gz ATFHXGFYLYRDRH-UHFFFAOYSA-N 2 2 322.428 1.145 20 10 DDCDLP Oc1cc2c(cc1C[N@@H+]1CC[C@H](C[NH+]3CCOCC3)C1)OCO2 ZINC000172935418 407854006 /nfs/dbraw/zinc/85/40/06/407854006.db2.gz QVMTYTLDZPKPPP-CYBMUJFWSA-N 2 2 320.389 1.275 20 10 DDCDLP Oc1cc2c(cc1C[N@H+]1CC[C@H](C[NH+]3CCOCC3)C1)OCO2 ZINC000172935418 407854010 /nfs/dbraw/zinc/85/40/10/407854010.db2.gz QVMTYTLDZPKPPP-CYBMUJFWSA-N 2 2 320.389 1.275 20 10 DDCDLP CN(C)c1ccc(C[N@H+](CCO)C2CC[NH+](C)CC2)cc1F ZINC000155497553 408172992 /nfs/dbraw/zinc/17/29/92/408172992.db2.gz WTTYXBCKQUOAQM-UHFFFAOYSA-N 2 2 309.429 1.780 20 10 DDCDLP CN(C)c1ccc(C[N@@H+](CCO)C2CC[NH+](C)CC2)cc1F ZINC000155497553 408172996 /nfs/dbraw/zinc/17/29/96/408172996.db2.gz WTTYXBCKQUOAQM-UHFFFAOYSA-N 2 2 309.429 1.780 20 10 DDCDLP COc1c(O)c(C[NH2+]CCCn2cc[nH+]c2C)ccc1[N+](=O)[O-] ZINC000278570001 409085228 /nfs/dbraw/zinc/08/52/28/409085228.db2.gz CMVDLUSFKLGULP-UHFFFAOYSA-N 2 2 320.349 1.994 20 10 DDCDLP C[C@@H]1C[C@H]([NH2+]CC(=O)N2CC[NH+](C)CC2)c2c1c(F)ccc2O ZINC000756491638 700623898 /nfs/dbraw/zinc/62/38/98/700623898.db2.gz WUSXHKXHBRFAAJ-YPMHNXCESA-N 2 2 321.396 1.443 20 10 DDCDLP CC[C@H]([NH2+]CC(=O)N1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000765416385 701010855 /nfs/dbraw/zinc/01/08/55/701010855.db2.gz HPGIEOWAZKGBMR-KRWDZBQOSA-N 2 2 318.465 1.567 20 10 DDCDLP CN(C)c1ccc(C[NH2+]C[C@H]2C[NH2+]CCO2)c(C(F)(F)F)c1 ZINC000841100558 702345900 /nfs/dbraw/zinc/34/59/00/702345900.db2.gz HXFBMEHNVGNQJQ-CYBMUJFWSA-N 2 2 317.355 1.849 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[NH2+][C@H](C)C3C[NH2+]C3)cc2F)CC1 ZINC000817902316 702515180 /nfs/dbraw/zinc/51/51/80/702515180.db2.gz NNTKTSKCPLDFOV-CQSZACIVSA-N 3 2 320.456 1.665 20 10 DDCDLP COC[C@]1(C[NH2+][C@@H](C)c2cc(C(=O)OC)ccc2O)CCC[NH2+]1 ZINC000817974205 702541090 /nfs/dbraw/zinc/54/10/90/702541090.db2.gz JIPHSEKISFQNIG-YVEFUNNKSA-N 2 2 322.405 1.598 20 10 DDCDLP C[C@H]1C[NH2+]C[C@@H]([NH2+]Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000843126801 702825440 /nfs/dbraw/zinc/82/54/40/702825440.db2.gz WMPNZQXNKQLUBE-HIFRSBDPSA-N 2 2 307.413 1.750 20 10 DDCDLP C[C@H]1C[N@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@@H]1[NH3+] ZINC000844218949 702994712 /nfs/dbraw/zinc/99/47/12/702994712.db2.gz GEBPNDCNFNADIB-YOEHRIQHSA-N 2 2 318.465 1.380 20 10 DDCDLP C[C@H]1C[N@@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@@H]1[NH3+] ZINC000844218949 702994714 /nfs/dbraw/zinc/99/47/14/702994714.db2.gz GEBPNDCNFNADIB-YOEHRIQHSA-N 2 2 318.465 1.380 20 10 DDCDLP Cn1cc(C[N@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)nn1 ZINC000827304808 705972325 /nfs/dbraw/zinc/97/23/25/705972325.db2.gz GGPGOTCITDVFFU-UHFFFAOYSA-N 2 2 314.437 1.199 20 10 DDCDLP Cn1cc(C[N@@H+](C)Cc2ccc(N3CC[NH+](C)CC3)cc2)nn1 ZINC000827304808 705972328 /nfs/dbraw/zinc/97/23/28/705972328.db2.gz GGPGOTCITDVFFU-UHFFFAOYSA-N 2 2 314.437 1.199 20 10 DDCDLP COc1cccc(O)c1C[NH+]1CCC([N@@H+]2CC[C@@H](O)C2)CC1 ZINC000827699668 706052012 /nfs/dbraw/zinc/05/20/12/706052012.db2.gz LDICHPSNZNBHMD-CQSZACIVSA-N 2 2 306.406 1.432 20 10 DDCDLP COc1cccc(O)c1C[NH+]1CCC([N@H+]2CC[C@@H](O)C2)CC1 ZINC000827699668 706052015 /nfs/dbraw/zinc/05/20/15/706052015.db2.gz LDICHPSNZNBHMD-CQSZACIVSA-N 2 2 306.406 1.432 20 10 DDCDLP CC(C)c1ccc(O)c(C[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)c1 ZINC001206660831 863159656 /nfs/dbraw/zinc/15/96/56/863159656.db2.gz KJQGUASZLGPESK-INIZCTEOSA-N 2 2 319.449 1.945 20 10 DDCDLP CC(C)c1ccc(O)c(C[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c1 ZINC001206660831 863159668 /nfs/dbraw/zinc/15/96/68/863159668.db2.gz KJQGUASZLGPESK-INIZCTEOSA-N 2 2 319.449 1.945 20 10 DDCDLP C[NH+](C)CCN1CC2(C1)CC[NH+](Cc1cccc(F)c1O)CC2 ZINC001276538205 873347831 /nfs/dbraw/zinc/34/78/31/873347831.db2.gz VXZXODKRNXQYQQ-UHFFFAOYSA-N 2 2 321.440 1.991 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1C[C@H]2CCC[NH2+][C@H]2C1 ZINC001235218360 888486904 /nfs/dbraw/zinc/48/69/04/888486904.db2.gz FZXPEMVEMVMGCV-AEFFLSMTSA-N 3 2 300.450 1.280 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1C[C@H]2CCC[NH2+][C@H]2C1 ZINC001235218360 888486908 /nfs/dbraw/zinc/48/69/08/888486908.db2.gz FZXPEMVEMVMGCV-AEFFLSMTSA-N 3 2 300.450 1.280 20 10 DDCDLP COC(=O)Cc1ccc(C[N@@H+]2C[C@H]3CCC[NH+](C)[C@H]3C2)c(O)c1 ZINC001249214639 893870546 /nfs/dbraw/zinc/87/05/46/893870546.db2.gz OQHGSYAVXIIJHC-ZBFHGGJFSA-N 2 2 318.417 1.634 20 10 DDCDLP COC(=O)Cc1ccc(C[N@H+]2C[C@H]3CCC[NH+](C)[C@H]3C2)c(O)c1 ZINC001249214639 893870562 /nfs/dbraw/zinc/87/05/62/893870562.db2.gz OQHGSYAVXIIJHC-ZBFHGGJFSA-N 2 2 318.417 1.634 20 10 DDCDLP COC(=O)Cc1ccc(C[NH+]2C[C@H]3CCC[N@H+](C)[C@H]3C2)c(O)c1 ZINC001249214639 893870581 /nfs/dbraw/zinc/87/05/81/893870581.db2.gz OQHGSYAVXIIJHC-ZBFHGGJFSA-N 2 2 318.417 1.634 20 10 DDCDLP COC(=O)Cc1ccc(C[NH+]2C[C@H]3CCC[N@@H+](C)[C@H]3C2)c(O)c1 ZINC001249214639 893870607 /nfs/dbraw/zinc/87/06/07/893870607.db2.gz OQHGSYAVXIIJHC-ZBFHGGJFSA-N 2 2 318.417 1.634 20 10 DDCDLP COC(=O)Cc1ccc(C[N@@H+]2C[C@H]3CCC[NH+](C)[C@@H]3C2)c(O)c1 ZINC001249214636 893873043 /nfs/dbraw/zinc/87/30/43/893873043.db2.gz OQHGSYAVXIIJHC-GDBMZVCRSA-N 2 2 318.417 1.634 20 10 DDCDLP COC(=O)Cc1ccc(C[N@H+]2C[C@H]3CCC[NH+](C)[C@@H]3C2)c(O)c1 ZINC001249214636 893873054 /nfs/dbraw/zinc/87/30/54/893873054.db2.gz OQHGSYAVXIIJHC-GDBMZVCRSA-N 2 2 318.417 1.634 20 10 DDCDLP COC(=O)Cc1ccc(C[NH+]2C[C@H]3CCC[N@H+](C)[C@@H]3C2)c(O)c1 ZINC001249214636 893873066 /nfs/dbraw/zinc/87/30/66/893873066.db2.gz OQHGSYAVXIIJHC-GDBMZVCRSA-N 2 2 318.417 1.634 20 10 DDCDLP COC(=O)Cc1ccc(C[NH+]2C[C@H]3CCC[N@@H+](C)[C@@H]3C2)c(O)c1 ZINC001249214636 893873076 /nfs/dbraw/zinc/87/30/76/893873076.db2.gz OQHGSYAVXIIJHC-GDBMZVCRSA-N 2 2 318.417 1.634 20 10 DDCDLP C[C@@H]([NH2+][C@@H]1CCC(=O)N[C@H]1c1c[nH+]cn1C)c1ccccc1O ZINC000375517592 418653532 /nfs/dbraw/zinc/65/35/32/418653532.db2.gz WXKIMGXTUKCSLM-CJBNDPTMSA-N 2 2 314.389 1.796 20 10 DDCDLP CCOc1cccc(C[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)c1O ZINC000858224611 704681362 /nfs/dbraw/zinc/68/13/62/704681362.db2.gz MIUSGBDXKUUOAE-AWEZNQCLSA-N 2 2 321.421 1.220 20 10 DDCDLP CCOc1cccc(C[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c1O ZINC000858224611 704681363 /nfs/dbraw/zinc/68/13/63/704681363.db2.gz MIUSGBDXKUUOAE-AWEZNQCLSA-N 2 2 321.421 1.220 20 10 DDCDLP CO[C@H]1C[N@H+](Cc2ccc(N3CCOCC3)cc2)[C@](C)(C[NH3+])C1 ZINC000923413621 714348068 /nfs/dbraw/zinc/34/80/68/714348068.db2.gz WLDCZWPJMPVQKG-MSOLQXFVSA-N 2 2 319.449 1.461 20 10 DDCDLP CO[C@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2)[C@](C)(C[NH3+])C1 ZINC000923413621 714348071 /nfs/dbraw/zinc/34/80/71/714348071.db2.gz WLDCZWPJMPVQKG-MSOLQXFVSA-N 2 2 319.449 1.461 20 10 DDCDLP CCN(CC)c1ccc(C[NH+]2CC(N3CC[NH+](C)CC3)C2)cc1 ZINC001203943466 870846279 /nfs/dbraw/zinc/84/62/79/870846279.db2.gz CMVXAYDAOULHSW-UHFFFAOYSA-N 2 2 316.493 1.964 20 10 DDCDLP Cc1c2ccccc2n(C)c1C[NH2+]CC(=O)N1CC[NH+](C)CC1 ZINC001308228967 871482025 /nfs/dbraw/zinc/48/20/25/871482025.db2.gz NHWJXBCMCCCBGB-UHFFFAOYSA-N 2 2 314.433 1.350 20 10 DDCDLP COC(=O)Cc1ccc(C[N@@H+]2C[C@@H](C)CC[C@H]2C[NH3+])c(O)c1 ZINC001205855864 871863966 /nfs/dbraw/zinc/86/39/66/871863966.db2.gz PXUVGFPBWYBSPT-WFASDCNBSA-N 2 2 306.406 1.667 20 10 DDCDLP COC(=O)Cc1ccc(C[N@H+]2C[C@@H](C)CC[C@H]2C[NH3+])c(O)c1 ZINC001205855864 871863983 /nfs/dbraw/zinc/86/39/83/871863983.db2.gz PXUVGFPBWYBSPT-WFASDCNBSA-N 2 2 306.406 1.667 20 10 DDCDLP Cc1cc(CN2CC[NH2+][C@H]3CC[NH2+]CC[C@@H]32)ccc1N(C)C ZINC001222497537 880512477 /nfs/dbraw/zinc/51/24/77/880512477.db2.gz OQAGEWNCQDAKNW-WMZOPIPTSA-N 2 2 302.466 1.587 20 10 DDCDLP COc1cc(Cl)cc(C[NH2+]C[C@@H]2C[N@H+](C)CCN2C)c1O ZINC000228674150 407650899 /nfs/dbraw/zinc/65/08/99/407650899.db2.gz XKQHFMZKALCGIF-CYBMUJFWSA-N 2 2 313.829 1.390 20 10 DDCDLP COc1cc(Cl)cc(C[NH2+]C[C@@H]2C[N@@H+](C)CCN2C)c1O ZINC000228674150 407650907 /nfs/dbraw/zinc/65/09/07/407650907.db2.gz XKQHFMZKALCGIF-CYBMUJFWSA-N 2 2 313.829 1.390 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@H]3CC[NH+](C)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000278530546 484296244 /nfs/dbraw/zinc/29/62/44/484296244.db2.gz VCHVJWYCCXOSFO-RISCZKNCSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@H]3CC[NH+](C)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000278530546 484296249 /nfs/dbraw/zinc/29/62/49/484296249.db2.gz VCHVJWYCCXOSFO-RISCZKNCSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@H]3CC[N@H+](C)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000278530546 484296254 /nfs/dbraw/zinc/29/62/54/484296254.db2.gz VCHVJWYCCXOSFO-RISCZKNCSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@H]3CC[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000278530546 484296260 /nfs/dbraw/zinc/29/62/60/484296260.db2.gz VCHVJWYCCXOSFO-RISCZKNCSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1cccc(O)c1C[NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1 ZINC000762484814 700893937 /nfs/dbraw/zinc/89/39/37/700893937.db2.gz WJGKDVDMGLRJGQ-AWEZNQCLSA-N 2 2 308.422 1.991 20 10 DDCDLP COc1cccc(O)c1C[NH2+]CCC[N@H+]1CCCO[C@@H](C)C1 ZINC000762484814 700893939 /nfs/dbraw/zinc/89/39/39/700893939.db2.gz WJGKDVDMGLRJGQ-AWEZNQCLSA-N 2 2 308.422 1.991 20 10 DDCDLP CN(C)c1ccc(CN(C)C(=O)C[NH2+][C@@H](C[NH3+])C(C)(C)C)cc1 ZINC000844227548 702997556 /nfs/dbraw/zinc/99/75/56/702997556.db2.gz YRTAAYHCJJFYRU-INIZCTEOSA-N 2 2 320.481 1.674 20 10 DDCDLP C[C@H]1CC[NH2+]C[C@@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000854230736 704368873 /nfs/dbraw/zinc/36/88/73/704368873.db2.gz XLOGKSLTNOAQLC-KSSFIOAISA-N 2 2 303.450 1.735 20 10 DDCDLP CCn1ncc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)n1 ZINC000858207441 704678353 /nfs/dbraw/zinc/67/83/53/704678353.db2.gz WZTCRTGGTXCOMS-UHFFFAOYSA-N 2 2 314.437 1.340 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[NH2+][C@@]12CCC[C@@H]1[NH2+]CC2 ZINC000873229825 707778734 /nfs/dbraw/zinc/77/87/34/707778734.db2.gz HDTMPVKAESEIKT-ZWKOTPCHSA-N 2 2 301.434 1.897 20 10 DDCDLP [NH3+]C[C@]1(O)CCC[N@H+](Cc2cc(F)cc(Cl)c2O)CC1 ZINC001205248957 751349749 /nfs/dbraw/zinc/34/97/49/751349749.db2.gz UTGWIGJCKTWSFW-AWEZNQCLSA-N 2 2 302.777 1.860 20 10 DDCDLP [NH3+]C[C@]1(O)CCC[N@@H+](Cc2cc(F)cc(Cl)c2O)CC1 ZINC001205248957 751349755 /nfs/dbraw/zinc/34/97/55/751349755.db2.gz UTGWIGJCKTWSFW-AWEZNQCLSA-N 2 2 302.777 1.860 20 10 DDCDLP COc1cc(C[N@H+](C)CCC[NH+](C)C)cc(C[NH+](C)C)c1O ZINC001139253139 860337262 /nfs/dbraw/zinc/33/72/62/860337262.db2.gz NBSGVQFAVYVTKA-UHFFFAOYSA-N 3 2 309.454 1.846 20 10 DDCDLP COc1cc(C[N@@H+](C)CCC[NH+](C)C)cc(C[NH+](C)C)c1O ZINC001139253139 860337271 /nfs/dbraw/zinc/33/72/71/860337271.db2.gz NBSGVQFAVYVTKA-UHFFFAOYSA-N 3 2 309.454 1.846 20 10 DDCDLP C[NH+](C)CCCN1CC[NH+](Cc2cc(F)c(F)cc2O)CC1 ZINC001142524758 861170777 /nfs/dbraw/zinc/17/07/77/861170777.db2.gz JHANLGHNCDBOQS-UHFFFAOYSA-N 2 2 313.392 1.740 20 10 DDCDLP COc1ccc(N2CC[NH+](CC[C@H]3COC(C)(C)[NH2+]3)CC2)cc1 ZINC001204621972 871183120 /nfs/dbraw/zinc/18/31/20/871183120.db2.gz TVPCBUGZIPGYPY-HNNXBMFYSA-N 2 2 319.449 1.932 20 10 DDCDLP Oc1c(F)cc(Cl)cc1CN1CC[NH2+][C@H]2CC[NH2+]CC[C@@H]21 ZINC001222510678 880527484 /nfs/dbraw/zinc/52/74/84/880527484.db2.gz CQXMBOZTIJGNAM-KBPBESRZSA-N 2 2 313.804 1.711 20 10 DDCDLP CC[C@H]([NH2+]CCC[N@@H+]1CCC[C@@H]1C(N)=O)c1ccccc1O ZINC000274931884 130274485 /nfs/dbraw/zinc/27/44/85/130274485.db2.gz RBGRMQYXEJXTRI-LSDHHAIUSA-N 2 2 305.422 1.773 20 10 DDCDLP CC[C@H]([NH2+]CCC[N@H+]1CCC[C@@H]1C(N)=O)c1ccccc1O ZINC000274931884 130274488 /nfs/dbraw/zinc/27/44/88/130274488.db2.gz RBGRMQYXEJXTRI-LSDHHAIUSA-N 2 2 305.422 1.773 20 10 DDCDLP CCOc1cccc(C[N@@H+]2CC[C@H](C[NH+]3CCOCC3)C2)c1O ZINC000093664464 407201253 /nfs/dbraw/zinc/20/12/53/407201253.db2.gz PZRZIWJLQZOQFZ-OAHLLOKOSA-N 2 2 320.433 1.945 20 10 DDCDLP CCOc1cccc(C[N@H+]2CC[C@H](C[NH+]3CCOCC3)C2)c1O ZINC000093664464 407201255 /nfs/dbraw/zinc/20/12/55/407201255.db2.gz PZRZIWJLQZOQFZ-OAHLLOKOSA-N 2 2 320.433 1.945 20 10 DDCDLP COc1cc(O)c(C[N@@H+]2CC[C@@H]3CC[NH+](C)C[C@H]32)cc1OC ZINC000272352010 407881611 /nfs/dbraw/zinc/88/16/11/407881611.db2.gz YGHRAFLEJFFERA-GXTWGEPZSA-N 2 2 306.406 1.935 20 10 DDCDLP COc1cc(O)c(C[N@H+]2CC[C@@H]3CC[NH+](C)C[C@H]32)cc1OC ZINC000272352010 407881618 /nfs/dbraw/zinc/88/16/18/407881618.db2.gz YGHRAFLEJFFERA-GXTWGEPZSA-N 2 2 306.406 1.935 20 10 DDCDLP COc1cc(O)c(C[NH+]2CC[C@@H]3CC[N@H+](C)C[C@H]32)cc1OC ZINC000272352010 407881624 /nfs/dbraw/zinc/88/16/24/407881624.db2.gz YGHRAFLEJFFERA-GXTWGEPZSA-N 2 2 306.406 1.935 20 10 DDCDLP COc1cc(O)c(C[NH+]2CC[C@@H]3CC[N@@H+](C)C[C@H]32)cc1OC ZINC000272352010 407881630 /nfs/dbraw/zinc/88/16/30/407881630.db2.gz YGHRAFLEJFFERA-GXTWGEPZSA-N 2 2 306.406 1.935 20 10 DDCDLP COC(=O)C[N@H+](CCn1cc[nH+]c1)Cc1cc(Cl)ccc1O ZINC000270846880 408706306 /nfs/dbraw/zinc/70/63/06/408706306.db2.gz HBUQSDCQSGZGTR-UHFFFAOYSA-N 2 2 323.780 1.917 20 10 DDCDLP COC(=O)C[N@@H+](CCn1cc[nH+]c1)Cc1cc(Cl)ccc1O ZINC000270846880 408706310 /nfs/dbraw/zinc/70/63/10/408706310.db2.gz HBUQSDCQSGZGTR-UHFFFAOYSA-N 2 2 323.780 1.917 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H](C)C3C[NH2+]C3)cc2F)CC1 ZINC000817902315 702514453 /nfs/dbraw/zinc/51/44/53/702514453.db2.gz NNTKTSKCPLDFOV-AWEZNQCLSA-N 3 2 320.456 1.665 20 10 DDCDLP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1CC(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000846708875 703322204 /nfs/dbraw/zinc/32/22/04/703322204.db2.gz XAIFGJBMRFOYKO-ZBFHGGJFSA-N 2 2 318.465 1.523 20 10 DDCDLP C[C@@H]1C[C@@H]([NH3+])CC[N@H+]1CC(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000846708875 703322207 /nfs/dbraw/zinc/32/22/07/703322207.db2.gz XAIFGJBMRFOYKO-ZBFHGGJFSA-N 2 2 318.465 1.523 20 10 DDCDLP Cc1cc(O)c(C[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)cc1C ZINC000858224338 704681491 /nfs/dbraw/zinc/68/14/91/704681491.db2.gz CKPPFOVUSHINSR-HNNXBMFYSA-N 2 2 305.422 1.438 20 10 DDCDLP Cc1cc(O)c(C[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)cc1C ZINC000858224338 704681493 /nfs/dbraw/zinc/68/14/93/704681493.db2.gz CKPPFOVUSHINSR-HNNXBMFYSA-N 2 2 305.422 1.438 20 10 DDCDLP COc1c(O)c(C[N@@H+]2C[C@@H]3C[NH2+]C[C@]3(C)C2)ccc1[N+](=O)[O-] ZINC000873228169 707778078 /nfs/dbraw/zinc/77/80/78/707778078.db2.gz AMIFOWXXHHNFLT-XHDPSFHLSA-N 2 2 307.350 1.350 20 10 DDCDLP COc1c(O)c(C[N@H+]2C[C@@H]3C[NH2+]C[C@]3(C)C2)ccc1[N+](=O)[O-] ZINC000873228169 707778082 /nfs/dbraw/zinc/77/80/82/707778082.db2.gz AMIFOWXXHHNFLT-XHDPSFHLSA-N 2 2 307.350 1.350 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@@]34CCC[C@@H]3[NH2+]CC4)cc2)CC1 ZINC000873229816 707779082 /nfs/dbraw/zinc/77/90/82/707779082.db2.gz GKYJJLMDUDFTKF-RBUKOAKNSA-N 3 2 314.477 1.813 20 10 DDCDLP C[C@@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1c(O)cccc1F ZINC000886522985 708772541 /nfs/dbraw/zinc/77/25/41/708772541.db2.gz USYFFRDADYKDTK-GFCCVEGCSA-N 2 2 309.385 1.346 20 10 DDCDLP [NH3+]Cc1cc(=O)[nH]c(C[NH2+]Cc2ccc3c(c2)CCCO3)n1 ZINC000904379844 711849532 /nfs/dbraw/zinc/84/95/32/711849532.db2.gz DIUCPWVKMUQIQK-UHFFFAOYSA-N 2 2 300.362 1.256 20 10 DDCDLP C[C@H](C(=O)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)n1cc[nH+]c1 ZINC001327182072 861947892 /nfs/dbraw/zinc/94/78/92/861947892.db2.gz VXOIHQAUDHABHP-IUODEOHRSA-N 2 2 301.394 1.326 20 10 DDCDLP Cc1ccc(O)c(C[NH+]2CC3(CCN3CCn3cc[nH+]c3)C2)c1 ZINC001275311975 852972071 /nfs/dbraw/zinc/97/20/71/852972071.db2.gz WZZFNGUBCKOVLM-UHFFFAOYSA-N 2 2 312.417 1.857 20 10 DDCDLP C[C@H]1CC[C@H](C[NH3+])[N@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)C1 ZINC001205844695 871858860 /nfs/dbraw/zinc/85/88/60/871858860.db2.gz XUKXKJYOMQDHLB-SWLSCSKDSA-N 3 2 305.422 1.433 20 10 DDCDLP C[C@H]1CC[C@H](C[NH3+])[N@@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)C1 ZINC001205844695 871858877 /nfs/dbraw/zinc/85/88/77/871858877.db2.gz XUKXKJYOMQDHLB-SWLSCSKDSA-N 3 2 305.422 1.433 20 10 DDCDLP Oc1ccc(Cl)c(Cl)c1CN1CC[NH2+]C[C@@]12CC[NH2+]C2 ZINC001234992609 888316783 /nfs/dbraw/zinc/31/67/83/888316783.db2.gz SFODEZPQYHNPRQ-AWEZNQCLSA-N 2 2 316.232 1.836 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CCCC[NH2+]3)cc2)CC1 ZINC000841032220 702316853 /nfs/dbraw/zinc/31/68/53/702316853.db2.gz APDVIXKCLOEJON-QGZVFWFLSA-N 3 2 302.466 1.670 20 10 DDCDLP CC[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)CC[C@@H]1[NH3+] ZINC000843051048 702808452 /nfs/dbraw/zinc/80/84/52/702808452.db2.gz UFLQLAXAAAPHMU-PWSUYJOCSA-N 2 2 309.366 1.868 20 10 DDCDLP CC[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)CC[C@@H]1[NH3+] ZINC000843051048 702808453 /nfs/dbraw/zinc/80/84/53/702808453.db2.gz UFLQLAXAAAPHMU-PWSUYJOCSA-N 2 2 309.366 1.868 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@H]4CCC[C@@H](C3)N4)cc2)CC1 ZINC000843105420 702819867 /nfs/dbraw/zinc/81/98/67/702819867.db2.gz DOMLKZUGZAIVBN-HDICACEKSA-N 2 2 314.477 1.765 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@H]4CCC[C@@H](C3)N4)cc2)CC1 ZINC000843105420 702819870 /nfs/dbraw/zinc/81/98/70/702819870.db2.gz DOMLKZUGZAIVBN-HDICACEKSA-N 2 2 314.477 1.765 20 10 DDCDLP CC[C@@H]1C[N@H+](CC(=O)NCc2ccc(N(C)C)cc2)CC[C@H]1[NH3+] ZINC000844222860 702996182 /nfs/dbraw/zinc/99/61/82/702996182.db2.gz MWLABAUAUQJNKH-NVXWUHKLSA-N 2 2 318.465 1.428 20 10 DDCDLP CC[C@@H]1C[N@@H+](CC(=O)NCc2ccc(N(C)C)cc2)CC[C@H]1[NH3+] ZINC000844222860 702996183 /nfs/dbraw/zinc/99/61/83/702996183.db2.gz MWLABAUAUQJNKH-NVXWUHKLSA-N 2 2 318.465 1.428 20 10 DDCDLP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1cc(F)cc(F)c1O ZINC000883091722 707923823 /nfs/dbraw/zinc/92/38/23/707923823.db2.gz VFEMOBWEWKDRIK-LBPRGKRZSA-N 2 2 313.392 1.786 20 10 DDCDLP CN(C)c1ccc([C@H](CNC(=O)Cn2cc[nH+]c2)[NH+](C)C)cc1 ZINC000891247309 710140624 /nfs/dbraw/zinc/14/06/24/710140624.db2.gz IAEDDLGNIBGECN-INIZCTEOSA-N 2 2 315.421 1.368 20 10 DDCDLP C[NH+](C)CCN(CC[NH+](C)C)Cc1c(F)ccc(F)c1O ZINC001139684083 780362268 /nfs/dbraw/zinc/36/22/68/780362268.db2.gz QITJOLOWXUZGQY-UHFFFAOYSA-N 2 2 301.381 1.596 20 10 DDCDLP COc1ccc(C[NH2+]CCNC(=O)Cn2cc[nH+]c2)cc1C ZINC001153495895 863912542 /nfs/dbraw/zinc/91/25/42/863912542.db2.gz QQUDMYCHEYQTEZ-UHFFFAOYSA-N 2 2 302.378 1.106 20 10 DDCDLP CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@]12C[NH2+]C[C@@H]1CC[NH2+]2 ZINC001161135198 866396892 /nfs/dbraw/zinc/39/68/92/866396892.db2.gz VIEWMQWXZJHQFH-YJBOKZPZSA-N 2 2 316.449 1.053 20 10 DDCDLP [NH3+]C[C@]1(O)CCCC[N@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001205726527 871754238 /nfs/dbraw/zinc/75/42/38/871754238.db2.gz UEZXCZKCJCUEIF-CQSZACIVSA-N 2 2 302.777 1.860 20 10 DDCDLP [NH3+]C[C@]1(O)CCCC[N@@H+](Cc2cc(F)c(Cl)cc2O)C1 ZINC001205726527 871754246 /nfs/dbraw/zinc/75/42/46/871754246.db2.gz UEZXCZKCJCUEIF-CQSZACIVSA-N 2 2 302.777 1.860 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H]([NH3+])[C@@H](F)CC3)cc2)CC1 ZINC001206174000 872111432 /nfs/dbraw/zinc/11/14/32/872111432.db2.gz LCORGOOVXFOCLB-ZWKOTPCHSA-N 3 2 320.456 1.700 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H]([NH3+])[C@@H](F)CC3)cc2)CC1 ZINC001206174000 872111437 /nfs/dbraw/zinc/11/14/37/872111437.db2.gz LCORGOOVXFOCLB-ZWKOTPCHSA-N 3 2 320.456 1.700 20 10 DDCDLP COc1ccc([NH+]2CCC(N(C)C(=O)CCC[NH3+])CC2)cc1 ZINC000378206780 418719860 /nfs/dbraw/zinc/71/98/60/418719860.db2.gz APHYGERWMSVWJY-UHFFFAOYSA-N 2 2 305.422 1.861 20 10 DDCDLP C[C@H]1C[C@@H]([NH2+]CC(=O)N2CC[NH+](C)CC2)c2c1c(F)ccc2O ZINC000756491637 700623970 /nfs/dbraw/zinc/62/39/70/700623970.db2.gz WUSXHKXHBRFAAJ-WCQYABFASA-N 2 2 321.396 1.443 20 10 DDCDLP Cc1cc(N(C)C)ccc1C[N@H+]1C[C@@H](c2cnn(C)c2)[C@H]([NH3+])C1 ZINC000818431534 702647802 /nfs/dbraw/zinc/64/78/02/702647802.db2.gz PBPYGRWWYFRDRW-ZWKOTPCHSA-N 2 2 313.449 1.721 20 10 DDCDLP Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@@H](c2cnn(C)c2)[C@H]([NH3+])C1 ZINC000818431534 702647804 /nfs/dbraw/zinc/64/78/04/702647804.db2.gz PBPYGRWWYFRDRW-ZWKOTPCHSA-N 2 2 313.449 1.721 20 10 DDCDLP Cc1ccc(O)c(C[N@@H+]2CCC[C@@H](N3CC[NH2+]CC3=O)C2)c1 ZINC000843065908 702812052 /nfs/dbraw/zinc/81/20/52/702812052.db2.gz RENKYLIZNAFBEQ-OAHLLOKOSA-N 2 2 303.406 1.097 20 10 DDCDLP Cc1ccc(O)c(C[N@H+]2CCC[C@@H](N3CC[NH2+]CC3=O)C2)c1 ZINC000843065908 702812054 /nfs/dbraw/zinc/81/20/54/702812054.db2.gz RENKYLIZNAFBEQ-OAHLLOKOSA-N 2 2 303.406 1.097 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)ccc1[N+](=O)[O-] ZINC000843119357 702822936 /nfs/dbraw/zinc/82/29/36/702822936.db2.gz ZNBKVTVPFTXBDW-INIZCTEOSA-N 2 2 321.377 1.885 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@@]3(C2)CCC[NH2+]C3)ccc1[N+](=O)[O-] ZINC000843119357 702822939 /nfs/dbraw/zinc/82/29/39/702822939.db2.gz ZNBKVTVPFTXBDW-INIZCTEOSA-N 2 2 321.377 1.885 20 10 DDCDLP CCN(CC)c1ccc(CN2CC[N@H+](C)C[C@@H]2C[NH3+])cc1F ZINC000843120761 702823249 /nfs/dbraw/zinc/82/32/49/702823249.db2.gz UHKGQCWCSOMZFA-HNNXBMFYSA-N 2 2 308.445 1.747 20 10 DDCDLP CCN(CC)c1ccc(CN2CC[N@@H+](C)C[C@@H]2C[NH3+])cc1F ZINC000843120761 702823252 /nfs/dbraw/zinc/82/32/52/702823252.db2.gz UHKGQCWCSOMZFA-HNNXBMFYSA-N 2 2 308.445 1.747 20 10 DDCDLP C[C@@H]1C[N@H+](C)C[C@H]1NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000898451538 708644579 /nfs/dbraw/zinc/64/45/79/708644579.db2.gz ZJXHLIBEBUKSOX-OLMNPRSZSA-N 2 2 304.482 1.895 20 10 DDCDLP C[C@@H]1C[N@@H+](C)C[C@H]1NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000898451538 708644582 /nfs/dbraw/zinc/64/45/82/708644582.db2.gz ZJXHLIBEBUKSOX-OLMNPRSZSA-N 2 2 304.482 1.895 20 10 DDCDLP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC[C@@H]1[NH3+] ZINC001118241808 781073334 /nfs/dbraw/zinc/07/33/34/781073334.db2.gz OKXWSDSKJYDIQH-YOEHRIQHSA-N 3 2 320.456 1.747 20 10 DDCDLP C[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC[C@@H]1[NH3+] ZINC001118241808 781073339 /nfs/dbraw/zinc/07/33/39/781073339.db2.gz OKXWSDSKJYDIQH-YOEHRIQHSA-N 3 2 320.456 1.747 20 10 DDCDLP C[C@H]1CN(Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC[C@@H]1[NH3+] ZINC001118241808 781073345 /nfs/dbraw/zinc/07/33/45/781073345.db2.gz OKXWSDSKJYDIQH-YOEHRIQHSA-N 2 2 320.456 1.747 20 10 DDCDLP CCOC(=O)C1C[NH+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139256497 860338678 /nfs/dbraw/zinc/33/86/78/860338678.db2.gz DLVULBJBNQLBKU-UHFFFAOYSA-N 2 2 322.405 1.457 20 10 DDCDLP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2NC(=O)[C@H]1C[NH2+]C[C@@H]1[NH3+] ZINC001157434657 863819539 /nfs/dbraw/zinc/81/95/39/863819539.db2.gz PZPDBKCWWFAOFG-XEZPLFJOSA-N 2 2 317.433 1.295 20 10 DDCDLP COc1ccc(C[N@@H+]2CCCC[C@@](O)(C[NH3+])C2)c(O)c1Cl ZINC001205726569 871752028 /nfs/dbraw/zinc/75/20/28/871752028.db2.gz VAURWQFDFFDDDT-OAHLLOKOSA-N 2 2 314.813 1.730 20 10 DDCDLP COc1ccc(C[N@H+]2CCCC[C@@](O)(C[NH3+])C2)c(O)c1Cl ZINC001205726569 871752033 /nfs/dbraw/zinc/75/20/33/871752033.db2.gz VAURWQFDFFDDDT-OAHLLOKOSA-N 2 2 314.813 1.730 20 10 DDCDLP Oc1c(CN2CC[NH2+]C[C@]23CC[NH2+]C3)cccc1C(F)(F)F ZINC001234992726 888316051 /nfs/dbraw/zinc/31/60/51/888316051.db2.gz SPLSJKKLVAUZLO-CQSZACIVSA-N 2 2 315.339 1.548 20 10 DDCDLP COc1ccc(O)c([C@@H](C)[NH2+]CCC[N@@H+]2CCC[C@@H]2C(N)=O)c1 ZINC000273595864 130142214 /nfs/dbraw/zinc/14/22/14/130142214.db2.gz QMQCBQWYDVPPNF-IUODEOHRSA-N 2 2 321.421 1.391 20 10 DDCDLP COc1ccc(O)c([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@@H]2C(N)=O)c1 ZINC000273595864 130142217 /nfs/dbraw/zinc/14/22/17/130142217.db2.gz QMQCBQWYDVPPNF-IUODEOHRSA-N 2 2 321.421 1.391 20 10 DDCDLP CC1(C)[NH2+]CC[C@@H]1[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000841085561 702340275 /nfs/dbraw/zinc/34/02/75/702340275.db2.gz HEYSJIQQYASHHJ-INIZCTEOSA-N 2 2 307.413 1.892 20 10 DDCDLP COc1cc(Br)cc(C[N@H+](C)C[C@@H](C)[NH3+])c1O ZINC000863653324 705977164 /nfs/dbraw/zinc/97/71/64/705977164.db2.gz HWEBGYLIFLBVSR-MRVPVSSYSA-N 2 2 303.200 1.942 20 10 DDCDLP COc1cc(Br)cc(C[N@@H+](C)C[C@@H](C)[NH3+])c1O ZINC000863653324 705977165 /nfs/dbraw/zinc/97/71/65/705977165.db2.gz HWEBGYLIFLBVSR-MRVPVSSYSA-N 2 2 303.200 1.942 20 10 DDCDLP COc1ccc(N2CC[C@@H](C[NH2+][C@@H]3C[NH2+]CCOC3)C2)cc1 ZINC000925706329 714918371 /nfs/dbraw/zinc/91/83/71/714918371.db2.gz NKHVHWZKABGIGE-LSDHHAIUSA-N 2 2 305.422 1.100 20 10 DDCDLP COc1cc(C[NH+]2CCOCC2)ccc1N(C)C(C)(C)C[NH3+] ZINC001170060273 764466813 /nfs/dbraw/zinc/46/68/13/764466813.db2.gz MRHISLZQTXAMSP-UHFFFAOYSA-N 2 2 307.438 1.701 20 10 DDCDLP Cc1cc(C[NH+]2CC(N3CC[NH+](C)CC3)C2)ccc1N(C)C ZINC001139673964 860450116 /nfs/dbraw/zinc/45/01/16/860450116.db2.gz OJGIVLFQYOLTSS-UHFFFAOYSA-N 2 2 302.466 1.493 20 10 DDCDLP CC[NH+]1CCN(c2ccc(O[C@@H]3C[NH2+]CC3(F)F)cc2)CC1 ZINC001218236161 877434298 /nfs/dbraw/zinc/43/42/98/877434298.db2.gz HBTGHMCGSZUWTE-OAHLLOKOSA-N 2 2 311.376 1.814 20 10 DDCDLP COc1ccc(CN2CC[NH2+]C[C@@]23CC[NH2+]C3)c(O)c1Cl ZINC001234993848 888320536 /nfs/dbraw/zinc/32/05/36/888320536.db2.gz WHJILAKXXQOVBX-HNNXBMFYSA-N 2 2 311.813 1.192 20 10 DDCDLP CCC[N@H+](CC(=O)N1CC[NH+](C)CC1)Cc1ccccc1O ZINC000093177556 696599473 /nfs/dbraw/zinc/59/94/73/696599473.db2.gz IELXRXYOBAHZCF-UHFFFAOYSA-N 2 2 305.422 1.378 20 10 DDCDLP CCC[N@@H+](CC(=O)N1CC[NH+](C)CC1)Cc1ccccc1O ZINC000093177556 696599474 /nfs/dbraw/zinc/59/94/74/696599474.db2.gz IELXRXYOBAHZCF-UHFFFAOYSA-N 2 2 305.422 1.378 20 10 DDCDLP CC[NH+]1CCN(C(=O)[C@H](C)[N@H+](C)Cc2ccccc2O)CC1 ZINC000111235941 696643023 /nfs/dbraw/zinc/64/30/23/696643023.db2.gz QOPBUFABRRWRJD-AWEZNQCLSA-N 2 2 305.422 1.377 20 10 DDCDLP CC[NH+]1CCN(C(=O)[C@H](C)[N@@H+](C)Cc2ccccc2O)CC1 ZINC000111235941 696643024 /nfs/dbraw/zinc/64/30/24/696643024.db2.gz QOPBUFABRRWRJD-AWEZNQCLSA-N 2 2 305.422 1.377 20 10 DDCDLP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1CC(=O)NCc1ccc(N(C)C)cc1 ZINC000846708177 703321809 /nfs/dbraw/zinc/32/18/09/703321809.db2.gz MRKFRXBANOUAJL-ZFWWWQNUSA-N 2 2 304.438 1.180 20 10 DDCDLP C[C@H]1C[C@@H]([NH3+])CC[N@H+]1CC(=O)NCc1ccc(N(C)C)cc1 ZINC000846708177 703321812 /nfs/dbraw/zinc/32/18/12/703321812.db2.gz MRKFRXBANOUAJL-ZFWWWQNUSA-N 2 2 304.438 1.180 20 10 DDCDLP CC[NH+]1CCN([C@@H](C)C[NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC000882890322 707839468 /nfs/dbraw/zinc/83/94/68/707839468.db2.gz VIUIKTBGNBURTL-LBPRGKRZSA-N 2 2 313.392 1.786 20 10 DDCDLP Cc1nc(NC[C@H](c2ccc(N(C)C)cc2)[NH+](C)C)nc(N)[nH+]1 ZINC000897521463 708361985 /nfs/dbraw/zinc/36/19/85/708361985.db2.gz GQVZGZHDTNRMSU-CQSZACIVSA-N 2 2 315.425 1.543 20 10 DDCDLP Cc1ccc(C[NH+]2CC3(CN(CCn4cc[nH+]c4)C3)C2)c(O)c1 ZINC001276168829 854873077 /nfs/dbraw/zinc/87/30/77/854873077.db2.gz IYMUTGAFNUMTOH-UHFFFAOYSA-N 2 2 312.417 1.715 20 10 DDCDLP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C1CC([NH3+])C1 ZINC001328414111 862959726 /nfs/dbraw/zinc/95/97/26/862959726.db2.gz ZWVLXUCAJAPZLE-UHFFFAOYSA-N 3 2 306.429 1.499 20 10 DDCDLP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C1CC([NH3+])C1 ZINC001328414111 862959734 /nfs/dbraw/zinc/95/97/34/862959734.db2.gz ZWVLXUCAJAPZLE-UHFFFAOYSA-N 3 2 306.429 1.499 20 10 DDCDLP CN1CCN(c2ccc(C[N@H+](C)C3CC([NH3+])C3)cc2F)CC1 ZINC001328414111 862959741 /nfs/dbraw/zinc/95/97/41/862959741.db2.gz ZWVLXUCAJAPZLE-UHFFFAOYSA-N 2 2 306.429 1.499 20 10 DDCDLP CN1CCN(c2ccc(C[N@@H+](C)C3CC([NH3+])C3)cc2F)CC1 ZINC001328414111 862959747 /nfs/dbraw/zinc/95/97/47/862959747.db2.gz ZWVLXUCAJAPZLE-UHFFFAOYSA-N 2 2 306.429 1.499 20 10 DDCDLP COc1cc(C[N@@H+]2CC[C@](F)(CO)C2)cc(C[NH+](C)C)c1O ZINC001139253381 860337473 /nfs/dbraw/zinc/33/74/73/860337473.db2.gz SWSITPRRXSGFOW-MRXNPFEDSA-N 2 2 312.385 1.369 20 10 DDCDLP COc1cc(C[N@H+]2CC[C@](F)(CO)C2)cc(C[NH+](C)C)c1O ZINC001139253381 860337481 /nfs/dbraw/zinc/33/74/81/860337481.db2.gz SWSITPRRXSGFOW-MRXNPFEDSA-N 2 2 312.385 1.369 20 10 DDCDLP C[NH2+]CCC[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001345104231 873258194 /nfs/dbraw/zinc/25/81/94/873258194.db2.gz LVLDVEHPBBROAN-UHFFFAOYSA-N 3 2 308.445 1.619 20 10 DDCDLP C[NH2+]CCC[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001345104231 873258202 /nfs/dbraw/zinc/25/82/02/873258202.db2.gz LVLDVEHPBBROAN-UHFFFAOYSA-N 3 2 308.445 1.619 20 10 DDCDLP CC[N@@H+]1CCO[C@@H]2C[NH+](Cc3cc(F)cc(C)c3O)C[C@@H]2C1 ZINC001238061190 890006625 /nfs/dbraw/zinc/00/66/25/890006625.db2.gz NQRNOYPIGQCSRY-GOEBONIOSA-N 2 2 308.397 1.992 20 10 DDCDLP CC[N@H+]1CCO[C@@H]2C[NH+](Cc3cc(F)cc(C)c3O)C[C@@H]2C1 ZINC001238061190 890006641 /nfs/dbraw/zinc/00/66/41/890006641.db2.gz NQRNOYPIGQCSRY-GOEBONIOSA-N 2 2 308.397 1.992 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@H+](Cc3cc(F)cc(C)c3O)C[C@@H]2C1 ZINC001238061190 890006656 /nfs/dbraw/zinc/00/66/56/890006656.db2.gz NQRNOYPIGQCSRY-GOEBONIOSA-N 2 2 308.397 1.992 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@@H+](Cc3cc(F)cc(C)c3O)C[C@@H]2C1 ZINC001238061190 890006674 /nfs/dbraw/zinc/00/66/74/890006674.db2.gz NQRNOYPIGQCSRY-GOEBONIOSA-N 2 2 308.397 1.992 20 10 DDCDLP COCC[NH+](CCOC)C1CC[NH+](Cc2ccccc2O)CC1 ZINC000289181605 131363443 /nfs/dbraw/zinc/36/34/43/131363443.db2.gz AIRJLYLMXGCHEP-UHFFFAOYSA-N 2 2 322.449 1.951 20 10 DDCDLP COCC[N@H+](C)CC[NH2+]Cc1cc(Br)ccc1O ZINC000227874103 222206128 /nfs/dbraw/zinc/20/61/28/222206128.db2.gz JTFHFDQKIQHUSZ-UHFFFAOYSA-N 2 2 317.227 1.823 20 10 DDCDLP COCC[N@@H+](C)CC[NH2+]Cc1cc(Br)ccc1O ZINC000227874103 222206131 /nfs/dbraw/zinc/20/61/31/222206131.db2.gz JTFHFDQKIQHUSZ-UHFFFAOYSA-N 2 2 317.227 1.823 20 10 DDCDLP COc1ccc([NH+]2CCC(N(C)C(=O)C3([NH3+])CC3)CC2)cc1 ZINC000370768118 418748037 /nfs/dbraw/zinc/74/80/37/418748037.db2.gz YFAOSJIIVNPPPV-UHFFFAOYSA-N 2 2 303.406 1.614 20 10 DDCDLP Cn1cc[nH+]c1[C@H]1CC[N@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000372886505 418912246 /nfs/dbraw/zinc/91/22/46/418912246.db2.gz YBTLSHZSGXQKPH-NSHDSACASA-N 2 2 301.346 1.844 20 10 DDCDLP Cn1cc[nH+]c1[C@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000372886505 418912248 /nfs/dbraw/zinc/91/22/48/418912248.db2.gz YBTLSHZSGXQKPH-NSHDSACASA-N 2 2 301.346 1.844 20 10 DDCDLP C[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(F)c(F)c1O ZINC000191188523 525338386 /nfs/dbraw/zinc/33/83/86/525338386.db2.gz LQNJUJARZBTLRJ-LBPRGKRZSA-N 2 2 313.392 1.959 20 10 DDCDLP Cc1cc(Br)c(O)c(C[NH2+]C[C@@H]2C[NH2+]CCO2)c1 ZINC000841098127 702344642 /nfs/dbraw/zinc/34/46/42/702344642.db2.gz CWISKQIDMALPOX-NSHDSACASA-N 2 2 315.211 1.541 20 10 DDCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CCC(=O)NC2(C)C)cc1 ZINC000817942527 702531376 /nfs/dbraw/zinc/53/13/76/702531376.db2.gz PKAKFNIKVVHFLN-HUUCEWRRSA-N 2 2 304.438 1.399 20 10 DDCDLP COc1ccc(N2CC[NH+](C[C@]3(C)CC[NH2+]C3)CC2)cc1F ZINC000843119380 702823058 /nfs/dbraw/zinc/82/30/58/702823058.db2.gz KXAQBZBVNDFTQP-QGZVFWFLSA-N 2 2 307.413 1.956 20 10 DDCDLP COc1ccc(N2CC[NH+](C[C@@H]3CCC[NH2+]C3)CC2)c(OC)c1 ZINC000866697240 706767629 /nfs/dbraw/zinc/76/76/29/706767629.db2.gz KDJZNIXOGRRJSP-OAHLLOKOSA-N 2 2 319.449 1.825 20 10 DDCDLP CCOc1ccc(C[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)c(O)c1 ZINC000858224396 704681345 /nfs/dbraw/zinc/68/13/45/704681345.db2.gz FANYPXWCUYWQLZ-HNNXBMFYSA-N 2 2 321.421 1.220 20 10 DDCDLP CCOc1ccc(C[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c(O)c1 ZINC000858224396 704681346 /nfs/dbraw/zinc/68/13/46/704681346.db2.gz FANYPXWCUYWQLZ-HNNXBMFYSA-N 2 2 321.421 1.220 20 10 DDCDLP C[C@H]1CC[C@H]([NH2+]Cc2ccc(N3CCOCC3)c(F)c2)C[NH2+]1 ZINC000863485152 705938843 /nfs/dbraw/zinc/93/88/43/705938843.db2.gz VMEQCBHVTKRZCU-ZFWWWQNUSA-N 2 2 307.413 1.892 20 10 DDCDLP C[C@@H]1[NH2+]CCC[C@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000925715712 714920106 /nfs/dbraw/zinc/92/01/06/714920106.db2.gz LJMCZFITAARURJ-KBXCAEBGSA-N 2 2 303.450 1.878 20 10 DDCDLP CN1CCOc2cc(C[N@@H+]3CCC(F)(F)[C@@H](C[NH3+])C3)ccc21 ZINC001205779195 871802678 /nfs/dbraw/zinc/80/26/78/871802678.db2.gz KHBGYSKUMROQJB-ZDUSSCGKSA-N 2 2 311.376 1.931 20 10 DDCDLP CN1CCOc2cc(C[N@H+]3CCC(F)(F)[C@@H](C[NH3+])C3)ccc21 ZINC001205779195 871802700 /nfs/dbraw/zinc/80/27/00/871802700.db2.gz KHBGYSKUMROQJB-ZDUSSCGKSA-N 2 2 311.376 1.931 20 10 DDCDLP CCOc1ccc(C[N@@H+]2CCN[C@H]3CC[NH2+]CC[C@@H]32)c(O)c1 ZINC001222510695 880526835 /nfs/dbraw/zinc/52/68/35/880526835.db2.gz DMYRJMZZHQCDPU-HOTGVXAUSA-N 2 2 305.422 1.317 20 10 DDCDLP CCOc1ccc(C[N@H+]2CCN[C@H]3CC[NH2+]CC[C@@H]32)c(O)c1 ZINC001222510695 880526842 /nfs/dbraw/zinc/52/68/42/880526842.db2.gz DMYRJMZZHQCDPU-HOTGVXAUSA-N 2 2 305.422 1.317 20 10 DDCDLP CCOc1ccc(CN2CC[NH2+][C@H]3CC[NH2+]CC[C@@H]32)c(O)c1 ZINC001222510695 880526848 /nfs/dbraw/zinc/52/68/48/880526848.db2.gz DMYRJMZZHQCDPU-HOTGVXAUSA-N 2 2 305.422 1.317 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H]4CC[C@]4([NH3+])C3)cc2)CC1 ZINC001235995910 889051740 /nfs/dbraw/zinc/05/17/40/889051740.db2.gz ROLSDVIQPMOADD-WMZOPIPTSA-N 3 2 300.450 1.362 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H]4CC[C@]4([NH3+])C3)cc2)CC1 ZINC001235995910 889051749 /nfs/dbraw/zinc/05/17/49/889051749.db2.gz ROLSDVIQPMOADD-WMZOPIPTSA-N 3 2 300.450 1.362 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH+]3CCN(C4CC4)CC3)cc2)CC1 ZINC000775648943 698019048 /nfs/dbraw/zinc/01/90/48/698019048.db2.gz JIOYWHKIXJZZFG-UHFFFAOYSA-N 2 2 314.477 1.718 20 10 DDCDLP C[C@@H]1[NH2+]CCC[C@@H]1[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000841066268 702333190 /nfs/dbraw/zinc/33/31/90/702333190.db2.gz YZBKBARRPDEBGC-BBRMVZONSA-N 2 2 307.413 1.892 20 10 DDCDLP Cc1cc(Br)c(O)c(C[N@H+](C)C[C@H](O)C[NH3+])c1 ZINC000841094384 702344166 /nfs/dbraw/zinc/34/41/66/702344166.db2.gz XIQNDCNJNBVZAB-SNVBAGLBSA-N 2 2 303.200 1.215 20 10 DDCDLP Cc1cc(Br)c(O)c(C[N@@H+](C)C[C@H](O)C[NH3+])c1 ZINC000841094384 702344173 /nfs/dbraw/zinc/34/41/73/702344173.db2.gz XIQNDCNJNBVZAB-SNVBAGLBSA-N 2 2 303.200 1.215 20 10 DDCDLP Oc1ccc(Br)cc1C[NH2+]C[C@H]1C[NH2+]CCO1 ZINC000841098515 702345017 /nfs/dbraw/zinc/34/50/17/702345017.db2.gz HHEXQRIRUZGQHP-LLVKDONJSA-N 2 2 301.184 1.233 20 10 DDCDLP C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000843044056 702807305 /nfs/dbraw/zinc/80/73/05/702807305.db2.gz BQULWZMRLYYHCA-NSHDSACASA-N 2 2 309.366 1.740 20 10 DDCDLP C[NH2+]C[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000843044056 702807308 /nfs/dbraw/zinc/80/73/08/702807308.db2.gz BQULWZMRLYYHCA-NSHDSACASA-N 2 2 309.366 1.740 20 10 DDCDLP C[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)cc1)[C@H]1CCC[NH2+]1 ZINC000854230571 704368965 /nfs/dbraw/zinc/36/89/65/704368965.db2.gz UXCTYALZGDRYMB-KBXCAEBGSA-N 2 2 303.450 1.878 20 10 DDCDLP COC(=O)[C@]12C[C@H]([NH3+])C[C@H]1C[N@H+](Cc1cccc(Cl)c1O)C2 ZINC000903976843 711354427 /nfs/dbraw/zinc/35/44/27/711354427.db2.gz DGLRGRGTELBVCN-OZVIIMIRSA-N 2 2 324.808 1.758 20 10 DDCDLP COC(=O)[C@]12C[C@H]([NH3+])C[C@H]1C[N@@H+](Cc1cccc(Cl)c1O)C2 ZINC000903976843 711354433 /nfs/dbraw/zinc/35/44/33/711354433.db2.gz DGLRGRGTELBVCN-OZVIIMIRSA-N 2 2 324.808 1.758 20 10 DDCDLP Cc1cccc(C[NH+]2CC3(CCN3CCn3cc[nH+]c3)C2)c1O ZINC001276080999 854715525 /nfs/dbraw/zinc/71/55/25/854715525.db2.gz ZJGMROHDUXPAJK-UHFFFAOYSA-N 2 2 312.417 1.857 20 10 DDCDLP CCC[N@H+](CC(N)=O)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001330213899 864162802 /nfs/dbraw/zinc/16/28/02/864162802.db2.gz SYNGOMHZWILFQO-UHFFFAOYSA-N 2 2 322.428 1.275 20 10 DDCDLP CCC[N@@H+](CC(N)=O)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001330213899 864162813 /nfs/dbraw/zinc/16/28/13/864162813.db2.gz SYNGOMHZWILFQO-UHFFFAOYSA-N 2 2 322.428 1.275 20 10 DDCDLP COc1ccc(C[NH2+]C[C@H]2C[N@@H+]3CCC[C@H]3CO2)c(O)c1OC ZINC001334168157 867348749 /nfs/dbraw/zinc/34/87/49/867348749.db2.gz JHQKOOQHZYCBKD-KBPBESRZSA-N 2 2 322.405 1.362 20 10 DDCDLP COc1ccc(C[NH2+]C[C@H]2C[N@H+]3CCC[C@H]3CO2)c(O)c1OC ZINC001334168157 867348758 /nfs/dbraw/zinc/34/87/58/867348758.db2.gz JHQKOOQHZYCBKD-KBPBESRZSA-N 2 2 322.405 1.362 20 10 DDCDLP COCC[N@H+](Cc1cccc(OC)c1O)C1CC[NH+](C)CC1 ZINC001203595990 870658121 /nfs/dbraw/zinc/65/81/21/870658121.db2.gz WUEOYPIFKCTGDY-UHFFFAOYSA-N 2 2 308.422 1.943 20 10 DDCDLP COCC[N@@H+](Cc1cccc(OC)c1O)C1CC[NH+](C)CC1 ZINC001203595990 870658125 /nfs/dbraw/zinc/65/81/25/870658125.db2.gz WUEOYPIFKCTGDY-UHFFFAOYSA-N 2 2 308.422 1.943 20 10 DDCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@H](C)[C@H](C)O)CC2)cc1 ZINC001345604838 873452500 /nfs/dbraw/zinc/45/25/00/873452500.db2.gz GHAPCYHXXLYPCF-CVEARBPZSA-N 2 2 321.465 1.566 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC001222427653 880459068 /nfs/dbraw/zinc/45/90/68/880459068.db2.gz VWMOYPQMCBQLRV-LJQANCHMSA-N 3 2 314.477 1.814 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CC[C@@]2(C1)CCCC[NH2+]2 ZINC001222427653 880459082 /nfs/dbraw/zinc/45/90/82/880459082.db2.gz VWMOYPQMCBQLRV-LJQANCHMSA-N 3 2 314.477 1.814 20 10 DDCDLP Cc1ccc([C@H](C)[NH2+]CCC[N@H+]2CCC[C@@H]2C(N)=O)c(O)c1 ZINC000273361783 130110833 /nfs/dbraw/zinc/11/08/33/130110833.db2.gz ANHPEEPJKHMFJR-DZGCQCFKSA-N 2 2 305.422 1.691 20 10 DDCDLP COc1c(O)c(C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000775029042 697956160 /nfs/dbraw/zinc/95/61/60/697956160.db2.gz JIHLFTDLPWOSGS-CMPLNLGQSA-N 2 2 309.366 1.881 20 10 DDCDLP COc1c(O)c(C[NH2+][C@@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000775029042 697956163 /nfs/dbraw/zinc/95/61/63/697956163.db2.gz JIHLFTDLPWOSGS-CMPLNLGQSA-N 2 2 309.366 1.881 20 10 DDCDLP COc1cc(Br)cc(C[N@H+](C)C[C@H](C)[NH3+])c1O ZINC000863653325 705977126 /nfs/dbraw/zinc/97/71/26/705977126.db2.gz HWEBGYLIFLBVSR-QMMMGPOBSA-N 2 2 303.200 1.942 20 10 DDCDLP COc1cc(Br)cc(C[N@@H+](C)C[C@H](C)[NH3+])c1O ZINC000863653325 705977128 /nfs/dbraw/zinc/97/71/28/705977128.db2.gz HWEBGYLIFLBVSR-QMMMGPOBSA-N 2 2 303.200 1.942 20 10 DDCDLP Oc1c(F)cc(Cl)cc1C[NH2+]CCCN1CC[NH2+]CC1 ZINC000841028448 702316022 /nfs/dbraw/zinc/31/60/22/702316022.db2.gz GCFCFVSGEGHBNR-UHFFFAOYSA-N 2 2 301.793 1.570 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[NH2+]C34CCC4)cc2)CC1 ZINC000863482826 705938437 /nfs/dbraw/zinc/93/84/37/705938437.db2.gz LZDLZNHYRDQZCH-GOSISDBHSA-N 3 2 314.477 1.813 20 10 DDCDLP C[NH+]1CCN(C(C)(C)C[NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC000882886592 707838113 /nfs/dbraw/zinc/83/81/13/707838113.db2.gz BZXIINPRNCKPSC-UHFFFAOYSA-N 2 2 313.392 1.786 20 10 DDCDLP C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000911667251 710916863 /nfs/dbraw/zinc/91/68/63/710916863.db2.gz PARXFBNWGNJZCJ-WBMJQRKESA-N 2 2 315.421 1.471 20 10 DDCDLP C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000911667251 710916865 /nfs/dbraw/zinc/91/68/65/710916865.db2.gz PARXFBNWGNJZCJ-WBMJQRKESA-N 2 2 315.421 1.471 20 10 DDCDLP Oc1cc2c(cc1C[NH2+][C@H]1C[NH2+]CC3(CCOCC3)C1)OCO2 ZINC000903973841 711353652 /nfs/dbraw/zinc/35/36/52/711353652.db2.gz IZHVPPWOTASPLR-CYBMUJFWSA-N 2 2 320.389 1.369 20 10 DDCDLP CN(C)c1ccc(C[NH2+]C[C@H]2C[N@@H+]3CCC[C@@H]3CO2)cc1F ZINC001200269512 748182864 /nfs/dbraw/zinc/18/28/64/748182864.db2.gz XHNVAXLKNOQTFN-CABCVRRESA-N 2 2 307.413 1.845 20 10 DDCDLP CN(C)c1ccc(C[NH2+]C[C@H]2C[N@H+]3CCC[C@@H]3CO2)cc1F ZINC001200269512 748182871 /nfs/dbraw/zinc/18/28/71/748182871.db2.gz XHNVAXLKNOQTFN-CABCVRRESA-N 2 2 307.413 1.845 20 10 DDCDLP C[C@H]([NH3+])[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001326232933 861217703 /nfs/dbraw/zinc/21/77/03/861217703.db2.gz UGHATQCCATWMTH-HOCLYGCPSA-N 3 2 320.456 1.747 20 10 DDCDLP CN1CCCc2cc(C[NH+]3CC(N4CC[NH+](C)CC4)C3)ccc21 ZINC001138359310 860073185 /nfs/dbraw/zinc/07/31/85/860073185.db2.gz QXHGBWTVBZBJEY-UHFFFAOYSA-N 2 2 314.477 1.501 20 10 DDCDLP COc1ccc(C[NH2+]C[C@H]2C[N@@H+]3CCC[C@@H]3CO2)c(O)c1OC ZINC001334168159 867348590 /nfs/dbraw/zinc/34/85/90/867348590.db2.gz JHQKOOQHZYCBKD-KGLIPLIRSA-N 2 2 322.405 1.362 20 10 DDCDLP COc1ccc(C[NH2+]C[C@H]2C[N@H+]3CCC[C@@H]3CO2)c(O)c1OC ZINC001334168159 867348605 /nfs/dbraw/zinc/34/86/05/867348605.db2.gz JHQKOOQHZYCBKD-KGLIPLIRSA-N 2 2 322.405 1.362 20 10 DDCDLP CN(C)C1=[NH+]OC2(C1)CC[NH+](Cc1ccc(O)c(O)c1)CC2 ZINC001203877635 870813119 /nfs/dbraw/zinc/81/31/19/870813119.db2.gz VEKBWDUABMUKER-UHFFFAOYSA-N 2 2 305.378 1.728 20 10 DDCDLP Nc1ccc(N(Cc2ccccc2)C(=O)[C@H]2C[NH2+]C[C@@H]2[NH3+])cc1 ZINC001218956499 877834036 /nfs/dbraw/zinc/83/40/36/877834036.db2.gz YFNYFXFTRCTMTE-IRXDYDNUSA-N 2 2 310.401 1.349 20 10 DDCDLP CN(C)c1ccc(C[NH+]2CC(N3CC[NH2+]CC3)C2)c(Cl)c1 ZINC001236160214 889119971 /nfs/dbraw/zinc/11/99/71/889119971.db2.gz JZUMIKKUMKHXKZ-UHFFFAOYSA-N 2 2 308.857 1.495 20 10 DDCDLP C[C@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1ccc(F)c(F)c1O ZINC000276851254 299283761 /nfs/dbraw/zinc/28/37/61/299283761.db2.gz AZXQQEOLFUXHTF-JTQLQIEISA-N 2 2 300.349 1.778 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@@H+]1CCC[C@H]1C(N)=O)c1cc(F)ccc1O ZINC000273556279 287024907 /nfs/dbraw/zinc/02/49/07/287024907.db2.gz GXEXSSXGELUVKY-RISCZKNCSA-N 2 2 309.385 1.522 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@H]1C(N)=O)c1cc(F)ccc1O ZINC000273556279 287024908 /nfs/dbraw/zinc/02/49/08/287024908.db2.gz GXEXSSXGELUVKY-RISCZKNCSA-N 2 2 309.385 1.522 20 10 DDCDLP CN1CCc2cc(C[NH2+]C[C@H]3C[N@@H+]4CCC[C@H]4CO3)ccc21 ZINC000317793931 409870625 /nfs/dbraw/zinc/87/06/25/409870625.db2.gz ZKYPOOJQGPSMTP-IRXDYDNUSA-N 2 2 301.434 1.632 20 10 DDCDLP CN1CCc2cc(C[NH2+]C[C@H]3C[N@H+]4CCC[C@H]4CO3)ccc21 ZINC000317793931 409870630 /nfs/dbraw/zinc/87/06/30/409870630.db2.gz ZKYPOOJQGPSMTP-IRXDYDNUSA-N 2 2 301.434 1.632 20 10 DDCDLP C[C@H]([NH2+][C@@H]1CCN(CC[NH+]2CCOCC2)C1)c1ccccc1O ZINC000371681362 418808386 /nfs/dbraw/zinc/80/83/86/418808386.db2.gz QDLMDKCYNUDYBH-JKSUJKDBSA-N 2 2 319.449 1.449 20 10 DDCDLP C[C@H]1[NH2+]CCC[C@@H]1[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000841066269 702333362 /nfs/dbraw/zinc/33/33/62/702333362.db2.gz YZBKBARRPDEBGC-CJNGLKHVSA-N 2 2 307.413 1.892 20 10 DDCDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@@H]2C[NH2+]CCCO2)c1 ZINC000817981563 702542736 /nfs/dbraw/zinc/54/27/36/702542736.db2.gz LFYKRYYJTVOVDH-AAEUAGOBSA-N 2 2 308.378 1.208 20 10 DDCDLP C[C@H]1CC[NH2+]C[C@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000854230732 704368949 /nfs/dbraw/zinc/36/89/49/704368949.db2.gz XLOGKSLTNOAQLC-KBXCAEBGSA-N 2 2 303.450 1.735 20 10 DDCDLP CC[C@@H]([NH2+]Cc1nc(C[NH3+])cc(=O)[nH]1)c1ccc(F)cc1O ZINC000854232058 704369276 /nfs/dbraw/zinc/36/92/76/704369276.db2.gz KMXVGPYCZKVZNI-GFCCVEGCSA-N 2 2 306.341 1.727 20 10 DDCDLP C[C@@H]1C[N@H+](C)C[C@@H]1NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000898451536 708644797 /nfs/dbraw/zinc/64/47/97/708644797.db2.gz ZJXHLIBEBUKSOX-JLSDUUJJSA-N 2 2 304.482 1.895 20 10 DDCDLP C[C@@H]1C[N@@H+](C)C[C@@H]1NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000898451536 708644801 /nfs/dbraw/zinc/64/48/01/708644801.db2.gz ZJXHLIBEBUKSOX-JLSDUUJJSA-N 2 2 304.482 1.895 20 10 DDCDLP c1cc2c(cc1C[NH2+]C[C@@H]1C[N@@H+]3CCC[C@H]3CO1)CCCO2 ZINC000921689484 713843819 /nfs/dbraw/zinc/84/38/19/713843819.db2.gz DUBJHUDOZMVYCG-DLBZAZTESA-N 2 2 302.418 1.964 20 10 DDCDLP c1cc2c(cc1C[NH2+]C[C@@H]1C[N@H+]3CCC[C@H]3CO1)CCCO2 ZINC000921689484 713843820 /nfs/dbraw/zinc/84/38/20/713843820.db2.gz DUBJHUDOZMVYCG-DLBZAZTESA-N 2 2 302.418 1.964 20 10 DDCDLP c1cc2c(cc1C[NH2+]C[C@@H]1C[N@@H+]3CCC[C@@H]3CO1)CCCO2 ZINC000921689485 713843840 /nfs/dbraw/zinc/84/38/40/713843840.db2.gz DUBJHUDOZMVYCG-IAGOWNOFSA-N 2 2 302.418 1.964 20 10 DDCDLP c1cc2c(cc1C[NH2+]C[C@@H]1C[N@H+]3CCC[C@@H]3CO1)CCCO2 ZINC000921689485 713843841 /nfs/dbraw/zinc/84/38/41/713843841.db2.gz DUBJHUDOZMVYCG-IAGOWNOFSA-N 2 2 302.418 1.964 20 10 DDCDLP COc1ccc(N2CC[C@H](C[NH2+][C@@H]3C[NH2+]CCOC3)C2)cc1 ZINC000925706328 714918274 /nfs/dbraw/zinc/91/82/74/714918274.db2.gz NKHVHWZKABGIGE-HUUCEWRRSA-N 2 2 305.422 1.100 20 10 DDCDLP NC(=O)[C@@H]1CCC[N@@H+]1CCC[NH2+]Cc1ccc(Cl)cc1O ZINC001308864307 871533893 /nfs/dbraw/zinc/53/38/93/871533893.db2.gz HWSLBXSZRJXUBQ-ZDUSSCGKSA-N 2 2 311.813 1.475 20 10 DDCDLP NC(=O)[C@@H]1CCC[N@H+]1CCC[NH2+]Cc1ccc(Cl)cc1O ZINC001308864307 871533908 /nfs/dbraw/zinc/53/39/08/871533908.db2.gz HWSLBXSZRJXUBQ-ZDUSSCGKSA-N 2 2 311.813 1.475 20 10 DDCDLP C[C@H]1CC[C@@H](C[NH3+])[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2O)C1 ZINC001205844833 871857788 /nfs/dbraw/zinc/85/77/88/871857788.db2.gz YMORCAPIGVAPLJ-YOEHRIQHSA-N 3 2 318.465 1.361 20 10 DDCDLP C[C@H]1CC[C@@H](C[NH3+])[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2O)C1 ZINC001205844833 871857807 /nfs/dbraw/zinc/85/78/07/871857807.db2.gz YMORCAPIGVAPLJ-YOEHRIQHSA-N 2 2 318.465 1.361 20 10 DDCDLP COc1cc(C[N@H+]2CCc3[nH+]ccn3CC2)c(O)c(OC)c1 ZINC001237672823 889792821 /nfs/dbraw/zinc/79/28/21/889792821.db2.gz AQTIHVOUTQHIID-UHFFFAOYSA-N 2 2 303.362 1.664 20 10 DDCDLP COc1cc(C[N@@H+]2CCc3[nH+]ccn3CC2)c(O)c(OC)c1 ZINC001237672823 889792837 /nfs/dbraw/zinc/79/28/37/889792837.db2.gz AQTIHVOUTQHIID-UHFFFAOYSA-N 2 2 303.362 1.664 20 10 DDCDLP Cc1ccc(O)c([C@@H](C)[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)c1 ZINC000273622730 292165506 /nfs/dbraw/zinc/16/55/06/292165506.db2.gz ZMVIIFMFWKXQEJ-HIFRSBDPSA-N 2 2 305.422 1.691 20 10 DDCDLP Cc1ccc(O)c([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c1 ZINC000273622730 292165508 /nfs/dbraw/zinc/16/55/08/292165508.db2.gz ZMVIIFMFWKXQEJ-HIFRSBDPSA-N 2 2 305.422 1.691 20 10 DDCDLP COCC[N@H+](C)CC[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC000228672938 222205983 /nfs/dbraw/zinc/20/59/83/222205983.db2.gz ADGRMEFLJGUFGD-UHFFFAOYSA-N 2 2 302.802 1.722 20 10 DDCDLP COCC[N@@H+](C)CC[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC000228672938 222205988 /nfs/dbraw/zinc/20/59/88/222205988.db2.gz ADGRMEFLJGUFGD-UHFFFAOYSA-N 2 2 302.802 1.722 20 10 DDCDLP C[NH2+]CCC(=O)N(C)C1CC[NH+](c2ccc(OC)cc2)CC1 ZINC000375964587 418690222 /nfs/dbraw/zinc/69/02/22/418690222.db2.gz NZYIQNNQWRKPFI-UHFFFAOYSA-N 2 2 305.422 1.732 20 10 DDCDLP COc1ccc(N2CC[NH+](C[C@@H](O)Cn3cc[nH+]c3)CC2)cc1 ZINC000754099670 700483692 /nfs/dbraw/zinc/48/36/92/700483692.db2.gz XBLMGEWVJLBJJE-MRXNPFEDSA-N 2 2 316.405 1.075 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000843127304 702825379 /nfs/dbraw/zinc/82/53/79/702825379.db2.gz PSLMRQIYKGWGGY-JQWIXIFHSA-N 2 2 307.350 1.493 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000843127304 702825380 /nfs/dbraw/zinc/82/53/80/702825380.db2.gz PSLMRQIYKGWGGY-JQWIXIFHSA-N 2 2 307.350 1.493 20 10 DDCDLP CO[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CCO1 ZINC000895968109 711657830 /nfs/dbraw/zinc/65/78/30/711657830.db2.gz HQDDBKCQBRKQAU-KRWDZBQOSA-N 2 2 305.422 1.243 20 10 DDCDLP CO[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CCO1 ZINC000895968109 711657832 /nfs/dbraw/zinc/65/78/32/711657832.db2.gz HQDDBKCQBRKQAU-KRWDZBQOSA-N 2 2 305.422 1.243 20 10 DDCDLP [NH3+]C[C@@]1(O)CCCC[N@H+](Cc2cc(Cl)c(O)cc2O)C1 ZINC001205689752 746552223 /nfs/dbraw/zinc/55/22/23/746552223.db2.gz RJJMQNTXJDLWJJ-AWEZNQCLSA-N 2 2 300.786 1.427 20 10 DDCDLP [NH3+]C[C@@]1(O)CCCC[N@@H+](Cc2cc(Cl)c(O)cc2O)C1 ZINC001205689752 746552224 /nfs/dbraw/zinc/55/22/24/746552224.db2.gz RJJMQNTXJDLWJJ-AWEZNQCLSA-N 2 2 300.786 1.427 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCN4CC[C@H]4C3)cc2)CC1 ZINC001139411451 860390701 /nfs/dbraw/zinc/39/07/01/860390701.db2.gz MTJXDFBGABDXFK-SFHVURJKSA-N 2 2 300.450 1.328 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCN4CC[C@H]4C3)cc2)CC1 ZINC001139411451 860390704 /nfs/dbraw/zinc/39/07/04/860390704.db2.gz MTJXDFBGABDXFK-SFHVURJKSA-N 2 2 300.450 1.328 20 10 DDCDLP [NH3+]C[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001204932474 871291843 /nfs/dbraw/zinc/29/18/43/871291843.db2.gz KBPCBWBAQHTUEJ-INIZCTEOSA-N 3 2 304.438 1.115 20 10 DDCDLP [NH3+]C[C@@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001204932474 871291854 /nfs/dbraw/zinc/29/18/54/871291854.db2.gz KBPCBWBAQHTUEJ-INIZCTEOSA-N 3 2 304.438 1.115 20 10 DDCDLP [NH3+][C@H](CC(=O)NC[C@@H]1CC[NH2+]CC1(F)F)c1ccccc1O ZINC001220185402 878794520 /nfs/dbraw/zinc/79/45/20/878794520.db2.gz GZLYYQNQHVTCTO-CMPLNLGQSA-N 2 2 313.348 1.143 20 10 DDCDLP COC(=O)Cc1ccc(C[N@@H+]2CCCC[C@]23CC[NH2+]C3)c(O)c1 ZINC001235129650 888425798 /nfs/dbraw/zinc/42/57/98/888425798.db2.gz RPRHTBOXBZURCR-GOSISDBHSA-N 2 2 318.417 1.826 20 10 DDCDLP COC(=O)Cc1ccc(C[N@H+]2CCCC[C@]23CC[NH2+]C3)c(O)c1 ZINC001235129650 888425805 /nfs/dbraw/zinc/42/58/05/888425805.db2.gz RPRHTBOXBZURCR-GOSISDBHSA-N 2 2 318.417 1.826 20 10 DDCDLP C[NH+](C)CCN1CC[NH+](Cc2c(O)ccc(F)c2Cl)CC1 ZINC001237119115 889510136 /nfs/dbraw/zinc/51/01/36/889510136.db2.gz AZUGDYWFHSXZBC-UHFFFAOYSA-N 2 2 315.820 1.864 20 10 DDCDLP COc1c(O)c(C[N@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)ccc1[N+](=O)[O-] ZINC000373331531 418420830 /nfs/dbraw/zinc/42/08/30/418420830.db2.gz JQVZJZNNQXOCJU-TXEJJXNPSA-N 2 2 307.350 1.302 20 10 DDCDLP COc1c(O)c(C[N@@H+]2C[C@H]3C[NH+](C)C[C@H]3C2)ccc1[N+](=O)[O-] ZINC000373331531 418420833 /nfs/dbraw/zinc/42/08/33/418420833.db2.gz JQVZJZNNQXOCJU-TXEJJXNPSA-N 2 2 307.350 1.302 20 10 DDCDLP c1[nH]c2c([nH+]1)CC[C@@H]([NH2+]Cc1ccc(N3CCOCC3)cc1)C2 ZINC000368092018 418688189 /nfs/dbraw/zinc/68/81/89/418688189.db2.gz ZFQHVBNWCZCVDQ-OAHLLOKOSA-N 2 2 312.417 1.893 20 10 DDCDLP c1[nH]c2c([nH+]1)C[C@H]([NH2+]Cc1ccc(N3CCOCC3)cc1)CC2 ZINC000368092018 418688191 /nfs/dbraw/zinc/68/81/91/418688191.db2.gz ZFQHVBNWCZCVDQ-OAHLLOKOSA-N 2 2 312.417 1.893 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCNC(=O)C3(C)C)cc2)CC1 ZINC000775678241 698021455 /nfs/dbraw/zinc/02/14/55/698021455.db2.gz XOZHRJYMPPAWDA-UHFFFAOYSA-N 2 2 316.449 1.149 20 10 DDCDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CCC[N@@H+]1CCCO ZINC000840949971 702290569 /nfs/dbraw/zinc/29/05/69/702290569.db2.gz DKRLFVDAEIJGIZ-SFHVURJKSA-N 2 2 305.466 1.997 20 10 DDCDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CCC[N@H+]1CCCO ZINC000840949971 702290571 /nfs/dbraw/zinc/29/05/71/702290571.db2.gz DKRLFVDAEIJGIZ-SFHVURJKSA-N 2 2 305.466 1.997 20 10 DDCDLP CN(C)c1ccc(C[NH2+][C@@H](C2CC2)[C@H]2C[NH2+]CCO2)cc1F ZINC000817900595 702514069 /nfs/dbraw/zinc/51/40/69/702514069.db2.gz ODAPINLCNHCBEQ-SJORKVTESA-N 2 2 307.413 1.748 20 10 DDCDLP O=C([C@@H]1CCC[N@@H+](Cc2cccc(F)c2O)C1)N1CC[NH2+]CC1 ZINC000843046944 702807860 /nfs/dbraw/zinc/80/78/60/702807860.db2.gz IBLGMWURLXRLMK-CQSZACIVSA-N 2 2 321.396 1.175 20 10 DDCDLP O=C([C@@H]1CCC[N@H+](Cc2cccc(F)c2O)C1)N1CC[NH2+]CC1 ZINC000843046944 702807863 /nfs/dbraw/zinc/80/78/63/702807863.db2.gz IBLGMWURLXRLMK-CQSZACIVSA-N 2 2 321.396 1.175 20 10 DDCDLP C[C@@H]1C[N@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@@H]1[NH3+] ZINC000844218946 702994635 /nfs/dbraw/zinc/99/46/35/702994635.db2.gz GEBPNDCNFNADIB-PBHICJAKSA-N 2 2 318.465 1.380 20 10 DDCDLP C[C@@H]1C[N@@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@@H]1[NH3+] ZINC000844218946 702994638 /nfs/dbraw/zinc/99/46/38/702994638.db2.gz GEBPNDCNFNADIB-PBHICJAKSA-N 2 2 318.465 1.380 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@H+](C)CC(C)(C)C[NH3+])cc1 ZINC000844221414 702995739 /nfs/dbraw/zinc/99/57/39/702995739.db2.gz ZFJSKQAIGKTTNB-UHFFFAOYSA-N 2 2 306.454 1.286 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@@H+](C)CC(C)(C)C[NH3+])cc1 ZINC000844221414 702995741 /nfs/dbraw/zinc/99/57/41/702995741.db2.gz ZFJSKQAIGKTTNB-UHFFFAOYSA-N 2 2 306.454 1.286 20 10 DDCDLP COCC[NH2+]C1CC[NH+](Cc2cc3c(cc2O)OCO3)CC1 ZINC000844901828 703082189 /nfs/dbraw/zinc/08/21/89/703082189.db2.gz ZLQWSAZUVWHBTI-UHFFFAOYSA-N 2 2 308.378 1.321 20 10 DDCDLP CC[C@H]([NH2+]Cc1nc(C[NH3+])cc(=O)[nH]1)c1ccc(F)cc1O ZINC000854232059 704369240 /nfs/dbraw/zinc/36/92/40/704369240.db2.gz KMXVGPYCZKVZNI-LBPRGKRZSA-N 2 2 306.341 1.727 20 10 DDCDLP CN(CCC[NH2+]Cc1cc(F)cc(F)c1O)CC[NH+](C)C ZINC000883184819 707950099 /nfs/dbraw/zinc/95/00/99/707950099.db2.gz GBZUEEBYFNDPEW-UHFFFAOYSA-N 2 2 301.381 1.644 20 10 DDCDLP CCO[C@@H](C[NH2+]Cc1cc(OC)c(OC)cc1O)C[NH+](C)C ZINC000896879666 708171078 /nfs/dbraw/zinc/17/10/78/708171078.db2.gz DMDNGTVSTQCZGQ-ZDUSSCGKSA-N 2 2 312.410 1.466 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH+]3C[C@@H]4C[NH2+]C[C@H]4C3)cc2F)CC1 ZINC001319972367 866410471 /nfs/dbraw/zinc/41/04/71/866410471.db2.gz HABZGBLSOGJWIZ-HOTGVXAUSA-N 3 2 318.440 1.229 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1)c1ccc(F)cc1O ZINC000756547775 700627191 /nfs/dbraw/zinc/62/71/91/700627191.db2.gz HKPLXWXFRVPZRS-CHWSQXEVSA-N 2 2 323.412 1.769 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1ccc(F)cc1O ZINC000756547775 700627192 /nfs/dbraw/zinc/62/71/92/700627192.db2.gz HKPLXWXFRVPZRS-CHWSQXEVSA-N 2 2 323.412 1.769 20 10 DDCDLP CC[NH2+]CC[NH2+]Cc1cc(Br)cc(OC)c1O ZINC000841037206 702318445 /nfs/dbraw/zinc/31/84/45/702318445.db2.gz QGFIVHWOYJMLCJ-UHFFFAOYSA-N 2 2 303.200 1.862 20 10 DDCDLP CC[C@@H](O)C[NH2+]CCC[NH+]1CCN(c2ccc(OC)cc2)CC1 ZINC000818943450 704031328 /nfs/dbraw/zinc/03/13/28/704031328.db2.gz UBMRQNAYVAFAMC-QGZVFWFLSA-N 2 2 321.465 1.568 20 10 DDCDLP Cc1[nH+]c[nH]c1CC(=O)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000876506937 705738731 /nfs/dbraw/zinc/73/87/31/705738731.db2.gz RBCBLRHGVBVYOE-CQSZACIVSA-N 2 2 301.394 1.143 20 10 DDCDLP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CC[N@H+](CC(C)(C)O)C1 ZINC000877665557 706174358 /nfs/dbraw/zinc/17/43/58/706174358.db2.gz YLPDCDMCSCDREP-INIZCTEOSA-N 2 2 305.466 1.996 20 10 DDCDLP Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CC[N@@H+](CC(C)(C)O)C1 ZINC000877665557 706174359 /nfs/dbraw/zinc/17/43/59/706174359.db2.gz YLPDCDMCSCDREP-INIZCTEOSA-N 2 2 305.466 1.996 20 10 DDCDLP COc1cc(C)cc(C[NH2+]C[C@@H]2C[N@@H+]3CCC[C@@H]3CO2)c1O ZINC000894242720 711031589 /nfs/dbraw/zinc/03/15/89/711031589.db2.gz URFXJSMTBMDFEB-HUUCEWRRSA-N 2 2 306.406 1.662 20 10 DDCDLP COc1cc(C)cc(C[NH2+]C[C@@H]2C[N@H+]3CCC[C@@H]3CO2)c1O ZINC000894242720 711031592 /nfs/dbraw/zinc/03/15/92/711031592.db2.gz URFXJSMTBMDFEB-HUUCEWRRSA-N 2 2 306.406 1.662 20 10 DDCDLP C[N@@H+]1CCC[C@H]1C(=O)N1CC[NH+](Cc2ccc(N)cc2)CC1 ZINC001120371077 781901494 /nfs/dbraw/zinc/90/14/94/781901494.db2.gz OWVJHSPRRXNLSU-INIZCTEOSA-N 2 2 302.422 1.007 20 10 DDCDLP C[N@H+]1CCC[C@H]1C(=O)N1CC[NH+](Cc2ccc(N)cc2)CC1 ZINC001120371077 781901501 /nfs/dbraw/zinc/90/15/01/781901501.db2.gz OWVJHSPRRXNLSU-INIZCTEOSA-N 2 2 302.422 1.007 20 10 DDCDLP CCC[N@H+](Cc1cc2c(cc1O)OCC[NH2+]C2)[C@@H]1CC[NH2+]C1 ZINC001236322998 889186110 /nfs/dbraw/zinc/18/61/10/889186110.db2.gz BGFLUQUYNBLCNE-OAHLLOKOSA-N 3 2 305.422 1.448 20 10 DDCDLP CCC[N@@H+](Cc1cc2c(cc1O)OCC[NH2+]C2)[C@@H]1CC[NH2+]C1 ZINC001236322998 889186118 /nfs/dbraw/zinc/18/61/18/889186118.db2.gz BGFLUQUYNBLCNE-OAHLLOKOSA-N 3 2 305.422 1.448 20 10 DDCDLP COc1cc(O)c(C[N@@H+]2CC[C@H]3CC[NH+](C)C[C@H]32)cc1OC ZINC000272352016 407881071 /nfs/dbraw/zinc/88/10/71/407881071.db2.gz YGHRAFLEJFFERA-TZMCWYRMSA-N 2 2 306.406 1.935 20 10 DDCDLP COc1cc(O)c(C[N@H+]2CC[C@H]3CC[NH+](C)C[C@H]32)cc1OC ZINC000272352016 407881076 /nfs/dbraw/zinc/88/10/76/407881076.db2.gz YGHRAFLEJFFERA-TZMCWYRMSA-N 2 2 306.406 1.935 20 10 DDCDLP COc1cc(O)c(C[NH+]2CC[C@H]3CC[N@H+](C)C[C@H]32)cc1OC ZINC000272352016 407881080 /nfs/dbraw/zinc/88/10/80/407881080.db2.gz YGHRAFLEJFFERA-TZMCWYRMSA-N 2 2 306.406 1.935 20 10 DDCDLP COc1cc(O)c(C[NH+]2CC[C@H]3CC[N@@H+](C)C[C@H]32)cc1OC ZINC000272352016 407881087 /nfs/dbraw/zinc/88/10/87/407881087.db2.gz YGHRAFLEJFFERA-TZMCWYRMSA-N 2 2 306.406 1.935 20 10 DDCDLP COc1ccc(N2CC[NH+](C[C@H](O)C[N@H+](C)C3CC3)CC2)cc1 ZINC000273248956 408125827 /nfs/dbraw/zinc/12/58/27/408125827.db2.gz VVBZFQUJNXKRPG-QGZVFWFLSA-N 2 2 319.449 1.272 20 10 DDCDLP COc1ccc(N2CC[NH+](C[C@H](O)C[N@@H+](C)C3CC3)CC2)cc1 ZINC000273248956 408125834 /nfs/dbraw/zinc/12/58/34/408125834.db2.gz VVBZFQUJNXKRPG-QGZVFWFLSA-N 2 2 319.449 1.272 20 10 DDCDLP COC[C@@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)C1CCOCC1 ZINC000817940659 702530585 /nfs/dbraw/zinc/53/05/85/702530585.db2.gz GNDFTEYTDUNAHD-QZTJIDSGSA-N 2 2 321.465 1.784 20 10 DDCDLP C[NH2+]C[C@@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000843056230 702809553 /nfs/dbraw/zinc/80/95/53/702809553.db2.gz WVHJBTFWJIOHHQ-SFHVURJKSA-N 3 2 302.466 1.622 20 10 DDCDLP C[NH2+]C[C@@H]1CCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000843056230 702809557 /nfs/dbraw/zinc/80/95/57/702809557.db2.gz WVHJBTFWJIOHHQ-SFHVURJKSA-N 3 2 302.466 1.622 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)ccc1[N+](=O)[O-] ZINC000843123940 702824682 /nfs/dbraw/zinc/82/46/82/702824682.db2.gz SLGVZRYBPYDJOW-INIZCTEOSA-N 2 2 321.377 1.885 20 10 DDCDLP COc1c(O)c(C[N@H+]2CCC[C@@]3(CC[NH2+]C3)C2)ccc1[N+](=O)[O-] ZINC000843123940 702824684 /nfs/dbraw/zinc/82/46/84/702824684.db2.gz SLGVZRYBPYDJOW-INIZCTEOSA-N 2 2 321.377 1.885 20 10 DDCDLP CC[C@@H]1C[N@H+](CC(=O)NCc2ccc(N(C)C)cc2)CC[C@@H]1[NH3+] ZINC000844222862 702996142 /nfs/dbraw/zinc/99/61/42/702996142.db2.gz MWLABAUAUQJNKH-WBVHZDCISA-N 2 2 318.465 1.428 20 10 DDCDLP CC[C@@H]1C[N@@H+](CC(=O)NCc2ccc(N(C)C)cc2)CC[C@@H]1[NH3+] ZINC000844222862 702996144 /nfs/dbraw/zinc/99/61/44/702996144.db2.gz MWLABAUAUQJNKH-WBVHZDCISA-N 2 2 318.465 1.428 20 10 DDCDLP OC1CCN(c2ccc(C[NH2+]CC[NH+]3CCCC3)cc2)CC1 ZINC000877142242 705995326 /nfs/dbraw/zinc/99/53/26/705995326.db2.gz LYOWGFWXQGRGNF-UHFFFAOYSA-N 2 2 303.450 1.833 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[NH2+][C@@]12CCC[C@H]1[NH2+]CC2 ZINC000873229823 707778771 /nfs/dbraw/zinc/77/87/71/707778771.db2.gz HDTMPVKAESEIKT-QZTJIDSGSA-N 2 2 301.434 1.897 20 10 DDCDLP C[C@@H]1CC[NH2+][C@@H](C)[C@H]1[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000923369882 714330712 /nfs/dbraw/zinc/33/07/12/714330712.db2.gz MZPDMLNBKQARNG-VKJFTORMSA-N 2 2 303.450 1.999 20 10 DDCDLP C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)[C@H]1C[N@H+](C)CCN1C ZINC001183930411 743929144 /nfs/dbraw/zinc/92/91/44/743929144.db2.gz RLHRDQIUACSZAA-RHSMWYFYSA-N 2 2 303.450 1.736 20 10 DDCDLP C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)[C@H]1C[N@@H+](C)CCN1C ZINC001183930411 743929147 /nfs/dbraw/zinc/92/91/47/743929147.db2.gz RLHRDQIUACSZAA-RHSMWYFYSA-N 2 2 303.450 1.736 20 10 DDCDLP CCNC(=O)C[N@H+](C)Cc1cc(C[NH+](C)C)c(O)c(OC)c1 ZINC001139252829 860336690 /nfs/dbraw/zinc/33/66/90/860336690.db2.gz APONINVBZIIIRU-UHFFFAOYSA-N 2 2 309.410 1.030 20 10 DDCDLP CCNC(=O)C[N@@H+](C)Cc1cc(C[NH+](C)C)c(O)c(OC)c1 ZINC001139252829 860336698 /nfs/dbraw/zinc/33/66/98/860336698.db2.gz APONINVBZIIIRU-UHFFFAOYSA-N 2 2 309.410 1.030 20 10 DDCDLP CC[N@@H+]1CCO[C@@H]2C[NH+](Cc3cccc(OC)c3O)C[C@@H]2C1 ZINC001203592486 870655625 /nfs/dbraw/zinc/65/56/25/870655625.db2.gz GNXBADMVYJFZGF-GOEBONIOSA-N 2 2 306.406 1.553 20 10 DDCDLP CC[N@H+]1CCO[C@@H]2C[NH+](Cc3cccc(OC)c3O)C[C@@H]2C1 ZINC001203592486 870655632 /nfs/dbraw/zinc/65/56/32/870655632.db2.gz GNXBADMVYJFZGF-GOEBONIOSA-N 2 2 306.406 1.553 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@H+](Cc3cccc(OC)c3O)C[C@@H]2C1 ZINC001203592486 870655641 /nfs/dbraw/zinc/65/56/41/870655641.db2.gz GNXBADMVYJFZGF-GOEBONIOSA-N 2 2 306.406 1.553 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@@H+](Cc3cccc(OC)c3O)C[C@@H]2C1 ZINC001203592486 870655647 /nfs/dbraw/zinc/65/56/47/870655647.db2.gz GNXBADMVYJFZGF-GOEBONIOSA-N 2 2 306.406 1.553 20 10 DDCDLP CC[N@@H+]1CCO[C@@H]2C[NH+](Cc3cc(OC)ccc3O)C[C@@H]2C1 ZINC001203675400 870706523 /nfs/dbraw/zinc/70/65/23/870706523.db2.gz WAKSTPAJXDMRLK-WMLDXEAASA-N 2 2 306.406 1.553 20 10 DDCDLP CC[N@H+]1CCO[C@@H]2C[NH+](Cc3cc(OC)ccc3O)C[C@@H]2C1 ZINC001203675400 870706529 /nfs/dbraw/zinc/70/65/29/870706529.db2.gz WAKSTPAJXDMRLK-WMLDXEAASA-N 2 2 306.406 1.553 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@H+](Cc3cc(OC)ccc3O)C[C@@H]2C1 ZINC001203675400 870706532 /nfs/dbraw/zinc/70/65/32/870706532.db2.gz WAKSTPAJXDMRLK-WMLDXEAASA-N 2 2 306.406 1.553 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@@H+](Cc3cc(OC)ccc3O)C[C@@H]2C1 ZINC001203675400 870706536 /nfs/dbraw/zinc/70/65/36/870706536.db2.gz WAKSTPAJXDMRLK-WMLDXEAASA-N 2 2 306.406 1.553 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@H]4CC[C@]4([NH3+])C3)cc2)CC1 ZINC001235995895 889053033 /nfs/dbraw/zinc/05/30/33/889053033.db2.gz ROLSDVIQPMOADD-AEFFLSMTSA-N 3 2 300.450 1.362 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@H]4CC[C@]4([NH3+])C3)cc2)CC1 ZINC001235995895 889053045 /nfs/dbraw/zinc/05/30/45/889053045.db2.gz ROLSDVIQPMOADD-AEFFLSMTSA-N 3 2 300.450 1.362 20 10 DDCDLP Cn1cc[nH+]c1[C@@H]1CC[N@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000372886500 418911908 /nfs/dbraw/zinc/91/19/08/418911908.db2.gz YBTLSHZSGXQKPH-LLVKDONJSA-N 2 2 301.346 1.844 20 10 DDCDLP Cn1cc[nH+]c1[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000372886500 418911910 /nfs/dbraw/zinc/91/19/10/418911910.db2.gz YBTLSHZSGXQKPH-LLVKDONJSA-N 2 2 301.346 1.844 20 10 DDCDLP COC(=O)N1CCC([NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)CC1 ZINC000841041306 702319811 /nfs/dbraw/zinc/31/98/11/702319811.db2.gz DYUSGYAINKHEDA-INIZCTEOSA-N 2 2 320.437 1.573 20 10 DDCDLP Cc1cc(N(C)C)ccc1C[NH2+][C@H](C1CC1)[C@H]1C[NH2+]CCO1 ZINC000817895265 702511587 /nfs/dbraw/zinc/51/15/87/702511587.db2.gz WMDQKXCFVNGJRE-QZTJIDSGSA-N 2 2 303.450 1.918 20 10 DDCDLP C[N@@H+](Cc1ccc(N2CCOCC2)cc1)C[C@@H]([NH3+])CC(F)F ZINC000903877795 711313553 /nfs/dbraw/zinc/31/35/53/711313553.db2.gz QKEHHAIXQSEEMQ-AWEZNQCLSA-N 2 2 313.392 1.938 20 10 DDCDLP C[N@H+](Cc1ccc(N2CCOCC2)cc1)C[C@@H]([NH3+])CC(F)F ZINC000903877795 711313556 /nfs/dbraw/zinc/31/35/56/711313556.db2.gz QKEHHAIXQSEEMQ-AWEZNQCLSA-N 2 2 313.392 1.938 20 10 DDCDLP COCC1C[NH+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001333847727 867073730 /nfs/dbraw/zinc/07/37/30/867073730.db2.gz AATMAMFGNLALJU-UHFFFAOYSA-N 2 2 307.413 1.656 20 10 DDCDLP Cc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)c(O)c1C ZINC000273553383 130135327 /nfs/dbraw/zinc/13/53/27/130135327.db2.gz GJIUTIYIBNNAOR-HOCLYGCPSA-N 2 2 319.449 1.999 20 10 DDCDLP Cc1ccc([C@H](C)[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c(O)c1C ZINC000273553383 130135330 /nfs/dbraw/zinc/13/53/30/130135330.db2.gz GJIUTIYIBNNAOR-HOCLYGCPSA-N 2 2 319.449 1.999 20 10 DDCDLP C[C@H]([NH2+][C@@H]1CCC(=O)N[C@H]1c1c[nH+]cn1C)c1ccccc1O ZINC000375517593 418654363 /nfs/dbraw/zinc/65/43/63/418654363.db2.gz WXKIMGXTUKCSLM-XTQGRXLLSA-N 2 2 314.389 1.796 20 10 DDCDLP CC[C@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000285969222 535899250 /nfs/dbraw/zinc/89/92/50/535899250.db2.gz HAQUWNBHDACCEW-HNNXBMFYSA-N 2 2 323.412 1.736 20 10 DDCDLP C[NH+](C)C[C@](C)(O)C[NH2+]Cc1c(O)cccc1Br ZINC000706833730 699244988 /nfs/dbraw/zinc/24/49/88/699244988.db2.gz DEXGZFMFZHWXNG-CYBMUJFWSA-N 2 2 317.227 1.557 20 10 DDCDLP COC(=O)[C@@H](C)[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000793325951 699750457 /nfs/dbraw/zinc/75/04/57/699750457.db2.gz YZQABBXVTGYDET-CQSZACIVSA-N 2 2 305.422 1.432 20 10 DDCDLP COC(=O)[C@@H](C)[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000793325951 699750458 /nfs/dbraw/zinc/75/04/58/699750458.db2.gz YZQABBXVTGYDET-CQSZACIVSA-N 2 2 305.422 1.432 20 10 DDCDLP CC[C@H]([NH2+]CC(=O)N1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000796731011 699949386 /nfs/dbraw/zinc/94/93/86/699949386.db2.gz UTDMOGLFACNNOO-AWEZNQCLSA-N 2 2 309.385 1.346 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](C[NH3+])C(C)(C)C)cc2)CC1 ZINC000841088050 702341558 /nfs/dbraw/zinc/34/15/58/702341558.db2.gz VJWIEQIDIUKTQM-KRWDZBQOSA-N 3 2 304.482 1.901 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](CN)C(C)(C)C)cc2)CC1 ZINC000841088050 702341564 /nfs/dbraw/zinc/34/15/64/702341564.db2.gz VJWIEQIDIUKTQM-KRWDZBQOSA-N 2 2 304.482 1.901 20 10 DDCDLP Cc1cc(Br)c(O)c(C[NH2+]C[C@H]2C[NH2+]CCO2)c1 ZINC000841098126 702345238 /nfs/dbraw/zinc/34/52/38/702345238.db2.gz CWISKQIDMALPOX-LLVKDONJSA-N 2 2 315.211 1.541 20 10 DDCDLP COCC[N@H+](C)C[C@H](O)C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000846861099 703343425 /nfs/dbraw/zinc/34/34/25/703343425.db2.gz NWLABWKWAGKTIC-WMLDXEAASA-N 2 2 309.454 1.342 20 10 DDCDLP COCC[N@@H+](C)C[C@H](O)C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000846861099 703343427 /nfs/dbraw/zinc/34/34/27/703343427.db2.gz NWLABWKWAGKTIC-WMLDXEAASA-N 2 2 309.454 1.342 20 10 DDCDLP [NH3+][C@@]12CC[C@H]1C[N@H+](Cc1ccc(N3CCC(O)CC3)cc1)C2 ZINC001235998388 889052369 /nfs/dbraw/zinc/05/23/69/889052369.db2.gz YINJRXBEWCRYMS-MAUKXSAKSA-N 2 2 301.434 1.571 20 10 DDCDLP [NH3+][C@@]12CC[C@H]1C[N@@H+](Cc1ccc(N3CCC(O)CC3)cc1)C2 ZINC001235998388 889052384 /nfs/dbraw/zinc/05/23/84/889052384.db2.gz YINJRXBEWCRYMS-MAUKXSAKSA-N 2 2 301.434 1.571 20 10 DDCDLP C[C@@H]([NH2+]C[C@@H](O)C[NH+]1CCCC1)c1ccc(F)c(F)c1O ZINC000276904179 408902607 /nfs/dbraw/zinc/90/26/07/408902607.db2.gz JNCXISHTAUQGDX-GHMZBOCLSA-N 2 2 300.349 1.778 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CC(=O)NCC3(C)C)cc2)CC1 ZINC000800538758 700231999 /nfs/dbraw/zinc/23/19/99/700231999.db2.gz AWRHOTLZVNKEPI-UHFFFAOYSA-N 2 2 316.449 1.149 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CC(=O)NCC3(C)C)cc2)CC1 ZINC000800538758 700232001 /nfs/dbraw/zinc/23/20/01/700232001.db2.gz AWRHOTLZVNKEPI-UHFFFAOYSA-N 2 2 316.449 1.149 20 10 DDCDLP C[C@H]([NH2+]C[C@@H](O)C[NH+](C)C)c1cc(Br)ccc1O ZINC000756558254 700628248 /nfs/dbraw/zinc/62/82/48/700628248.db2.gz ZDGTVNLZZPQGCQ-GXSJLCMTSA-N 2 2 317.227 1.728 20 10 DDCDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]CC2([NH3+])CCOCC2)c1 ZINC000863541522 705952444 /nfs/dbraw/zinc/95/24/44/705952444.db2.gz NUHOAAITKSZMHG-NSHDSACASA-N 2 2 308.378 1.337 20 10 DDCDLP CN(C)c1ccc([C@@H](CNC(=O)Cc2c[nH]c[nH+]2)[NH+](C)C)cc1 ZINC000891248241 710141080 /nfs/dbraw/zinc/14/10/80/710141080.db2.gz XDDPHOMHSIORBE-MRXNPFEDSA-N 2 2 315.421 1.437 20 10 DDCDLP [NH3+][C@]1(CO)CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000904401323 711852982 /nfs/dbraw/zinc/85/29/82/711852982.db2.gz OGFYMLWTWHEVRS-GOSISDBHSA-N 2 2 303.450 1.963 20 10 DDCDLP [NH3+][C@]1(CO)CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000904401323 711852983 /nfs/dbraw/zinc/85/29/83/711852983.db2.gz OGFYMLWTWHEVRS-GOSISDBHSA-N 2 2 303.450 1.963 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC[NH2+]CC3)cc2)CC1 ZINC001204666955 738890491 /nfs/dbraw/zinc/89/04/91/738890491.db2.gz ASXWKUHJWATZCP-UHFFFAOYSA-N 3 2 302.466 1.624 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](C[NH3+])C3)cc2F)CC1 ZINC001326202039 861186709 /nfs/dbraw/zinc/18/67/09/861186709.db2.gz ZLSXINGMTMOAQD-OAHLLOKOSA-N 3 2 306.429 1.358 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H](C[NH3+])C3)cc2F)CC1 ZINC001326202039 861186727 /nfs/dbraw/zinc/18/67/27/861186727.db2.gz ZLSXINGMTMOAQD-OAHLLOKOSA-N 3 2 306.429 1.358 20 10 DDCDLP CN1CCN(c2ccc(C[N@@H+]3CC[C@H](C[NH3+])C3)cc2F)CC1 ZINC001326202039 861186735 /nfs/dbraw/zinc/18/67/35/861186735.db2.gz ZLSXINGMTMOAQD-OAHLLOKOSA-N 2 2 306.429 1.358 20 10 DDCDLP CN1CCN(c2ccc(C[N@H+]3CC[C@H](C[NH3+])C3)cc2F)CC1 ZINC001326202039 861186751 /nfs/dbraw/zinc/18/67/51/861186751.db2.gz ZLSXINGMTMOAQD-OAHLLOKOSA-N 2 2 306.429 1.358 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@@]2(CCC[NH2+]2)C1 ZINC001222353681 880415674 /nfs/dbraw/zinc/41/56/74/880415674.db2.gz FGMHQHBJKXJEPB-IBGZPJMESA-N 3 2 314.477 1.814 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCC[C@@]2(CCC[NH2+]2)C1 ZINC001222353681 880415684 /nfs/dbraw/zinc/41/56/84/880415684.db2.gz FGMHQHBJKXJEPB-IBGZPJMESA-N 3 2 314.477 1.814 20 10 DDCDLP CCN(Cc1ccc(N2CC[NH+](C)CC2)cc1F)C1C[NH+](C)C1 ZINC001236941542 889435241 /nfs/dbraw/zinc/43/52/41/889435241.db2.gz BICGEUQAGYTQRZ-UHFFFAOYSA-N 2 2 320.456 1.713 20 10 DDCDLP CC[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C1CN(C)C1 ZINC001236941542 889435251 /nfs/dbraw/zinc/43/52/51/889435251.db2.gz BICGEUQAGYTQRZ-UHFFFAOYSA-N 2 2 320.456 1.713 20 10 DDCDLP C[C@H](NC(=O)NCC[NH+]1CCC([NH3+])CC1)c1ccccc1O ZINC001120560376 782023186 /nfs/dbraw/zinc/02/31/86/782023186.db2.gz JHJZOGGGUVBZQA-LBPRGKRZSA-N 2 2 306.410 1.176 20 10 DDCDLP C[NH2+]C[C@H]1CC[N@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 ZINC000844218475 702994749 /nfs/dbraw/zinc/99/47/49/702994749.db2.gz AUZWSPJAEIOEIS-MRXNPFEDSA-N 2 2 318.465 1.252 20 10 DDCDLP C[NH2+]C[C@H]1CC[N@@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 ZINC000844218475 702994750 /nfs/dbraw/zinc/99/47/50/702994750.db2.gz AUZWSPJAEIOEIS-MRXNPFEDSA-N 2 2 318.465 1.252 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+]CC34CC(C3)C[NH2+]4)cc2)CC1 ZINC000853246703 704224598 /nfs/dbraw/zinc/22/45/98/704224598.db2.gz QHXKMWOQQJGJPW-UHFFFAOYSA-N 3 2 300.450 1.280 20 10 DDCDLP COc1cc(C[N@H+](C)Cc2cnccn2)cc(C[NH+](C)C)c1O ZINC001139258037 860339523 /nfs/dbraw/zinc/33/95/23/860339523.db2.gz KGAZEWMPGYLMDF-UHFFFAOYSA-N 2 2 316.405 1.884 20 10 DDCDLP COc1cc(C[N@@H+](C)Cc2cnccn2)cc(C[NH+](C)C)c1O ZINC001139258037 860339526 /nfs/dbraw/zinc/33/95/26/860339526.db2.gz KGAZEWMPGYLMDF-UHFFFAOYSA-N 2 2 316.405 1.884 20 10 DDCDLP COc1cc(C[N@H+](C)Cc2ccncn2)cc(C[NH+](C)C)c1O ZINC001139261017 860340434 /nfs/dbraw/zinc/34/04/34/860340434.db2.gz RXNNSBJGQHUQFP-UHFFFAOYSA-N 2 2 316.405 1.884 20 10 DDCDLP COc1cc(C[N@@H+](C)Cc2ccncn2)cc(C[NH+](C)C)c1O ZINC001139261017 860340442 /nfs/dbraw/zinc/34/04/42/860340442.db2.gz RXNNSBJGQHUQFP-UHFFFAOYSA-N 2 2 316.405 1.884 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@@]12CC[NH2+]C2 ZINC001235111547 888416347 /nfs/dbraw/zinc/41/63/47/888416347.db2.gz PZDIJMNPAFEIRV-SFHVURJKSA-N 3 2 300.450 1.424 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCC[C@@]12CC[NH2+]C2 ZINC001235111547 888416353 /nfs/dbraw/zinc/41/63/53/888416353.db2.gz PZDIJMNPAFEIRV-SFHVURJKSA-N 3 2 300.450 1.424 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH+]3CC(C)(CO)C3)c(F)c2)CC1 ZINC001236932475 889430413 /nfs/dbraw/zinc/43/04/13/889430413.db2.gz PGSMLZONWNXDHP-UHFFFAOYSA-N 2 2 307.413 1.392 20 10 DDCDLP Cc1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCC[C@@H]2C(N)=O)c(O)c1C ZINC000273553378 408243332 /nfs/dbraw/zinc/24/33/32/408243332.db2.gz GJIUTIYIBNNAOR-GOEBONIOSA-N 2 2 319.449 1.999 20 10 DDCDLP Cc1ccc([C@H](C)[NH2+]CCC[N@H+]2CCC[C@@H]2C(N)=O)c(O)c1C ZINC000273553378 408243339 /nfs/dbraw/zinc/24/33/39/408243339.db2.gz GJIUTIYIBNNAOR-GOEBONIOSA-N 2 2 319.449 1.999 20 10 DDCDLP C[NH+]1CCC(O)(C[NH2+]Cc2cc(Cl)cc(F)c2O)CC1 ZINC000776214902 698082153 /nfs/dbraw/zinc/08/21/53/698082153.db2.gz TXBNOZDDOPHLEU-UHFFFAOYSA-N 2 2 302.777 1.731 20 10 DDCDLP Cc1noc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)n1 ZINC000792176346 699680755 /nfs/dbraw/zinc/68/07/55/699680755.db2.gz AUJPBMXSNUWYJO-ZDUSSCGKSA-N 2 2 315.421 1.981 20 10 DDCDLP COC[C@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)C1CCOCC1 ZINC000817940660 702530116 /nfs/dbraw/zinc/53/01/16/702530116.db2.gz GNDFTEYTDUNAHD-ROUUACIJSA-N 2 2 321.465 1.784 20 10 DDCDLP C[C@H]([NH2+]C[C@H]1C[NH2+]CCO1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817983294 702543532 /nfs/dbraw/zinc/54/35/32/702543532.db2.gz MCZHQXXCILJZIM-DZGCQCFKSA-N 2 2 323.412 1.301 20 10 DDCDLP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCO1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817983297 702543591 /nfs/dbraw/zinc/54/35/91/702543591.db2.gz MCZHQXXCILJZIM-ZFWWWQNUSA-N 2 2 323.412 1.301 20 10 DDCDLP CC[N@H+](C)C[C@H](O)C[NH+](C)CCN(C)c1ccc(OC)cc1 ZINC000847007301 703364931 /nfs/dbraw/zinc/36/49/31/703364931.db2.gz DKXLGRGNDCKVMF-INIZCTEOSA-N 2 2 309.454 1.376 20 10 DDCDLP CC[N@@H+](C)C[C@H](O)C[NH+](C)CCN(C)c1ccc(OC)cc1 ZINC000847007301 703364932 /nfs/dbraw/zinc/36/49/32/703364932.db2.gz DKXLGRGNDCKVMF-INIZCTEOSA-N 2 2 309.454 1.376 20 10 DDCDLP CC[NH+](C)C[C@H](O)C[N@H+](C)CCN(C)c1ccc(OC)cc1 ZINC000847007301 703364933 /nfs/dbraw/zinc/36/49/33/703364933.db2.gz DKXLGRGNDCKVMF-INIZCTEOSA-N 2 2 309.454 1.376 20 10 DDCDLP CC[NH+](C)C[C@H](O)C[N@@H+](C)CCN(C)c1ccc(OC)cc1 ZINC000847007301 703364934 /nfs/dbraw/zinc/36/49/34/703364934.db2.gz DKXLGRGNDCKVMF-INIZCTEOSA-N 2 2 309.454 1.376 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H]4CCC[C@]4([NH3+])C3)cc2)CC1 ZINC000857226248 704566050 /nfs/dbraw/zinc/56/60/50/704566050.db2.gz JAYUETDJVOHKSC-HKUYNNGSSA-N 3 2 314.477 1.752 20 10 DDCDLP CCOc1cccc(C[NH+]2CCC([N@@H+]3CC[C@@H](O)C3)CC2)c1O ZINC000827700810 706052893 /nfs/dbraw/zinc/05/28/93/706052893.db2.gz XODIEYQNZIKXQC-MRXNPFEDSA-N 2 2 320.433 1.822 20 10 DDCDLP CCOc1cccc(C[NH+]2CCC([N@H+]3CC[C@@H](O)C3)CC2)c1O ZINC000827700810 706052896 /nfs/dbraw/zinc/05/28/96/706052896.db2.gz XODIEYQNZIKXQC-MRXNPFEDSA-N 2 2 320.433 1.822 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1)c1c(O)cccc1F ZINC000886524906 708773122 /nfs/dbraw/zinc/77/31/22/708773122.db2.gz TXYYIIWEINGXMN-OLZOCXBDSA-N 2 2 323.412 1.769 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1c(O)cccc1F ZINC000886524906 708773124 /nfs/dbraw/zinc/77/31/24/708773124.db2.gz TXYYIIWEINGXMN-OLZOCXBDSA-N 2 2 323.412 1.769 20 10 DDCDLP Oc1cc(O)c(C[N@@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)c(O)c1 ZINC001144515572 772558478 /nfs/dbraw/zinc/55/84/78/772558478.db2.gz QTBXVKYOLLALEW-ZDUSSCGKSA-N 2 2 302.330 1.852 20 10 DDCDLP Oc1cc(O)c(C[N@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)c(O)c1 ZINC001144515572 772558480 /nfs/dbraw/zinc/55/84/80/772558480.db2.gz QTBXVKYOLLALEW-ZDUSSCGKSA-N 2 2 302.330 1.852 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+]CC3([NH3+])CCCC3)cc2F)CC1 ZINC001327075675 861854959 /nfs/dbraw/zinc/85/49/59/861854959.db2.gz XELSNMVFLFYUIN-UHFFFAOYSA-N 3 2 320.456 1.939 20 10 DDCDLP COC(=O)Cc1ccc(C[N@@H+]2C[C@H](C)CC[C@H]2C[NH3+])c(O)c1 ZINC001205855861 871864606 /nfs/dbraw/zinc/86/46/06/871864606.db2.gz PXUVGFPBWYBSPT-DOMZBBRYSA-N 2 2 306.406 1.667 20 10 DDCDLP COC(=O)Cc1ccc(C[N@H+]2C[C@H](C)CC[C@H]2C[NH3+])c(O)c1 ZINC001205855861 871864632 /nfs/dbraw/zinc/86/46/32/871864632.db2.gz PXUVGFPBWYBSPT-DOMZBBRYSA-N 2 2 306.406 1.667 20 10 DDCDLP C[C@H]([NH2+]C[C@@H](O)C[NH+](C)C)c1ccc(Br)cc1O ZINC000756556350 700627892 /nfs/dbraw/zinc/62/78/92/700627892.db2.gz NVIBKCLJSBITET-GXSJLCMTSA-N 2 2 317.227 1.728 20 10 DDCDLP CCN(C)c1ccc([C@@H](C)[NH2+]CC(=O)N2CC[NH+](C)CC2)cc1 ZINC000765415809 701010910 /nfs/dbraw/zinc/01/09/10/701010910.db2.gz AQMYJVKKYNRLOM-OAHLLOKOSA-N 2 2 318.465 1.567 20 10 DDCDLP COc1cccc(O)c1C[NH+]1CCC([N@H+](C)CCCO)CC1 ZINC000769429265 701244658 /nfs/dbraw/zinc/24/46/58/701244658.db2.gz WJEOIERZLHMNAS-UHFFFAOYSA-N 2 2 308.422 1.679 20 10 DDCDLP COc1cccc(O)c1C[NH+]1CCC([N@@H+](C)CCCO)CC1 ZINC000769429265 701244659 /nfs/dbraw/zinc/24/46/59/701244659.db2.gz WJEOIERZLHMNAS-UHFFFAOYSA-N 2 2 308.422 1.679 20 10 DDCDLP C[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H]1C[NH3+] ZINC000843052256 702808787 /nfs/dbraw/zinc/80/87/87/702808787.db2.gz QZPDJJPGAQALFB-APWZRJJASA-N 3 2 316.493 1.998 20 10 DDCDLP C[C@@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H]1C[NH3+] ZINC000843052256 702808788 /nfs/dbraw/zinc/80/87/88/702808788.db2.gz QZPDJJPGAQALFB-APWZRJJASA-N 3 2 316.493 1.998 20 10 DDCDLP C[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H]1C[NH3+] ZINC000843052257 702808945 /nfs/dbraw/zinc/80/89/45/702808945.db2.gz QZPDJJPGAQALFB-LPHOPBHVSA-N 3 2 316.493 1.998 20 10 DDCDLP C[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@H]1C[NH3+] ZINC000843052257 702808947 /nfs/dbraw/zinc/80/89/47/702808947.db2.gz QZPDJJPGAQALFB-LPHOPBHVSA-N 3 2 316.493 1.998 20 10 DDCDLP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1CC(=O)NCc1ccc(N(C)C)cc1 ZINC000846708175 703321891 /nfs/dbraw/zinc/32/18/91/703321891.db2.gz MRKFRXBANOUAJL-UKRRQHHQSA-N 2 2 304.438 1.180 20 10 DDCDLP C[C@@H]1C[C@H]([NH3+])CC[N@H+]1CC(=O)NCc1ccc(N(C)C)cc1 ZINC000846708175 703321893 /nfs/dbraw/zinc/32/18/93/703321893.db2.gz MRKFRXBANOUAJL-UKRRQHHQSA-N 2 2 304.438 1.180 20 10 DDCDLP COCC[N@H+](C)C[C@@H](O)C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000846861100 703343235 /nfs/dbraw/zinc/34/32/35/703343235.db2.gz NWLABWKWAGKTIC-YOEHRIQHSA-N 2 2 309.454 1.342 20 10 DDCDLP COCC[N@@H+](C)C[C@@H](O)C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000846861100 703343237 /nfs/dbraw/zinc/34/32/37/703343237.db2.gz NWLABWKWAGKTIC-YOEHRIQHSA-N 2 2 309.454 1.342 20 10 DDCDLP CC(C)[C@@H]([NH3+])C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001117953184 780960766 /nfs/dbraw/zinc/96/07/66/780960766.db2.gz CBIUFSDZKBHXKT-INIZCTEOSA-N 3 2 308.445 1.650 20 10 DDCDLP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC[C@H]1[NH3+] ZINC001118241806 781072800 /nfs/dbraw/zinc/07/28/00/781072800.db2.gz OKXWSDSKJYDIQH-RHSMWYFYSA-N 3 2 320.456 1.747 20 10 DDCDLP C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC[C@H]1[NH3+] ZINC001118241806 781072803 /nfs/dbraw/zinc/07/28/03/781072803.db2.gz OKXWSDSKJYDIQH-RHSMWYFYSA-N 3 2 320.456 1.747 20 10 DDCDLP C[C@@H]1CN(Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC[C@H]1[NH3+] ZINC001118241806 781072808 /nfs/dbraw/zinc/07/28/08/781072808.db2.gz OKXWSDSKJYDIQH-RHSMWYFYSA-N 2 2 320.456 1.747 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+]CCC[NH+]3CCC3)cc2F)CC1 ZINC001326848217 861655367 /nfs/dbraw/zinc/65/53/67/861655367.db2.gz YCJOAMZYGVPUOQ-UHFFFAOYSA-N 3 2 320.456 1.763 20 10 DDCDLP CCN(Cc1cc(C[NH+](C)C)c(O)c(OC)c1)C1C[NH+](C)C1 ZINC001139261040 860340677 /nfs/dbraw/zinc/34/06/77/860340677.db2.gz SKZGLMDKPKAXSC-UHFFFAOYSA-N 2 2 307.438 1.598 20 10 DDCDLP [NH3+][C@H](CC(=O)NC[C@H]1CC[NH2+]CC1(F)F)c1ccccc1O ZINC001220185403 878796308 /nfs/dbraw/zinc/79/63/08/878796308.db2.gz GZLYYQNQHVTCTO-ZYHUDNBSSA-N 2 2 313.348 1.143 20 10 DDCDLP Oc1c(F)cc(Cl)cc1C[N@@H+]1CCNC2(CC[NH2+]CC2)C1 ZINC001222104311 880257223 /nfs/dbraw/zinc/25/72/23/880257223.db2.gz DRJDUSQUOJPGGH-UHFFFAOYSA-N 2 2 313.804 1.712 20 10 DDCDLP Oc1c(F)cc(Cl)cc1C[N@H+]1CCNC2(CC[NH2+]CC2)C1 ZINC001222104311 880257234 /nfs/dbraw/zinc/25/72/34/880257234.db2.gz DRJDUSQUOJPGGH-UHFFFAOYSA-N 2 2 313.804 1.712 20 10 DDCDLP C[N@H+](CCn1cc[nH+]c1)Cc1ccc(N2CCOCC2)cc1 ZINC000272946129 130076354 /nfs/dbraw/zinc/07/63/54/130076354.db2.gz FLERODXIHOCESX-UHFFFAOYSA-N 2 2 300.406 1.852 20 10 DDCDLP C[N@@H+](CCn1cc[nH+]c1)Cc1ccc(N2CCOCC2)cc1 ZINC000272946129 130076355 /nfs/dbraw/zinc/07/63/55/130076355.db2.gz FLERODXIHOCESX-UHFFFAOYSA-N 2 2 300.406 1.852 20 10 DDCDLP C[C@H]([NH2+]CCC[N@@H+]1CCC[C@H]1C(N)=O)c1cc(F)ccc1O ZINC000273556276 130137140 /nfs/dbraw/zinc/13/71/40/130137140.db2.gz GXEXSSXGELUVKY-FZMZJTMJSA-N 2 2 309.385 1.522 20 10 DDCDLP C[C@H]([NH2+]CCC[N@H+]1CCC[C@H]1C(N)=O)c1cc(F)ccc1O ZINC000273556276 130137141 /nfs/dbraw/zinc/13/71/41/130137141.db2.gz GXEXSSXGELUVKY-FZMZJTMJSA-N 2 2 309.385 1.522 20 10 DDCDLP COc1ccc(O)c(C[N@@H+]2CC[C@H](C[NH+]3CCOCC3)C2)c1 ZINC000180453476 524744391 /nfs/dbraw/zinc/74/43/91/524744391.db2.gz QAZDHESIFFSJSQ-CQSZACIVSA-N 2 2 306.406 1.555 20 10 DDCDLP COc1ccc(O)c(C[N@H+]2CC[C@H](C[NH+]3CCOCC3)C2)c1 ZINC000180453476 524744398 /nfs/dbraw/zinc/74/43/98/524744398.db2.gz QAZDHESIFFSJSQ-CQSZACIVSA-N 2 2 306.406 1.555 20 10 DDCDLP C[C@H](C[C@@H]1COCC[NH2+]1)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000817896180 702512035 /nfs/dbraw/zinc/51/20/35/702512035.db2.gz ZBHBNIRZOHTSMQ-NVXWUHKLSA-N 2 2 319.449 1.380 20 10 DDCDLP CC[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)CC[C@H]1[NH3+] ZINC000843051053 702808516 /nfs/dbraw/zinc/80/85/16/702808516.db2.gz UFLQLAXAAAPHMU-ZYHUDNBSSA-N 2 2 309.366 1.868 20 10 DDCDLP CC[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)CC[C@H]1[NH3+] ZINC000843051053 702808519 /nfs/dbraw/zinc/80/85/19/702808519.db2.gz UFLQLAXAAAPHMU-ZYHUDNBSSA-N 2 2 309.366 1.868 20 10 DDCDLP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1(C[NH3+])CCC1 ZINC000843125313 702824937 /nfs/dbraw/zinc/82/49/37/702824937.db2.gz SCVGRHMDUJXBRR-UHFFFAOYSA-N 3 2 302.466 1.752 20 10 DDCDLP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1(C[NH3+])CCC1 ZINC000843125313 702824939 /nfs/dbraw/zinc/82/49/39/702824939.db2.gz SCVGRHMDUJXBRR-UHFFFAOYSA-N 3 2 302.466 1.752 20 10 DDCDLP CN(C)c1ccc(CN(C)C(=O)C[NH2+][C@](C)(C[NH3+])C2CC2)cc1 ZINC000844221055 702995842 /nfs/dbraw/zinc/99/58/42/702995842.db2.gz ROFZPKZIMOHALB-GOSISDBHSA-N 2 2 318.465 1.428 20 10 DDCDLP C[C@H]([NH2+]Cc1nc(C[NH3+])cc(=O)[nH]1)c1cc(F)cc(F)c1O ZINC000854231198 704369480 /nfs/dbraw/zinc/36/94/80/704369480.db2.gz BVKYITFRGVRDFI-ZETCQYMHSA-N 2 2 310.304 1.476 20 10 DDCDLP C[N@@H+]1CCC[C@H]1C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876985871 705949769 /nfs/dbraw/zinc/94/97/69/705949769.db2.gz SHVBCFGCYXPHDE-KRWDZBQOSA-N 2 2 303.450 1.832 20 10 DDCDLP C[N@H+]1CCC[C@H]1C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876985871 705949772 /nfs/dbraw/zinc/94/97/72/705949772.db2.gz SHVBCFGCYXPHDE-KRWDZBQOSA-N 2 2 303.450 1.832 20 10 DDCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]CC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000903917073 711330939 /nfs/dbraw/zinc/33/09/39/711330939.db2.gz KOEIWBREFQTXDM-NPVYPNSJSA-N 3 2 302.466 1.873 20 10 DDCDLP COC(=O)C1C[NH+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139255883 860339501 /nfs/dbraw/zinc/33/95/01/860339501.db2.gz SLDKCDNKLGZRCH-UHFFFAOYSA-N 2 2 308.378 1.067 20 10 DDCDLP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ncccn1 ZINC001139404668 860388875 /nfs/dbraw/zinc/38/88/75/860388875.db2.gz VEXFJOHWVOCPGW-UHFFFAOYSA-N 2 2 311.433 1.860 20 10 DDCDLP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)Cc1ncccn1 ZINC001139404668 860388882 /nfs/dbraw/zinc/38/88/82/860388882.db2.gz VEXFJOHWVOCPGW-UHFFFAOYSA-N 2 2 311.433 1.860 20 10 DDCDLP Cc1ccc(O)c(C[NH+]2CCN(CC[NH+]3CCOCC3)CC2)c1 ZINC001140621311 860664421 /nfs/dbraw/zinc/66/44/21/860664421.db2.gz VJWVODIPFUJONR-UHFFFAOYSA-N 2 2 319.449 1.150 20 10 DDCDLP [NH3+]C[C@H]1C[N@H+](Cc2c(O)cccc2OC(F)(F)F)C[C@H]1O ZINC001206492579 872378237 /nfs/dbraw/zinc/37/82/37/872378237.db2.gz XRPWZLJLGLXNRP-GZMMTYOYSA-N 2 2 306.284 1.042 20 10 DDCDLP [NH3+]C[C@H]1C[N@@H+](Cc2c(O)cccc2OC(F)(F)F)C[C@H]1O ZINC001206492579 872378254 /nfs/dbraw/zinc/37/82/54/872378254.db2.gz XRPWZLJLGLXNRP-GZMMTYOYSA-N 2 2 306.284 1.042 20 10 DDCDLP CCOCc1cc(C[NH2+]CC[N@H+](CC)CCO)ccc1OC ZINC000274464526 130237875 /nfs/dbraw/zinc/23/78/75/130237875.db2.gz YBBANAFARWNJGH-UHFFFAOYSA-N 2 2 310.438 1.636 20 10 DDCDLP CCOCc1cc(C[NH2+]CC[N@@H+](CC)CCO)ccc1OC ZINC000274464526 130237877 /nfs/dbraw/zinc/23/78/77/130237877.db2.gz YBBANAFARWNJGH-UHFFFAOYSA-N 2 2 310.438 1.636 20 10 DDCDLP Cc1cc(C[NH+]2CCN(C(=O)C[NH+](C)C)CC2)ccc1N(C)C ZINC000293599883 409145774 /nfs/dbraw/zinc/14/57/74/409145774.db2.gz UYNXDDPARKWUGI-UHFFFAOYSA-N 2 2 318.465 1.267 20 10 DDCDLP COc1c(O)c(C[NH2+][C@@H]2CCn3cc[nH+]c3C2)ccc1[N+](=O)[O-] ZINC000775086364 697961622 /nfs/dbraw/zinc/96/16/22/697961622.db2.gz FJKGDIFFOSAYQC-LLVKDONJSA-N 2 2 318.333 1.610 20 10 DDCDLP [NH3+]C[C@@H]1C[N@H+](Cc2cc(Br)ccc2O)CCCO1 ZINC000313356135 698682298 /nfs/dbraw/zinc/68/22/98/698682298.db2.gz RMYRBDNBXNFEDO-GFCCVEGCSA-N 2 2 315.211 1.704 20 10 DDCDLP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCO1)c1cc(Br)ccc1O ZINC000817982813 702542770 /nfs/dbraw/zinc/54/27/70/702542770.db2.gz HVGLAHRHUUSVPC-MWLCHTKSSA-N 2 2 315.211 1.794 20 10 DDCDLP C[N@@H+]1CCN(Cc2ccc(N3CCCCC3)cc2)[C@@H](C[NH3+])C1 ZINC000843120376 702823471 /nfs/dbraw/zinc/82/34/71/702823471.db2.gz HYIBIGOXHFSJLI-SFHVURJKSA-N 2 2 302.466 1.752 20 10 DDCDLP C[N@H+]1CCN(Cc2ccc(N3CCCCC3)cc2)[C@@H](C[NH3+])C1 ZINC000843120376 702823474 /nfs/dbraw/zinc/82/34/74/702823474.db2.gz HYIBIGOXHFSJLI-SFHVURJKSA-N 2 2 302.466 1.752 20 10 DDCDLP COc1ccc(O)c(C[NH+]2CCC([N@@H+]3CC[C@H](O)C3)CC2)c1 ZINC000827698699 706051857 /nfs/dbraw/zinc/05/18/57/706051857.db2.gz AYDZAXYRKVRBOI-HNNXBMFYSA-N 2 2 306.406 1.432 20 10 DDCDLP COc1ccc(O)c(C[NH+]2CCC([N@H+]3CC[C@H](O)C3)CC2)c1 ZINC000827698699 706051861 /nfs/dbraw/zinc/05/18/61/706051861.db2.gz AYDZAXYRKVRBOI-HNNXBMFYSA-N 2 2 306.406 1.432 20 10 DDCDLP C[NH+](C)CCN1CCC([NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC000882887475 707838390 /nfs/dbraw/zinc/83/83/90/707838390.db2.gz SWFBBMFPXXJBSW-UHFFFAOYSA-N 2 2 313.392 1.786 20 10 DDCDLP Oc1cc2c(cc1C[NH2+][C@@H]1C[NH2+]CC3(CCOCC3)C1)OCO2 ZINC000903973843 711353365 /nfs/dbraw/zinc/35/33/65/711353365.db2.gz IZHVPPWOTASPLR-ZDUSSCGKSA-N 2 2 320.389 1.369 20 10 DDCDLP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000925762657 714930279 /nfs/dbraw/zinc/93/02/79/714930279.db2.gz MXQZAUQNJFRFSK-QAPCUYQASA-N 3 2 302.466 1.669 20 10 DDCDLP CN(C)c1ccc(CN(C)C(=O)C[NH+]2CCC([NH3+])CC2)cc1 ZINC000316085947 879277315 /nfs/dbraw/zinc/27/73/15/879277315.db2.gz JEDPQLPEUUTXSI-UHFFFAOYSA-N 2 2 304.438 1.134 20 10 DDCDLP COc1cc(C)c(CN2CC[NH2+][C@H]3CC[NH2+]CC[C@@H]32)c(O)c1 ZINC001222511051 880527091 /nfs/dbraw/zinc/52/70/91/880527091.db2.gz MAWLECWTANEICU-HOTGVXAUSA-N 2 2 305.422 1.235 20 10 DDCDLP C[NH+](C)CCN1CC[NH+](Cc2cc(F)c(Cl)cc2O)CC1 ZINC001237940044 889950037 /nfs/dbraw/zinc/95/00/37/889950037.db2.gz ANIMWMGNMKUKFR-UHFFFAOYSA-N 2 2 315.820 1.864 20 10 DDCDLP CCOCc1cc(C[NH2+]C[C@@](C)(O)C[NH+](C)C)ccc1OC ZINC000178998419 407685799 /nfs/dbraw/zinc/68/57/99/407685799.db2.gz KBVNYUOIKWWTFV-QGZVFWFLSA-N 2 2 310.438 1.634 20 10 DDCDLP C[NH+]1CCC([N@H+](CCO)Cc2cc3c(cc2O)OCO3)CC1 ZINC000155493409 408170893 /nfs/dbraw/zinc/17/08/93/408170893.db2.gz SYZVGUHPWILENA-UHFFFAOYSA-N 2 2 308.378 1.009 20 10 DDCDLP C[NH+]1CCC([N@@H+](CCO)Cc2cc3c(cc2O)OCO3)CC1 ZINC000155493409 408170898 /nfs/dbraw/zinc/17/08/98/408170898.db2.gz SYZVGUHPWILENA-UHFFFAOYSA-N 2 2 308.378 1.009 20 10 DDCDLP CC[C@@H]([NH2+]CCC[N@@H+]1CCC[C@H]1C(N)=O)c1ccc(F)cc1O ZINC000286161823 280187015 /nfs/dbraw/zinc/18/70/15/280187015.db2.gz PWWTVMGTPFZLIP-CABCVRRESA-N 2 2 323.412 1.912 20 10 DDCDLP CC[C@@H]([NH2+]CCC[N@H+]1CCC[C@H]1C(N)=O)c1ccc(F)cc1O ZINC000286161823 280187016 /nfs/dbraw/zinc/18/70/16/280187016.db2.gz PWWTVMGTPFZLIP-CABCVRRESA-N 2 2 323.412 1.912 20 10 DDCDLP CCN(C)c1ccc(C[NH+]2CCN(C(=O)C[NH+](C)C)CC2)cc1 ZINC000773733521 697798745 /nfs/dbraw/zinc/79/87/45/697798745.db2.gz XFBMMDONEABLEC-UHFFFAOYSA-N 2 2 318.465 1.349 20 10 DDCDLP CCN(CC)C(=O)C[C@@H](C)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817938231 702530015 /nfs/dbraw/zinc/53/00/15/702530015.db2.gz HDGVZSOHGTZYAM-RHSMWYFYSA-N 2 2 320.481 1.989 20 10 DDCDLP C[C@H]1C[C@@H]([NH3+])CC[N@@H+]1CC(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000846708874 703322229 /nfs/dbraw/zinc/32/22/29/703322229.db2.gz XAIFGJBMRFOYKO-HOCLYGCPSA-N 2 2 318.465 1.523 20 10 DDCDLP C[C@H]1C[C@@H]([NH3+])CC[N@H+]1CC(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000846708874 703322231 /nfs/dbraw/zinc/32/22/31/703322231.db2.gz XAIFGJBMRFOYKO-HOCLYGCPSA-N 2 2 318.465 1.523 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ccno3)cc2F)CC1 ZINC001329506800 863701764 /nfs/dbraw/zinc/70/17/64/863701764.db2.gz LBVRLDKUWIBQMF-UHFFFAOYSA-N 2 2 304.369 1.855 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@@]2(CCC[NH2+]2)C1 ZINC001222471160 880491587 /nfs/dbraw/zinc/49/15/87/880491587.db2.gz MGRFNPFRRLCXTD-SFHVURJKSA-N 3 2 300.450 1.424 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CC[C@@]2(CCC[NH2+]2)C1 ZINC001222471160 880491592 /nfs/dbraw/zinc/49/15/92/880491592.db2.gz MGRFNPFRRLCXTD-SFHVURJKSA-N 3 2 300.450 1.424 20 10 DDCDLP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(O)c(O)c(O)c1 ZINC001276832716 880674285 /nfs/dbraw/zinc/67/42/85/880674285.db2.gz ACGAVVNSSSOHMK-OKILXGFUSA-N 2 2 321.421 1.014 20 10 DDCDLP C[NH+](C)CCN1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc(O)c(O)c(O)c1 ZINC001276832716 880674292 /nfs/dbraw/zinc/67/42/92/880674292.db2.gz ACGAVVNSSSOHMK-OKILXGFUSA-N 2 2 321.421 1.014 20 10 DDCDLP COc1cccc(C[N@@H+]2CC[C@H](C[NH+]3CCOCC3)C2)c1O ZINC000093664960 407200688 /nfs/dbraw/zinc/20/06/88/407200688.db2.gz ZLDGTVMMLROKNQ-CQSZACIVSA-N 2 2 306.406 1.555 20 10 DDCDLP COc1cccc(C[N@H+]2CC[C@H](C[NH+]3CCOCC3)C2)c1O ZINC000093664960 407200690 /nfs/dbraw/zinc/20/06/90/407200690.db2.gz ZLDGTVMMLROKNQ-CQSZACIVSA-N 2 2 306.406 1.555 20 10 DDCDLP C[C@@H]1C[N@H+](Cc2cc(F)ccc2O)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000368605836 418723083 /nfs/dbraw/zinc/72/30/83/418723083.db2.gz ZFKJRVBKCRHHDP-PBHICJAKSA-N 2 2 321.440 1.989 20 10 DDCDLP C[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000368605836 418723084 /nfs/dbraw/zinc/72/30/84/418723084.db2.gz ZFKJRVBKCRHHDP-PBHICJAKSA-N 2 2 321.440 1.989 20 10 DDCDLP CC[N@@H+]1CCO[C@H](CN2CC[NH+](Cc3ccccc3O)CC2)C1 ZINC000378493655 418723948 /nfs/dbraw/zinc/72/39/48/418723948.db2.gz IWXIYONMCDPXRJ-KRWDZBQOSA-N 2 2 319.449 1.231 20 10 DDCDLP CC[N@H+]1CCO[C@H](CN2CC[NH+](Cc3ccccc3O)CC2)C1 ZINC000378493655 418723951 /nfs/dbraw/zinc/72/39/51/418723951.db2.gz IWXIYONMCDPXRJ-KRWDZBQOSA-N 2 2 319.449 1.231 20 10 DDCDLP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@H](C)c1cc(F)cc(F)c1O ZINC000756555988 700627802 /nfs/dbraw/zinc/62/78/02/700627802.db2.gz YJSDXGFDTZMFHC-VXGBXAGGSA-N 2 2 313.392 1.957 20 10 DDCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc(C(N)=O)cc2)cc1 ZINC000841044214 702321099 /nfs/dbraw/zinc/32/10/99/702321099.db2.gz ULTDIJYOOPEGAF-KRWDZBQOSA-N 2 2 312.417 1.641 20 10 DDCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cccc(C(N)=O)c2)cc1 ZINC000841042847 702321302 /nfs/dbraw/zinc/32/13/02/702321302.db2.gz LUKHKHJZKBWYKN-KRWDZBQOSA-N 2 2 312.417 1.641 20 10 DDCDLP CCN(C)c1ccc(C[N@H+](C)CC(=O)N2CC[NH+](C)CC2)cc1 ZINC000879355830 706659338 /nfs/dbraw/zinc/65/93/38/706659338.db2.gz OSMLNYOLIAAXPT-UHFFFAOYSA-N 2 2 318.465 1.349 20 10 DDCDLP CCN(C)c1ccc(C[N@@H+](C)CC(=O)N2CC[NH+](C)CC2)cc1 ZINC000879355830 706659341 /nfs/dbraw/zinc/65/93/41/706659341.db2.gz OSMLNYOLIAAXPT-UHFFFAOYSA-N 2 2 318.465 1.349 20 10 DDCDLP C[C@H]([NH2+]C[C@H]1C[NH2+]CCO1)c1ccc(Br)cc1O ZINC000817982576 702542839 /nfs/dbraw/zinc/54/28/39/702542839.db2.gz GJTNLFGJZNVAME-GXSJLCMTSA-N 2 2 315.211 1.794 20 10 DDCDLP Cc1cc(O)c(C[N@H+](C)CC(=O)N2CC[NH2+]CC2)c(Cl)c1 ZINC000843044078 702807504 /nfs/dbraw/zinc/80/75/04/702807504.db2.gz CHFBFIZLSSGFHM-UHFFFAOYSA-N 2 2 311.813 1.218 20 10 DDCDLP Cc1cc(O)c(C[N@@H+](C)CC(=O)N2CC[NH2+]CC2)c(Cl)c1 ZINC000843044078 702807508 /nfs/dbraw/zinc/80/75/08/702807508.db2.gz CHFBFIZLSSGFHM-UHFFFAOYSA-N 2 2 311.813 1.218 20 10 DDCDLP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)CCn2cc[nH+]c2)cc1 ZINC000844163337 702980531 /nfs/dbraw/zinc/98/05/31/702980531.db2.gz ZTJRSNCJTAIQGD-HNNXBMFYSA-N 2 2 301.394 1.155 20 10 DDCDLP COc1cc(Br)cc(C[NH2+][C@@H]2C[NH2+]C[C@H]2C)c1O ZINC000903960778 711348876 /nfs/dbraw/zinc/34/88/76/711348876.db2.gz ZHYTVUZIWZAHIT-LDYMZIIASA-N 2 2 315.211 1.861 20 10 DDCDLP CO[C@@H]1C[N@H+](Cc2ccc(N3CCOCC3)cc2)[C@@](C)(C[NH3+])C1 ZINC000923413624 714347971 /nfs/dbraw/zinc/34/79/71/714347971.db2.gz WLDCZWPJMPVQKG-ZWKOTPCHSA-N 2 2 319.449 1.461 20 10 DDCDLP CO[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2)[C@@](C)(C[NH3+])C1 ZINC000923413624 714347973 /nfs/dbraw/zinc/34/79/73/714347973.db2.gz WLDCZWPJMPVQKG-ZWKOTPCHSA-N 2 2 319.449 1.461 20 10 DDCDLP C[NH2+]C[C@@H](C)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001325267247 867900569 /nfs/dbraw/zinc/90/05/69/867900569.db2.gz KSXDNVGVGGJVGG-CQSZACIVSA-N 3 2 308.445 1.523 20 10 DDCDLP C[C@H]1CC[C@H](C[NH3+])[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001205817030 871832848 /nfs/dbraw/zinc/83/28/48/871832848.db2.gz PONPBLHCXCWLOH-QFBILLFUSA-N 3 2 316.493 1.998 20 10 DDCDLP C[C@H]1CC[C@H](C[NH3+])[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001205817030 871832859 /nfs/dbraw/zinc/83/28/59/871832859.db2.gz PONPBLHCXCWLOH-QFBILLFUSA-N 3 2 316.493 1.998 20 10 DDCDLP C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1[NH3+] ZINC001205868962 871877967 /nfs/dbraw/zinc/87/79/67/871877967.db2.gz YXTDPWPAKWHTLM-QAPCUYQASA-N 3 2 302.466 1.608 20 10 DDCDLP C[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C[C@@H]1[NH3+] ZINC001205868962 871877975 /nfs/dbraw/zinc/87/79/75/871877975.db2.gz YXTDPWPAKWHTLM-QAPCUYQASA-N 3 2 302.466 1.608 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@@H+]1CCC[C@@H]1C(N)=O)c1ccc(N(C)C)cc1 ZINC000268884743 296123140 /nfs/dbraw/zinc/12/31/40/296123140.db2.gz IJJQKNCHKPSWNN-RHSMWYFYSA-N 2 2 318.465 1.743 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@@H]1C(N)=O)c1ccc(N(C)C)cc1 ZINC000268884743 296123141 /nfs/dbraw/zinc/12/31/41/296123141.db2.gz IJJQKNCHKPSWNN-RHSMWYFYSA-N 2 2 318.465 1.743 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@@H]1C(=O)N(C)C)c1ccccc1O ZINC000272898572 130072762 /nfs/dbraw/zinc/07/27/62/130072762.db2.gz UQHNLRQPLWCYDI-GDBMZVCRSA-N 2 2 319.449 1.986 20 10 DDCDLP COc1c(O)c(C[NH2+]CCCn2cc[nH+]c2)ccc1[N+](=O)[O-] ZINC000278612058 409085864 /nfs/dbraw/zinc/08/58/64/409085864.db2.gz DWZJRIYKWLCSHI-UHFFFAOYSA-N 2 2 306.322 1.685 20 10 DDCDLP COc1ccc([NH+]2CCC(N(C)C(=O)C(C)(C)[NH3+])CC2)cc1 ZINC000370767517 418748383 /nfs/dbraw/zinc/74/83/83/418748383.db2.gz UVTMBYNZQOPZSU-UHFFFAOYSA-N 2 2 305.422 1.860 20 10 DDCDLP COc1ccc([NH+]2CCC(N(C)C(=O)C[NH+](C)C)CC2)cc1 ZINC000368917599 418726867 /nfs/dbraw/zinc/72/68/67/418726867.db2.gz LZWJDRXFQASNLG-UHFFFAOYSA-N 2 2 305.422 1.684 20 10 DDCDLP C[N@@H+]1CCN(Cc2cc(Br)ccc2O)[C@@H](C[NH3+])C1 ZINC000234359774 697791548 /nfs/dbraw/zinc/79/15/48/697791548.db2.gz MJMAIDROKURRJQ-LBPRGKRZSA-N 2 2 314.227 1.229 20 10 DDCDLP C[N@H+]1CCN(Cc2cc(Br)ccc2O)[C@@H](C[NH3+])C1 ZINC000234359774 697791549 /nfs/dbraw/zinc/79/15/49/697791549.db2.gz MJMAIDROKURRJQ-LBPRGKRZSA-N 2 2 314.227 1.229 20 10 DDCDLP CC[C@@H]([NH2+]CC(=O)N1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000796731014 699949408 /nfs/dbraw/zinc/94/94/08/699949408.db2.gz UTDMOGLFACNNOO-CQSZACIVSA-N 2 2 309.385 1.346 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCC[C@H]3[NH3+])cc2F)CC1 ZINC000817902689 702515122 /nfs/dbraw/zinc/51/51/22/702515122.db2.gz XCLZUULZTNDWBT-SJORKVTESA-N 3 2 320.456 1.937 20 10 DDCDLP CC[NH+]1CCN(c2ccc(CN[C@H]3CCC[C@H]3[NH3+])cc2F)CC1 ZINC000817902689 702515125 /nfs/dbraw/zinc/51/51/25/702515125.db2.gz XCLZUULZTNDWBT-SJORKVTESA-N 2 2 320.456 1.937 20 10 DDCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000843125908 702825166 /nfs/dbraw/zinc/82/51/66/702825166.db2.gz KQIONABWGAZBPL-KYHPRHEASA-N 3 2 302.466 1.730 20 10 DDCDLP CC[N@H+](C)C[C@H](O)C[NH+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000846765948 703328291 /nfs/dbraw/zinc/32/82/91/703328291.db2.gz GGFJXCXCJOVURW-SFHVURJKSA-N 2 2 321.465 1.268 20 10 DDCDLP CC[N@@H+](C)C[C@H](O)C[NH+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000846765948 703328295 /nfs/dbraw/zinc/32/82/95/703328295.db2.gz GGFJXCXCJOVURW-SFHVURJKSA-N 2 2 321.465 1.268 20 10 DDCDLP CC[NH+](C)C[C@H](O)C[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000846765948 703328297 /nfs/dbraw/zinc/32/82/97/703328297.db2.gz GGFJXCXCJOVURW-SFHVURJKSA-N 2 2 321.465 1.268 20 10 DDCDLP CC[NH+](C)C[C@H](O)C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000846765948 703328299 /nfs/dbraw/zinc/32/82/99/703328299.db2.gz GGFJXCXCJOVURW-SFHVURJKSA-N 2 2 321.465 1.268 20 10 DDCDLP Oc1ccc(C[NH+]2CCN(CC[NH+]3CCCC3)CC2)cc1O ZINC001203880491 747204231 /nfs/dbraw/zinc/20/42/31/747204231.db2.gz UGYRCZYVUIZVHZ-UHFFFAOYSA-N 2 2 305.422 1.311 20 10 DDCDLP C[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C[NH+](C)C ZINC001117674256 780877970 /nfs/dbraw/zinc/87/79/70/780877970.db2.gz ZNJCTFGDDYMCCX-OAHLLOKOSA-N 3 2 322.472 1.865 20 10 DDCDLP C[C@H](C[NH2+]Cc1ccc(N2CCN(C)CC2)c(F)c1)C[NH+](C)C ZINC001117674256 780877971 /nfs/dbraw/zinc/87/79/71/780877971.db2.gz ZNJCTFGDDYMCCX-OAHLLOKOSA-N 2 2 322.472 1.865 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH+]3CC(C(C)(C)O)C3)cc2F)CC1 ZINC001117867160 780921574 /nfs/dbraw/zinc/92/15/74/780921574.db2.gz ADPXRIQSGMIHIW-UHFFFAOYSA-N 2 2 321.440 1.780 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[NH+]3CC(NC(C)=O)C3)cc2)CC1 ZINC001140304223 860614973 /nfs/dbraw/zinc/61/49/73/860614973.db2.gz JJSJFSZWPXQLOM-UHFFFAOYSA-N 2 2 316.449 1.149 20 10 DDCDLP C[C@H]1CC[C@@H](C[NH3+])[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001205069039 871351712 /nfs/dbraw/zinc/35/17/12/871351712.db2.gz SFCRRGHWPWZDFB-YJBOKZPZSA-N 3 2 302.466 1.750 20 10 DDCDLP C[C@H]1CC[C@@H](C[NH3+])[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001205069039 871351726 /nfs/dbraw/zinc/35/17/26/871351726.db2.gz SFCRRGHWPWZDFB-YJBOKZPZSA-N 3 2 302.466 1.750 20 10 DDCDLP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@@]12CCC[NH2+]C2 ZINC001222198605 880323475 /nfs/dbraw/zinc/32/34/75/880323475.db2.gz XRIOTLOGXCBORN-GOSISDBHSA-N 3 2 316.449 1.130 20 10 DDCDLP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CC[C@@]12CCC[NH2+]C2 ZINC001222198605 880323482 /nfs/dbraw/zinc/32/34/82/880323482.db2.gz XRIOTLOGXCBORN-GOSISDBHSA-N 3 2 316.449 1.130 20 10 DDCDLP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccc(F)c(F)c1O ZINC000187707790 407880435 /nfs/dbraw/zinc/88/04/35/407880435.db2.gz NDLGPYHCWWSQPM-VXGBXAGGSA-N 2 2 313.392 1.957 20 10 DDCDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@@H](O)C[NH+]2CCCC2)c1 ZINC000273375920 536793299 /nfs/dbraw/zinc/79/32/99/536793299.db2.gz HFDWIBZIBJVTTE-GXTWGEPZSA-N 2 2 322.405 1.286 20 10 DDCDLP C[C@H](C[C@H]1COCC[NH2+]1)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000817896182 702511402 /nfs/dbraw/zinc/51/14/02/702511402.db2.gz ZBHBNIRZOHTSMQ-WBVHZDCISA-N 2 2 319.449 1.380 20 10 DDCDLP CC[C@@H](Cn1cncn1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817942894 702531806 /nfs/dbraw/zinc/53/18/06/702531806.db2.gz RGGWYQHATCKYDO-GOEBONIOSA-N 2 2 302.426 1.412 20 10 DDCDLP Cc1ccc(O)c(C[N@@H+]2CCC[C@H](N3CC[NH2+]CC3=O)C2)c1 ZINC000843065906 702812019 /nfs/dbraw/zinc/81/20/19/702812019.db2.gz RENKYLIZNAFBEQ-HNNXBMFYSA-N 2 2 303.406 1.097 20 10 DDCDLP Cc1ccc(O)c(C[N@H+]2CCC[C@H](N3CC[NH2+]CC3=O)C2)c1 ZINC000843065906 702812021 /nfs/dbraw/zinc/81/20/21/702812021.db2.gz RENKYLIZNAFBEQ-HNNXBMFYSA-N 2 2 303.406 1.097 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@@H+]2CCC[C@@H](C[NH3+])C2)cc1 ZINC000844218148 702994432 /nfs/dbraw/zinc/99/44/32/702994432.db2.gz TWXABBSTSPLROQ-HNNXBMFYSA-N 2 2 304.438 1.040 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@H+]2CCC[C@@H](C[NH3+])C2)cc1 ZINC000844218148 702994434 /nfs/dbraw/zinc/99/44/34/702994434.db2.gz TWXABBSTSPLROQ-HNNXBMFYSA-N 2 2 304.438 1.040 20 10 DDCDLP Cc1cc(N(C)C)ccc1C[N@@H+]1CCN(CC[NH+](C)C)C(=O)C1 ZINC000846014879 703226908 /nfs/dbraw/zinc/22/69/08/703226908.db2.gz UPRZFVASXHHIHG-UHFFFAOYSA-N 2 2 318.465 1.267 20 10 DDCDLP Cc1cc(N(C)C)ccc1C[N@H+]1CCN(CC[NH+](C)C)C(=O)C1 ZINC000846014879 703226910 /nfs/dbraw/zinc/22/69/10/703226910.db2.gz UPRZFVASXHHIHG-UHFFFAOYSA-N 2 2 318.465 1.267 20 10 DDCDLP COc1cccc(O)c1C[NH2+]C1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000850396588 703729712 /nfs/dbraw/zinc/72/97/12/703729712.db2.gz LPVIYPZBFDUOHD-CQSZACIVSA-N 2 2 306.406 1.744 20 10 DDCDLP CCOC(=O)C[N@H+](CCn1cc[nH+]c1C)Cc1ccccc1O ZINC000823576254 705270763 /nfs/dbraw/zinc/27/07/63/705270763.db2.gz JYYNPBJPEVYDKY-UHFFFAOYSA-N 2 2 317.389 1.962 20 10 DDCDLP CCOC(=O)C[N@@H+](CCn1cc[nH+]c1C)Cc1ccccc1O ZINC000823576254 705270767 /nfs/dbraw/zinc/27/07/67/705270767.db2.gz JYYNPBJPEVYDKY-UHFFFAOYSA-N 2 2 317.389 1.962 20 10 DDCDLP OC1CCN(c2ccc(C[NH2+]CCn3cc[nH+]c3)cc2)CC1 ZINC000876893548 705912130 /nfs/dbraw/zinc/91/21/30/705912130.db2.gz ZHWLYCJNQBUYEF-UHFFFAOYSA-N 2 2 300.406 1.634 20 10 DDCDLP CN(C)c1ccc([C@H](CNC(=O)Cc2c[nH]c[nH+]2)[NH+](C)C)cc1 ZINC000891248239 710141344 /nfs/dbraw/zinc/14/13/44/710141344.db2.gz XDDPHOMHSIORBE-INIZCTEOSA-N 2 2 315.421 1.437 20 10 DDCDLP Cc1nnc([C@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[nH]1 ZINC000894773663 711266304 /nfs/dbraw/zinc/26/63/04/711266304.db2.gz ZSJBBFSEKSXCLY-ZDUSSCGKSA-N 2 2 314.437 1.716 20 10 DDCDLP C[C@@H]([NH3+])[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001326232934 861217117 /nfs/dbraw/zinc/21/71/17/861217117.db2.gz UGHATQCCATWMTH-ZBFHGGJFSA-N 3 2 320.456 1.747 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H](C)[C@H]([NH3+])C3)cc2)CC1 ZINC001206058648 872023743 /nfs/dbraw/zinc/02/37/43/872023743.db2.gz LHLFSZRORXFWGE-CRAIPNDOSA-N 3 2 302.466 1.608 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H](C)[C@H]([NH3+])C3)cc2)CC1 ZINC001206058648 872023755 /nfs/dbraw/zinc/02/37/55/872023755.db2.gz LHLFSZRORXFWGE-CRAIPNDOSA-N 3 2 302.466 1.608 20 10 DDCDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@H](O)C[NH+]2CCCC2)c1 ZINC000273375925 130114727 /nfs/dbraw/zinc/11/47/27/130114727.db2.gz HFDWIBZIBJVTTE-OCCSQVGLSA-N 2 2 322.405 1.286 20 10 DDCDLP C[NH2+]C[C@H](C)C(=O)N(C)C1CC[NH+](c2ccc(OC)cc2)CC1 ZINC000378210431 418719904 /nfs/dbraw/zinc/71/99/04/418719904.db2.gz MVMXBJPTUKRNTR-AWEZNQCLSA-N 2 2 319.449 1.978 20 10 DDCDLP C[C@H]1C(=O)N(C)CC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000779199983 698401331 /nfs/dbraw/zinc/40/13/31/698401331.db2.gz OVUBDTKLKXLITM-HNNXBMFYSA-N 2 2 316.449 1.101 20 10 DDCDLP C[C@H]1C(=O)N(C)CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000779199983 698401332 /nfs/dbraw/zinc/40/13/32/698401332.db2.gz OVUBDTKLKXLITM-HNNXBMFYSA-N 2 2 316.449 1.101 20 10 DDCDLP CCc1nnc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[nH]1 ZINC000824446047 705453983 /nfs/dbraw/zinc/45/39/83/705453983.db2.gz QTXOIISUNGULDC-UHFFFAOYSA-N 2 2 314.437 1.409 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@H]3[C@H](CC[NH+]3C)C2)ccc1[N+](=O)[O-] ZINC000877743568 706195681 /nfs/dbraw/zinc/19/56/81/706195681.db2.gz WVOMPDFEGZVGOE-YPMHNXCESA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@H]3[C@H](CC[NH+]3C)C2)ccc1[N+](=O)[O-] ZINC000877743568 706195682 /nfs/dbraw/zinc/19/56/82/706195682.db2.gz WVOMPDFEGZVGOE-YPMHNXCESA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@H]3[C@H](CC[N@@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000877743568 706195685 /nfs/dbraw/zinc/19/56/85/706195685.db2.gz WVOMPDFEGZVGOE-YPMHNXCESA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@H]3[C@H](CC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000877743568 706195687 /nfs/dbraw/zinc/19/56/87/706195687.db2.gz WVOMPDFEGZVGOE-YPMHNXCESA-N 2 2 321.377 1.835 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+]Cc3csnn3)cc2)CC1 ZINC000865678117 706494623 /nfs/dbraw/zinc/49/46/23/706494623.db2.gz WQMAXWSXFNTMDX-UHFFFAOYSA-N 2 2 303.435 1.580 20 10 DDCDLP C[NH+](C)C1CC([NH2+]Cc2ccc(N3CCC(O)CC3)cc2)C1 ZINC000883153252 707942210 /nfs/dbraw/zinc/94/22/10/707942210.db2.gz XOTXHHUUYPRSHJ-UHFFFAOYSA-N 2 2 303.450 1.830 20 10 DDCDLP C[C@H]1[NH2+]CCC[C@@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000925715716 714920216 /nfs/dbraw/zinc/92/02/16/714920216.db2.gz LJMCZFITAARURJ-KDOFPFPSSA-N 2 2 303.450 1.878 20 10 DDCDLP COCC[N@H+](Cc1ccc(O)c(C)c1O)C1CC[NH+](C)CC1 ZINC001140745302 860690149 /nfs/dbraw/zinc/69/01/49/860690149.db2.gz DPSJOMAUEDUEAK-UHFFFAOYSA-N 2 2 308.422 1.949 20 10 DDCDLP COCC[N@@H+](Cc1ccc(O)c(C)c1O)C1CC[NH+](C)CC1 ZINC001140745302 860690152 /nfs/dbraw/zinc/69/01/52/860690152.db2.gz DPSJOMAUEDUEAK-UHFFFAOYSA-N 2 2 308.422 1.949 20 10 DDCDLP C[NH+]1CCC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC1 ZINC001319097696 872439992 /nfs/dbraw/zinc/43/99/92/872439992.db2.gz JUFQPYJPAQGIKS-UHFFFAOYSA-N 3 2 320.456 1.761 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H]4C[C@@]4([NH3+])C3)cc2)CC1 ZINC001235154372 888443135 /nfs/dbraw/zinc/44/31/35/888443135.db2.gz FGSPXYBEVHZYRG-PKOBYXMFSA-N 3 2 314.477 1.752 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H]4C[C@@]4([NH3+])C3)cc2)CC1 ZINC001235154372 888443145 /nfs/dbraw/zinc/44/31/45/888443145.db2.gz FGSPXYBEVHZYRG-PKOBYXMFSA-N 3 2 314.477 1.752 20 10 DDCDLP COC(=O)C1C[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2F)C1 ZINC001236936502 889432693 /nfs/dbraw/zinc/43/26/93/889432693.db2.gz RLTBSNIETHNHQU-UHFFFAOYSA-N 2 2 321.396 1.182 20 10 DDCDLP COC(=O)c1ccc(C[NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)[nH]1 ZINC000841041697 702319735 /nfs/dbraw/zinc/31/97/35/702319735.db2.gz AGQORKDRYYWBIS-OAHLLOKOSA-N 2 2 316.405 1.657 20 10 DDCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000843125907 702824922 /nfs/dbraw/zinc/82/49/22/702824922.db2.gz KQIONABWGAZBPL-BVIKNXMNSA-N 3 2 302.466 1.730 20 10 DDCDLP COCC[NH2+]C1CC[NH+](Cc2cc(OC)c(OC)cc2O)CC1 ZINC000844901412 703082271 /nfs/dbraw/zinc/08/22/71/703082271.db2.gz UZURLNCATXOOHS-UHFFFAOYSA-N 2 2 324.421 1.610 20 10 DDCDLP C[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)cc1)[C@H]1CCC[NH2+]1 ZINC000854230574 704368838 /nfs/dbraw/zinc/36/88/38/704368838.db2.gz UXCTYALZGDRYMB-RDTXWAMCSA-N 2 2 303.450 1.878 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC[NH2+]C34CCC4)cc2)CC1 ZINC000863482834 705938522 /nfs/dbraw/zinc/93/85/22/705938522.db2.gz LZDLZNHYRDQZCH-SFHVURJKSA-N 3 2 314.477 1.813 20 10 DDCDLP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cnn(C)n1 ZINC000926853864 712912732 /nfs/dbraw/zinc/91/27/32/712912732.db2.gz IUVPEYKCMUTTQO-AWEZNQCLSA-N 2 2 314.437 1.418 20 10 DDCDLP Cc1nonc1[C@@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000926854488 712913073 /nfs/dbraw/zinc/91/30/73/712913073.db2.gz NWPIVYRNLDDYOS-CYBMUJFWSA-N 2 2 315.421 1.981 20 10 DDCDLP Oc1ccccc1C[N@@H+]1CCCn2nnc(Cn3cc[nH+]c3)c2C1 ZINC001203552152 870636971 /nfs/dbraw/zinc/63/69/71/870636971.db2.gz CGMHKIXLHMOXAY-UHFFFAOYSA-N 2 2 324.388 1.634 20 10 DDCDLP Oc1ccccc1C[N@H+]1CCCn2nnc(Cn3cc[nH+]c3)c2C1 ZINC001203552152 870636978 /nfs/dbraw/zinc/63/69/78/870636978.db2.gz CGMHKIXLHMOXAY-UHFFFAOYSA-N 2 2 324.388 1.634 20 10 DDCDLP Oc1c(Cl)cc(F)cc1CN1CC[NH2+][C@H]2CC[NH2+]CC[C@@H]21 ZINC001222511206 880527282 /nfs/dbraw/zinc/52/72/82/880527282.db2.gz TYQOEWFJBKOIJX-KBPBESRZSA-N 2 2 313.804 1.711 20 10 DDCDLP COCC[N@H+](Cc1cc(O)c(O)cc1O)C1CC[NH+](C)CC1 ZINC001233484884 887017189 /nfs/dbraw/zinc/01/71/89/887017189.db2.gz ANYKQXTUCDFHEP-UHFFFAOYSA-N 2 2 310.394 1.346 20 10 DDCDLP COCC[N@@H+](Cc1cc(O)c(O)cc1O)C1CC[NH+](C)CC1 ZINC001233484884 887017197 /nfs/dbraw/zinc/01/71/97/887017197.db2.gz ANYKQXTUCDFHEP-UHFFFAOYSA-N 2 2 310.394 1.346 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@]12CC[NH2+]C2 ZINC001235111546 888415520 /nfs/dbraw/zinc/41/55/20/888415520.db2.gz PZDIJMNPAFEIRV-GOSISDBHSA-N 3 2 300.450 1.424 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCC[C@]12CC[NH2+]C2 ZINC001235111546 888415526 /nfs/dbraw/zinc/41/55/26/888415526.db2.gz PZDIJMNPAFEIRV-GOSISDBHSA-N 3 2 300.450 1.424 20 10 DDCDLP C[N@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)[C@]1(C)CCC[NH2+]C1 ZINC001236204747 889143338 /nfs/dbraw/zinc/14/33/38/889143338.db2.gz BGISIPBLMFBLTN-GOSISDBHSA-N 3 2 302.466 1.670 20 10 DDCDLP C[N@@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)[C@]1(C)CCC[NH2+]C1 ZINC001236204747 889143347 /nfs/dbraw/zinc/14/33/47/889143347.db2.gz BGISIPBLMFBLTN-GOSISDBHSA-N 3 2 302.466 1.670 20 10 DDCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@H]3CCOC3)CC2)cc1 ZINC000176478339 408376784 /nfs/dbraw/zinc/37/67/84/408376784.db2.gz VHAPTENHASUSET-INIZCTEOSA-N 2 2 319.449 1.586 20 10 DDCDLP CN1CC[N@H+](C)C[C@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293511425 409128379 /nfs/dbraw/zinc/12/83/79/409128379.db2.gz CEYCCMUSQIYRGU-LLVKDONJSA-N 2 2 301.793 1.520 20 10 DDCDLP CN1CC[N@@H+](C)C[C@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293511425 409128380 /nfs/dbraw/zinc/12/83/80/409128380.db2.gz CEYCCMUSQIYRGU-LLVKDONJSA-N 2 2 301.793 1.520 20 10 DDCDLP C[NH2+]C[C@@H](C)C(=O)N(C)C1CC[NH+](c2ccc(OC)cc2)CC1 ZINC000378210433 418719755 /nfs/dbraw/zinc/71/97/55/418719755.db2.gz MVMXBJPTUKRNTR-CQSZACIVSA-N 2 2 319.449 1.978 20 10 DDCDLP COc1ccc(O)c(C[N@@H+]2CC[C@@H](C[NH+]3CCOCC3)C2)c1 ZINC000180453499 524747662 /nfs/dbraw/zinc/74/76/62/524747662.db2.gz QAZDHESIFFSJSQ-AWEZNQCLSA-N 2 2 306.406 1.555 20 10 DDCDLP COc1ccc(O)c(C[N@H+]2CC[C@@H](C[NH+]3CCOCC3)C2)c1 ZINC000180453499 524747669 /nfs/dbraw/zinc/74/76/69/524747669.db2.gz QAZDHESIFFSJSQ-AWEZNQCLSA-N 2 2 306.406 1.555 20 10 DDCDLP CCc1nn(C)cc1C[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841046280 702321420 /nfs/dbraw/zinc/32/14/20/702321420.db2.gz ZBSUYBLURFQFHU-INIZCTEOSA-N 2 2 301.438 1.838 20 10 DDCDLP CC[C@H](Cn1cncn1)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817942847 702531503 /nfs/dbraw/zinc/53/15/03/702531503.db2.gz RGGWYQHATCKYDO-GDBMZVCRSA-N 2 2 302.426 1.412 20 10 DDCDLP COC[C@@]1(C[NH2+][C@@H](C)c2cc(C(=O)OC)ccc2O)CCC[NH2+]1 ZINC000817974203 702540724 /nfs/dbraw/zinc/54/07/24/702540724.db2.gz JIPHSEKISFQNIG-SJCJKPOMSA-N 2 2 322.405 1.598 20 10 DDCDLP Oc1c(F)cc(Cl)cc1C[N@@H+]1CC[C@H](N2CC[NH2+]CC2)C1 ZINC000843123615 702824127 /nfs/dbraw/zinc/82/41/27/702824127.db2.gz SVUCYXJHCSCJRM-ZDUSSCGKSA-N 2 2 313.804 1.664 20 10 DDCDLP Oc1c(F)cc(Cl)cc1C[N@H+]1CC[C@H](N2CC[NH2+]CC2)C1 ZINC000843123615 702824129 /nfs/dbraw/zinc/82/41/29/702824129.db2.gz SVUCYXJHCSCJRM-ZDUSSCGKSA-N 2 2 313.804 1.664 20 10 DDCDLP O[C@H](C[NH2+]Cc1ccc2c(c1)CCCO2)C[NH+]1CCCCC1 ZINC000921587495 713814766 /nfs/dbraw/zinc/81/47/66/713814766.db2.gz QMRRGXVQNRXEGK-QGZVFWFLSA-N 2 2 304.434 1.948 20 10 DDCDLP COc1ccc(C[NH2+]CCNC(=O)Cc2[nH]cc[nH+]2)cc1C ZINC001135757718 771699711 /nfs/dbraw/zinc/69/97/11/771699711.db2.gz MRLVGKVSTMQMRR-UHFFFAOYSA-N 2 2 302.378 1.175 20 10 DDCDLP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC(=O)N1C ZINC001327067630 861848164 /nfs/dbraw/zinc/84/81/64/861848164.db2.gz LDNUGHNRXRJKIX-HNNXBMFYSA-N 2 2 316.449 1.101 20 10 DDCDLP C[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC(=O)N1C ZINC001327067630 861848166 /nfs/dbraw/zinc/84/81/66/861848166.db2.gz LDNUGHNRXRJKIX-HNNXBMFYSA-N 2 2 316.449 1.101 20 10 DDCDLP C[NH+](C)CCN1CCC12C[NH+](Cc1cc(Cl)ccc1O)C2 ZINC001275276655 852945460 /nfs/dbraw/zinc/94/54/60/852945460.db2.gz NWYKIEVRGGURAM-UHFFFAOYSA-N 2 2 309.841 1.867 20 10 DDCDLP CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@]12C[NH2+]C[C@H]1CC[NH2+]2 ZINC001161135191 866397839 /nfs/dbraw/zinc/39/78/39/866397839.db2.gz VIEWMQWXZJHQFH-CRAIPNDOSA-N 2 2 316.449 1.053 20 10 DDCDLP CC[N@@H+]1CCO[C@@H]2C[NH+](Cc3ccc(OC)cc3O)C[C@@H]2C1 ZINC001203628550 870682049 /nfs/dbraw/zinc/68/20/49/870682049.db2.gz BEOIHBRGAHUTKO-WMLDXEAASA-N 2 2 306.406 1.553 20 10 DDCDLP CC[N@H+]1CCO[C@@H]2C[NH+](Cc3ccc(OC)cc3O)C[C@@H]2C1 ZINC001203628550 870682057 /nfs/dbraw/zinc/68/20/57/870682057.db2.gz BEOIHBRGAHUTKO-WMLDXEAASA-N 2 2 306.406 1.553 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@H+](Cc3ccc(OC)cc3O)C[C@@H]2C1 ZINC001203628550 870682066 /nfs/dbraw/zinc/68/20/66/870682066.db2.gz BEOIHBRGAHUTKO-WMLDXEAASA-N 2 2 306.406 1.553 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@@H+](Cc3ccc(OC)cc3O)C[C@@H]2C1 ZINC001203628550 870682071 /nfs/dbraw/zinc/68/20/71/870682071.db2.gz BEOIHBRGAHUTKO-WMLDXEAASA-N 2 2 306.406 1.553 20 10 DDCDLP C[C@@H]1CC[C@H](C[NH3+])[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001205817033 871833979 /nfs/dbraw/zinc/83/39/79/871833979.db2.gz PONPBLHCXCWLOH-VQIMIIECSA-N 3 2 316.493 1.998 20 10 DDCDLP C[C@@H]1CC[C@H](C[NH3+])[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001205817033 871833999 /nfs/dbraw/zinc/83/39/99/871833999.db2.gz PONPBLHCXCWLOH-VQIMIIECSA-N 3 2 316.493 1.998 20 10 DDCDLP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@]2(CC[NH2+]2)C1 ZINC001222287403 880379777 /nfs/dbraw/zinc/37/97/77/880379777.db2.gz IWPSWEJNPNGPES-SFHVURJKSA-N 3 2 316.449 1.130 20 10 DDCDLP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCC[C@]2(CC[NH2+]2)C1 ZINC001222287403 880379793 /nfs/dbraw/zinc/37/97/93/880379793.db2.gz IWPSWEJNPNGPES-SFHVURJKSA-N 3 2 316.449 1.130 20 10 DDCDLP C[C@H]([NH2+]C[C@H](O)C[NH+](C)C)c1cc(Br)ccc1O ZINC000756558298 700628230 /nfs/dbraw/zinc/62/82/30/700628230.db2.gz ZDGTVNLZZPQGCQ-ONGXEEELSA-N 2 2 317.227 1.728 20 10 DDCDLP C[NH+](C)CCC[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809729468 701683298 /nfs/dbraw/zinc/68/32/98/701683298.db2.gz JJGAVCKJBDXNJE-UHFFFAOYSA-N 3 2 304.482 1.822 20 10 DDCDLP C[NH+](C)CCC[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809729468 701683300 /nfs/dbraw/zinc/68/33/00/701683300.db2.gz JJGAVCKJBDXNJE-UHFFFAOYSA-N 3 2 304.482 1.822 20 10 DDCDLP CN(CCC[NH+](C)C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809729468 701683302 /nfs/dbraw/zinc/68/33/02/701683302.db2.gz JJGAVCKJBDXNJE-UHFFFAOYSA-N 2 2 304.482 1.822 20 10 DDCDLP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCO1)c1ccc(Br)cc1O ZINC000817982577 702543000 /nfs/dbraw/zinc/54/30/00/702543000.db2.gz GJTNLFGJZNVAME-KOLCDFICSA-N 2 2 315.211 1.794 20 10 DDCDLP CC(C)[C@H]([NH3+])CC[N@H+](C)CC(=O)NCc1ccc(N(C)C)cc1 ZINC000844220485 702995456 /nfs/dbraw/zinc/99/54/56/702995456.db2.gz FDZOHXTXMTXVGQ-QGZVFWFLSA-N 2 2 320.481 1.674 20 10 DDCDLP CC(C)[C@H]([NH3+])CC[N@@H+](C)CC(=O)NCc1ccc(N(C)C)cc1 ZINC000844220485 702995457 /nfs/dbraw/zinc/99/54/57/702995457.db2.gz FDZOHXTXMTXVGQ-QGZVFWFLSA-N 2 2 320.481 1.674 20 10 DDCDLP C[C@@H]([NH2+]Cc1nc(C[NH3+])cc(=O)[nH]1)c1cc(Cl)ccc1O ZINC000854232735 704369781 /nfs/dbraw/zinc/36/97/81/704369781.db2.gz SXXXHZZONGCBFR-MRVPVSSYSA-N 2 2 308.769 1.851 20 10 DDCDLP CN(CCC[N@H+](C)Cc1cc(F)cc(F)c1O)CC[NH+](C)C ZINC000894786249 711271873 /nfs/dbraw/zinc/27/18/73/711271873.db2.gz DNKGVYFSKAQWHY-UHFFFAOYSA-N 2 2 315.408 1.986 20 10 DDCDLP CN(CCC[N@@H+](C)Cc1cc(F)cc(F)c1O)CC[NH+](C)C ZINC000894786249 711271877 /nfs/dbraw/zinc/27/18/77/711271877.db2.gz DNKGVYFSKAQWHY-UHFFFAOYSA-N 2 2 315.408 1.986 20 10 DDCDLP COc1cc(C)cc(C[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)c1O ZINC000895390676 711500869 /nfs/dbraw/zinc/50/08/69/711500869.db2.gz PCGWRSIGTUCRNP-AWEZNQCLSA-N 2 2 321.421 1.139 20 10 DDCDLP COc1cc(C)cc(C[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c1O ZINC000895390676 711500870 /nfs/dbraw/zinc/50/08/70/711500870.db2.gz PCGWRSIGTUCRNP-AWEZNQCLSA-N 2 2 321.421 1.139 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@](C)([NH3+])C3)cc2)CC1 ZINC001204783021 741079066 /nfs/dbraw/zinc/07/90/66/741079066.db2.gz NLFDKUZVMBHYFW-GOSISDBHSA-N 3 2 302.466 1.752 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@](C)([NH3+])C3)cc2)CC1 ZINC001204783021 741079069 /nfs/dbraw/zinc/07/90/69/741079069.db2.gz NLFDKUZVMBHYFW-GOSISDBHSA-N 3 2 302.466 1.752 20 10 DDCDLP NC(=O)C1([NH+]2CCCCC2)CC[NH+](Cc2ccc(N)cc2)CC1 ZINC001356082683 878860986 /nfs/dbraw/zinc/86/09/86/878860986.db2.gz CCDBPZLEEHNORG-UHFFFAOYSA-N 2 2 316.449 1.575 20 10 DDCDLP CC[NH+]1CCN(c2ccc(OC[C@H]3C[N@H+](C)CCO3)cc2)CC1 ZINC001234660456 888173450 /nfs/dbraw/zinc/17/34/50/888173450.db2.gz INOGDIXJPQRBPZ-GOSISDBHSA-N 2 2 319.449 1.538 20 10 DDCDLP CC[NH+]1CCN(c2ccc(OC[C@H]3C[N@@H+](C)CCO3)cc2)CC1 ZINC001234660456 888173456 /nfs/dbraw/zinc/17/34/56/888173456.db2.gz INOGDIXJPQRBPZ-GOSISDBHSA-N 2 2 319.449 1.538 20 10 DDCDLP CN1CCc2cc(C[NH2+]C[C@H]3C[N@@H+]4CCC[C@@H]4CO3)ccc21 ZINC000317793933 409868635 /nfs/dbraw/zinc/86/86/35/409868635.db2.gz ZKYPOOJQGPSMTP-SJORKVTESA-N 2 2 301.434 1.632 20 10 DDCDLP CN1CCc2cc(C[NH2+]C[C@H]3C[N@H+]4CCC[C@@H]4CO3)ccc21 ZINC000317793933 409868640 /nfs/dbraw/zinc/86/86/40/409868640.db2.gz ZKYPOOJQGPSMTP-SJORKVTESA-N 2 2 301.434 1.632 20 10 DDCDLP C[C@H]1[NH2+]CCC[C@H]1[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000841066270 702333916 /nfs/dbraw/zinc/33/39/16/702333916.db2.gz YZBKBARRPDEBGC-CZUORRHYSA-N 2 2 307.413 1.892 20 10 DDCDLP C[C@@H](C[C@@H]1COCC[NH2+]1)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000817900879 702513984 /nfs/dbraw/zinc/51/39/84/702513984.db2.gz QBBYRFYVQKMJGJ-WMLDXEAASA-N 2 2 303.450 1.926 20 10 DDCDLP COc1ccc(N2CC[NH+](C[C@@]3(C)CC[NH2+]C3)CC2)cc1F ZINC000843119379 702822868 /nfs/dbraw/zinc/82/28/68/702822868.db2.gz KXAQBZBVNDFTQP-KRWDZBQOSA-N 2 2 307.413 1.956 20 10 DDCDLP C[C@@H]1C[N@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@H]1[NH3+] ZINC000844218947 702994677 /nfs/dbraw/zinc/99/46/77/702994677.db2.gz GEBPNDCNFNADIB-RHSMWYFYSA-N 2 2 318.465 1.380 20 10 DDCDLP C[C@@H]1C[N@@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@H]1[NH3+] ZINC000844218947 702994678 /nfs/dbraw/zinc/99/46/78/702994678.db2.gz GEBPNDCNFNADIB-RHSMWYFYSA-N 2 2 318.465 1.380 20 10 DDCDLP CC(C)[C@](C)(C[NH3+])[NH2+]CC(=O)NCc1ccc(N(C)C)cc1 ZINC000844220694 702995372 /nfs/dbraw/zinc/99/53/72/702995372.db2.gz JYPVXNPEWRHKSX-KRWDZBQOSA-N 2 2 306.454 1.332 20 10 DDCDLP COc1ccc(N2CC[NH+](C[C@H]3CC[NH2+]C3)CC2)c(OC)c1 ZINC000866697282 706767684 /nfs/dbraw/zinc/76/76/84/706767684.db2.gz LZJLOFFAFTWGIF-AWEZNQCLSA-N 2 2 305.422 1.435 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[NH2+][C@]12CCC[C@@H]1[NH2+]CC2 ZINC000873229824 707779070 /nfs/dbraw/zinc/77/90/70/707779070.db2.gz HDTMPVKAESEIKT-ROUUACIJSA-N 2 2 301.434 1.897 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3ncc[nH]3)cc2F)CC1 ZINC000066594256 407254928 /nfs/dbraw/zinc/25/49/28/407254928.db2.gz GDNZZRWDTPMZQU-UHFFFAOYSA-N 2 2 317.412 1.981 20 10 DDCDLP C[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1cc(F)cc(F)c1O ZINC000756357063 700617279 /nfs/dbraw/zinc/61/72/79/700617279.db2.gz BIYYVLPTSNPGPA-GFCCVEGCSA-N 2 2 313.392 1.959 20 10 DDCDLP Cc1ccc([C@H](C)[NH2+]CC(=O)N2CC[NH+](C)CC2)c(O)c1C ZINC000756489205 700623882 /nfs/dbraw/zinc/62/38/82/700623882.db2.gz GTQCVAHASZEAKJ-AWEZNQCLSA-N 2 2 305.422 1.434 20 10 DDCDLP C[C@H]1CC[NH2+]C[C@@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000817894522 702511511 /nfs/dbraw/zinc/51/15/11/702511511.db2.gz LUHYDFVEVRMUHM-GUYCJALGSA-N 2 2 321.440 1.874 20 10 DDCDLP O=C1C[NH2+]CCN1[C@H]1CCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000843065410 702811960 /nfs/dbraw/zinc/81/19/60/702811960.db2.gz LZKBSRNDZKUYRH-LBPRGKRZSA-N 2 2 323.824 1.442 20 10 DDCDLP O=C1C[NH2+]CCN1[C@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000843065410 702811963 /nfs/dbraw/zinc/81/19/63/702811963.db2.gz LZKBSRNDZKUYRH-LBPRGKRZSA-N 2 2 323.824 1.442 20 10 DDCDLP CC[NH+]1CCN(C(=O)[C@@H](C)[NH2+][C@H](C)c2ccccc2O)CC1 ZINC000879650009 706749567 /nfs/dbraw/zinc/74/95/67/706749567.db2.gz XIMLTFGERARKRF-ZIAGYGMSSA-N 2 2 305.422 1.595 20 10 DDCDLP C[C@@H]1CC[NH2+]C[C@@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000854230734 704369042 /nfs/dbraw/zinc/36/90/42/704369042.db2.gz XLOGKSLTNOAQLC-KDOFPFPSSA-N 2 2 303.450 1.735 20 10 DDCDLP CCOc1ccc(O)c(C[NH+]2CCC([N@@H+]3CC[C@H](O)C3)CC2)c1 ZINC000827699497 706051956 /nfs/dbraw/zinc/05/19/56/706051956.db2.gz ICRUWDHIPAEVCR-INIZCTEOSA-N 2 2 320.433 1.822 20 10 DDCDLP CCOc1ccc(O)c(C[NH+]2CCC([N@H+]3CC[C@H](O)C3)CC2)c1 ZINC000827699497 706051961 /nfs/dbraw/zinc/05/19/61/706051961.db2.gz ICRUWDHIPAEVCR-INIZCTEOSA-N 2 2 320.433 1.822 20 10 DDCDLP Cc1nc(NC[C@@H](c2ccc(N(C)C)cc2)[NH+](C)C)nc(N)[nH+]1 ZINC000897521462 708361878 /nfs/dbraw/zinc/36/18/78/708361878.db2.gz GQVZGZHDTNRMSU-AWEZNQCLSA-N 2 2 315.425 1.543 20 10 DDCDLP C[C@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000911667248 710917005 /nfs/dbraw/zinc/91/70/05/710917005.db2.gz PARXFBNWGNJZCJ-MLGOLLRUSA-N 2 2 315.421 1.471 20 10 DDCDLP C[C@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000911667248 710917010 /nfs/dbraw/zinc/91/70/10/710917010.db2.gz PARXFBNWGNJZCJ-MLGOLLRUSA-N 2 2 315.421 1.471 20 10 DDCDLP C[C@@H](C(=O)NC[C@H]([NH3+])c1ccc(N(C)C)cc1)n1cc[nH+]c1 ZINC001327182076 861948573 /nfs/dbraw/zinc/94/85/73/861948573.db2.gz VXOIHQAUDHABHP-WFASDCNBSA-N 2 2 301.394 1.326 20 10 DDCDLP COc1cc(C[N@@H+]2CCCN(C)C(=O)C2)cc(C[NH+](C)C)c1O ZINC001139256686 860338262 /nfs/dbraw/zinc/33/82/62/860338262.db2.gz HEJVPUPXRYJHQL-UHFFFAOYSA-N 2 2 321.421 1.127 20 10 DDCDLP COc1cc(C[N@H+]2CCCN(C)C(=O)C2)cc(C[NH+](C)C)c1O ZINC001139256686 860338270 /nfs/dbraw/zinc/33/82/70/860338270.db2.gz HEJVPUPXRYJHQL-UHFFFAOYSA-N 2 2 321.421 1.127 20 10 DDCDLP CCN(CC)c1ccc(C[NH2+]C[C@H]2C[N@H+](C)CCN2C)cc1 ZINC000264769359 222335924 /nfs/dbraw/zinc/33/59/24/222335924.db2.gz QWYCCBZNBYKJBI-SFHVURJKSA-N 2 2 304.482 1.868 20 10 DDCDLP CCN(CC)c1ccc(C[NH2+]C[C@H]2C[N@@H+](C)CCN2C)cc1 ZINC000264769359 222335926 /nfs/dbraw/zinc/33/59/26/222335926.db2.gz QWYCCBZNBYKJBI-SFHVURJKSA-N 2 2 304.482 1.868 20 10 DDCDLP C[NH+]1CCN(C[C@@H]2CCC[N@H+](Cc3cccc(F)c3O)C2)CC1 ZINC000377633314 290045290 /nfs/dbraw/zinc/04/52/90/290045290.db2.gz XBPYBVUYFRJDTO-HNNXBMFYSA-N 2 2 321.440 1.991 20 10 DDCDLP C[NH+]1CCN(C[C@@H]2CCC[N@@H+](Cc3cccc(F)c3O)C2)CC1 ZINC000377633314 290045293 /nfs/dbraw/zinc/04/52/93/290045293.db2.gz XBPYBVUYFRJDTO-HNNXBMFYSA-N 2 2 321.440 1.991 20 10 DDCDLP COc1ccc(O)c(C[N@@H+]2CCC[C@H](C[NH+]3CCOCC3)C2)c1 ZINC000180031858 524741794 /nfs/dbraw/zinc/74/17/94/524741794.db2.gz HQRPOHOODWCOGW-OAHLLOKOSA-N 2 2 320.433 1.945 20 10 DDCDLP COc1ccc(O)c(C[N@H+]2CCC[C@H](C[NH+]3CCOCC3)C2)c1 ZINC000180031858 524741798 /nfs/dbraw/zinc/74/17/98/524741798.db2.gz HQRPOHOODWCOGW-OAHLLOKOSA-N 2 2 320.433 1.945 20 10 DDCDLP CCN(C)c1ccc([C@H](C)[NH2+]CC(=O)N2CC[NH+](C)CC2)cc1 ZINC000765415808 701010781 /nfs/dbraw/zinc/01/07/81/701010781.db2.gz AQMYJVKKYNRLOM-HNNXBMFYSA-N 2 2 318.465 1.567 20 10 DDCDLP C[C@H]1CC[NH2+]C[C@@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000817895116 702511520 /nfs/dbraw/zinc/51/15/20/702511520.db2.gz QMMABYLMMZPKKH-KXBFYZLASA-N 2 2 317.477 1.983 20 10 DDCDLP C[C@@H](C[C@H]1COCC[NH2+]1)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000817896181 702511801 /nfs/dbraw/zinc/51/18/01/702511801.db2.gz ZBHBNIRZOHTSMQ-RDJZCZTQSA-N 2 2 319.449 1.380 20 10 DDCDLP CCN(CC)C(=O)C[C@@H](C)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817938230 702530330 /nfs/dbraw/zinc/53/03/30/702530330.db2.gz HDGVZSOHGTZYAM-PBHICJAKSA-N 2 2 320.481 1.989 20 10 DDCDLP C[C@@H]1C[NH2+]C[C@H]([NH2+]Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000843126800 702825315 /nfs/dbraw/zinc/82/53/15/702825315.db2.gz WMPNZQXNKQLUBE-DZGCQCFKSA-N 2 2 307.413 1.750 20 10 DDCDLP CN(C)c1ccc([C@H]([NH3+])CNC(=O)CCn2cc[nH+]c2)cc1 ZINC000844163338 702980610 /nfs/dbraw/zinc/98/06/10/702980610.db2.gz ZTJRSNCJTAIQGD-OAHLLOKOSA-N 2 2 301.394 1.155 20 10 DDCDLP CC[N@H+](C)C[C@@H](O)C[NH+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000821391880 704402691 /nfs/dbraw/zinc/40/26/91/704402691.db2.gz RTGBHFBPIZCVIX-SJORKVTESA-N 2 2 322.449 1.686 20 10 DDCDLP CC[N@@H+](C)C[C@@H](O)C[NH+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000821391880 704402693 /nfs/dbraw/zinc/40/26/93/704402693.db2.gz RTGBHFBPIZCVIX-SJORKVTESA-N 2 2 322.449 1.686 20 10 DDCDLP CC[NH+](C)C[C@@H](O)C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000821391880 704402695 /nfs/dbraw/zinc/40/26/95/704402695.db2.gz RTGBHFBPIZCVIX-SJORKVTESA-N 2 2 322.449 1.686 20 10 DDCDLP CC[NH+](C)C[C@@H](O)C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000821391880 704402697 /nfs/dbraw/zinc/40/26/97/704402697.db2.gz RTGBHFBPIZCVIX-SJORKVTESA-N 2 2 322.449 1.686 20 10 DDCDLP C[NH+](C)CCC[N@H+](C)CCNC(=O)/C=C\c1ccc(O)c(O)c1 ZINC000855414782 704484409 /nfs/dbraw/zinc/48/44/09/704484409.db2.gz MASRNQDVSBEQTD-VURMDHGXSA-N 2 2 321.421 1.111 20 10 DDCDLP C[NH+](C)CCC[N@@H+](C)CCNC(=O)/C=C\c1ccc(O)c(O)c1 ZINC000855414782 704484410 /nfs/dbraw/zinc/48/44/10/704484410.db2.gz MASRNQDVSBEQTD-VURMDHGXSA-N 2 2 321.421 1.111 20 10 DDCDLP Cc1cccc(O)c1C[NH2+][C@@H]1CCN(CC[NH+]2CCOCC2)C1 ZINC000877031377 705966036 /nfs/dbraw/zinc/96/60/36/705966036.db2.gz QNCJZAHYDHHICP-MRXNPFEDSA-N 2 2 319.449 1.197 20 10 DDCDLP COc1cc(O)c(C[N@H+](C)CCN2CC[NH+](C)CC2)c(OC)c1 ZINC001141029549 860767235 /nfs/dbraw/zinc/76/72/35/860767235.db2.gz VNNFGUOMYNZCJT-UHFFFAOYSA-N 2 2 323.437 1.089 20 10 DDCDLP COc1cc(O)c(C[N@@H+](C)CCN2CC[NH+](C)CC2)c(OC)c1 ZINC001141029549 860767239 /nfs/dbraw/zinc/76/72/39/860767239.db2.gz VNNFGUOMYNZCJT-UHFFFAOYSA-N 2 2 323.437 1.089 20 10 DDCDLP CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]([NH3+])Cc1c[nH+]c[nH]1 ZINC001161130374 866393855 /nfs/dbraw/zinc/39/38/55/866393855.db2.gz HOBKVTXEBAOMRF-INIZCTEOSA-N 2 2 315.421 1.394 20 10 DDCDLP COCCOc1ccc(N2CC[NH+](C3CC[NH2+]CC3)CC2)cc1 ZINC001246893273 892974276 /nfs/dbraw/zinc/97/42/76/892974276.db2.gz IIDOKZONCFZYHW-UHFFFAOYSA-N 2 2 319.449 1.586 20 10 DDCDLP COC(=O)Cc1ccc(C[NH+]2CCC([NH+]3CCC3)CC2)c(O)c1 ZINC001249217856 893876042 /nfs/dbraw/zinc/87/60/42/893876042.db2.gz STOQHIAHBMQZFW-UHFFFAOYSA-N 2 2 318.417 1.778 20 10 DDCDLP COC(=O)C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000775735665 698027129 /nfs/dbraw/zinc/02/71/29/698027129.db2.gz ATKVUBYFGBMVBC-UHFFFAOYSA-N 2 2 317.433 1.576 20 10 DDCDLP COC(=O)C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC1 ZINC000775735665 698027133 /nfs/dbraw/zinc/02/71/33/698027133.db2.gz ATKVUBYFGBMVBC-UHFFFAOYSA-N 2 2 317.433 1.576 20 10 DDCDLP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCO1)c1ccc(Br)cc1O ZINC000817982578 702542816 /nfs/dbraw/zinc/54/28/16/702542816.db2.gz GJTNLFGJZNVAME-MWLCHTKSSA-N 2 2 315.211 1.794 20 10 DDCDLP CC[N@H+](C)C[C@H](O)C[NH+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000821391879 704402765 /nfs/dbraw/zinc/40/27/65/704402765.db2.gz RTGBHFBPIZCVIX-IRXDYDNUSA-N 2 2 322.449 1.686 20 10 DDCDLP CC[N@@H+](C)C[C@H](O)C[NH+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000821391879 704402766 /nfs/dbraw/zinc/40/27/66/704402766.db2.gz RTGBHFBPIZCVIX-IRXDYDNUSA-N 2 2 322.449 1.686 20 10 DDCDLP CC[NH+](C)C[C@H](O)C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000821391879 704402767 /nfs/dbraw/zinc/40/27/67/704402767.db2.gz RTGBHFBPIZCVIX-IRXDYDNUSA-N 2 2 322.449 1.686 20 10 DDCDLP CC[NH+](C)C[C@H](O)C[N@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000821391879 704402768 /nfs/dbraw/zinc/40/27/68/704402768.db2.gz RTGBHFBPIZCVIX-IRXDYDNUSA-N 2 2 322.449 1.686 20 10 DDCDLP NC(=O)[C@@H]1CCC[N@@H+]1CCC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000858469301 704715564 /nfs/dbraw/zinc/71/55/64/704715564.db2.gz SXDKRFUDTRDXSS-KGLIPLIRSA-N 2 2 303.406 1.309 20 10 DDCDLP NC(=O)[C@@H]1CCC[N@H+]1CCC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000858469301 704715566 /nfs/dbraw/zinc/71/55/66/704715566.db2.gz SXDKRFUDTRDXSS-KGLIPLIRSA-N 2 2 303.406 1.309 20 10 DDCDLP CN(C)c1ccc(/C=C/C[NH2+]CC(=O)N2CC[NH+](C)CC2)cc1 ZINC000835035303 707160053 /nfs/dbraw/zinc/16/00/53/707160053.db2.gz GSNPTIYWMQSLSR-SNAWJCMRSA-N 2 2 316.449 1.129 20 10 DDCDLP COc1cccc(O)c1C[NH2+][C@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903974607 711354005 /nfs/dbraw/zinc/35/40/05/711354005.db2.gz RTUNBXVQMHRCKM-CYBMUJFWSA-N 2 2 306.406 1.649 20 10 DDCDLP [NH3+][C@@]1(CO)CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000904401325 711853003 /nfs/dbraw/zinc/85/30/03/711853003.db2.gz OGFYMLWTWHEVRS-SFHVURJKSA-N 2 2 303.450 1.963 20 10 DDCDLP [NH3+][C@@]1(CO)CCC[N@@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000904401325 711853004 /nfs/dbraw/zinc/85/30/04/711853004.db2.gz OGFYMLWTWHEVRS-SFHVURJKSA-N 2 2 303.450 1.963 20 10 DDCDLP C[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C[NH+](C)C ZINC001117674255 780877621 /nfs/dbraw/zinc/87/76/21/780877621.db2.gz ZNJCTFGDDYMCCX-HNNXBMFYSA-N 3 2 322.472 1.865 20 10 DDCDLP C[C@@H](C[NH2+]Cc1ccc(N2CCN(C)CC2)c(F)c1)C[NH+](C)C ZINC001117674255 780877623 /nfs/dbraw/zinc/87/76/23/780877623.db2.gz ZNJCTFGDDYMCCX-HNNXBMFYSA-N 2 2 322.472 1.865 20 10 DDCDLP Cc1cc(N2CC[NH+](Cc3cc(O)c(O)c(O)c3)CC2)cc[nH+]1 ZINC001233016396 886730181 /nfs/dbraw/zinc/73/01/81/886730181.db2.gz VSMVSODXCRCMHC-UHFFFAOYSA-N 2 2 315.373 1.829 20 10 DDCDLP Cc1ccc(O)c([C@H](C)[NH2+]CCC[N@@H+]2CCC[C@@H]2C(N)=O)c1 ZINC000273622729 408268086 /nfs/dbraw/zinc/26/80/86/408268086.db2.gz ZMVIIFMFWKXQEJ-DZGCQCFKSA-N 2 2 305.422 1.691 20 10 DDCDLP Cc1ccc(O)c([C@H](C)[NH2+]CCC[N@H+]2CCC[C@@H]2C(N)=O)c1 ZINC000273622729 408268090 /nfs/dbraw/zinc/26/80/90/408268090.db2.gz ZMVIIFMFWKXQEJ-DZGCQCFKSA-N 2 2 305.422 1.691 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[N@@H+]1CC[NH+]2CCC1CC2 ZINC000368043451 332216017 /nfs/dbraw/zinc/21/60/17/332216017.db2.gz PTJTZBPIUZXQKF-UHFFFAOYSA-N 2 2 301.434 1.803 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[N@H+]1CC[NH+]2CCC1CC2 ZINC000368043451 332216019 /nfs/dbraw/zinc/21/60/19/332216019.db2.gz PTJTZBPIUZXQKF-UHFFFAOYSA-N 2 2 301.434 1.803 20 10 DDCDLP C[N@@H+]1CCC[C@H]1C[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000237087548 697803637 /nfs/dbraw/zinc/80/36/37/697803637.db2.gz DRXDVIPNKOSNFB-HNNXBMFYSA-N 2 2 307.413 1.846 20 10 DDCDLP C[N@H+]1CCC[C@H]1C[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000237087548 697803642 /nfs/dbraw/zinc/80/36/42/697803642.db2.gz DRXDVIPNKOSNFB-HNNXBMFYSA-N 2 2 307.413 1.846 20 10 DDCDLP C[N@@H+]1CC[C@@](O)(C[NH2+]Cc2cc(Br)ccc2O)C1 ZINC000705763454 699241865 /nfs/dbraw/zinc/24/18/65/699241865.db2.gz ZXTNGEGWTSFCIM-CYBMUJFWSA-N 2 2 315.211 1.311 20 10 DDCDLP C[N@H+]1CC[C@@](O)(C[NH2+]Cc2cc(Br)ccc2O)C1 ZINC000705763454 699241866 /nfs/dbraw/zinc/24/18/66/699241866.db2.gz ZXTNGEGWTSFCIM-CYBMUJFWSA-N 2 2 315.211 1.311 20 10 DDCDLP Cc1cc(C)c([C@H](C)[NH2+]CC(=O)N2CC[NH+](C)CC2)c(O)c1 ZINC000815570180 701898802 /nfs/dbraw/zinc/89/88/02/701898802.db2.gz VBVVYKLCIJFELE-AWEZNQCLSA-N 2 2 305.422 1.434 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4ncncc4C3)cc2)CC1 ZINC000895723051 711588083 /nfs/dbraw/zinc/58/80/83/711588083.db2.gz PMAURFRIPUFSQA-UHFFFAOYSA-N 2 2 323.444 1.787 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH+]3CCC(C)([NH3+])CC3)cc2F)CC1 ZINC001326236816 861222358 /nfs/dbraw/zinc/22/23/58/861222358.db2.gz QCEMJBIMBGZNSP-UHFFFAOYSA-N 3 2 320.456 1.891 20 10 DDCDLP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2NC(=O)[C@H]1C[NH2+]C[C@@H]1[NH3+] ZINC001157434655 863819675 /nfs/dbraw/zinc/81/96/75/863819675.db2.gz PZPDBKCWWFAOFG-HEHGZKQESA-N 2 2 317.433 1.295 20 10 DDCDLP CC(C)(C)c1cccc(C[N@@H+]2CCN3CC[NH2+]C[C@H]3C2)c1O ZINC001234979891 888291955 /nfs/dbraw/zinc/29/19/55/888291955.db2.gz OQXLLVWQTDOARS-HNNXBMFYSA-N 2 2 303.450 1.779 20 10 DDCDLP CC(C)(C)c1cccc(C[N@H+]2CCN3CC[NH2+]C[C@H]3C2)c1O ZINC001234979891 888291974 /nfs/dbraw/zinc/29/19/74/888291974.db2.gz OQXLLVWQTDOARS-HNNXBMFYSA-N 2 2 303.450 1.779 20 10 DDCDLP Oc1ccc(Cl)c(Cl)c1CN1CC[NH2+]C[C@]12CC[NH2+]C2 ZINC001234992612 888315979 /nfs/dbraw/zinc/31/59/79/888315979.db2.gz SFODEZPQYHNPRQ-CQSZACIVSA-N 2 2 316.232 1.836 20 10 DDCDLP CCOc1ccc(C[NH+]2CC(N3CC[NH+](C)CC3)C2)c(O)c1 ZINC001237047449 889481189 /nfs/dbraw/zinc/48/11/89/889481189.db2.gz XVDJQRYXZRBRTQ-UHFFFAOYSA-N 2 2 305.422 1.223 20 10 DDCDLP COc1cc(O)c(C[NH2+][C@H]2CCn3cc[nH+]c3C2)cc1OC ZINC000779192071 698401034 /nfs/dbraw/zinc/40/10/34/698401034.db2.gz JBXWZBQZPWLWBC-LBPRGKRZSA-N 2 2 303.362 1.711 20 10 DDCDLP C[C@H]1CC[N@H+](CC[NH2+]Cc2ccc(N3CCOCC3)cc2)C1 ZINC000744450206 699949431 /nfs/dbraw/zinc/94/94/31/699949431.db2.gz WMIAVWUEHNKETD-INIZCTEOSA-N 2 2 303.450 1.955 20 10 DDCDLP C[C@H]1CC[N@@H+](CC[NH2+]Cc2ccc(N3CCOCC3)cc2)C1 ZINC000744450206 699949432 /nfs/dbraw/zinc/94/94/32/699949432.db2.gz WMIAVWUEHNKETD-INIZCTEOSA-N 2 2 303.450 1.955 20 10 DDCDLP COC[C@]1(C[NH2+]Cc2cc(Cl)cc(OC)c2O)CCC[NH2+]1 ZINC000841066388 702333070 /nfs/dbraw/zinc/33/30/70/702333070.db2.gz ARNTXNKIQHSZAI-OAHLLOKOSA-N 2 2 314.813 1.912 20 10 DDCDLP CN1CCCc2cc(C[NH2+][C@H](C3CC3)[C@@H]3C[NH2+]CCO3)ccc21 ZINC000817900913 702513732 /nfs/dbraw/zinc/51/37/32/702513732.db2.gz QVJAJKXPLJOYCT-RBUKOAKNSA-N 2 2 315.461 1.926 20 10 DDCDLP C[NH2+]C1CC[NH+](Cc2ccc(N3CCOCC3)c(F)c2)CC1 ZINC000843049190 702808263 /nfs/dbraw/zinc/80/82/63/702808263.db2.gz ISMHUXYCAJUJBM-UHFFFAOYSA-N 2 2 307.413 1.846 20 10 DDCDLP C[N@H+](CCN1CC[NH2+]CC1)Cc1c(O)ccc(Cl)c1F ZINC000843052978 702809249 /nfs/dbraw/zinc/80/92/49/702809249.db2.gz RVGWWSFJTQUSKM-UHFFFAOYSA-N 2 2 301.793 1.522 20 10 DDCDLP C[N@@H+](CCN1CC[NH2+]CC1)Cc1c(O)ccc(Cl)c1F ZINC000843052978 702809252 /nfs/dbraw/zinc/80/92/52/702809252.db2.gz RVGWWSFJTQUSKM-UHFFFAOYSA-N 2 2 301.793 1.522 20 10 DDCDLP O=C1C[NH2+]CCN1[C@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000843066569 702812444 /nfs/dbraw/zinc/81/24/44/702812444.db2.gz YGIZGKJAKSKRGK-AWEZNQCLSA-N 2 2 323.824 1.442 20 10 DDCDLP O=C1C[NH2+]CCN1[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000843066569 702812447 /nfs/dbraw/zinc/81/24/47/702812447.db2.gz YGIZGKJAKSKRGK-AWEZNQCLSA-N 2 2 323.824 1.442 20 10 DDCDLP CC[N@H+](C)C[C@@H](O)C[NH+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000846777008 703329872 /nfs/dbraw/zinc/32/98/72/703329872.db2.gz CBSVDGHFLBSSIM-QGZVFWFLSA-N 2 2 321.465 1.520 20 10 DDCDLP CC[N@@H+](C)C[C@@H](O)C[NH+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000846777008 703329875 /nfs/dbraw/zinc/32/98/75/703329875.db2.gz CBSVDGHFLBSSIM-QGZVFWFLSA-N 2 2 321.465 1.520 20 10 DDCDLP CC[NH+](C)C[C@@H](O)C[N@@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000846777008 703329878 /nfs/dbraw/zinc/32/98/78/703329878.db2.gz CBSVDGHFLBSSIM-QGZVFWFLSA-N 2 2 321.465 1.520 20 10 DDCDLP CC[NH+](C)C[C@@H](O)C[N@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000846777008 703329882 /nfs/dbraw/zinc/32/98/82/703329882.db2.gz CBSVDGHFLBSSIM-QGZVFWFLSA-N 2 2 321.465 1.520 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cc(N)ccn3)cc2)CC1 ZINC000903950647 711345443 /nfs/dbraw/zinc/34/54/43/711345443.db2.gz PNQSUMSZETYFHW-UHFFFAOYSA-N 2 2 311.433 1.705 20 10 DDCDLP c1cc(C[NH2+][C@@H]2C[NH2+]CC3(CCOCC3)C2)cc2c1OCC2 ZINC000903974540 711354192 /nfs/dbraw/zinc/35/41/92/711354192.db2.gz QBHNKHZGWMCHIO-INIZCTEOSA-N 2 2 302.418 1.870 20 10 DDCDLP CN(C)c1ccc(C[NH2+]C[C@H]2C[N@@H+]3CCC[C@H]3CO2)cc1F ZINC001200269514 748182900 /nfs/dbraw/zinc/18/29/00/748182900.db2.gz XHNVAXLKNOQTFN-GJZGRUSLSA-N 2 2 307.413 1.845 20 10 DDCDLP CN(C)c1ccc(C[NH2+]C[C@H]2C[N@H+]3CCC[C@H]3CO2)cc1F ZINC001200269514 748182906 /nfs/dbraw/zinc/18/29/06/748182906.db2.gz XHNVAXLKNOQTFN-GJZGRUSLSA-N 2 2 307.413 1.845 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+](C3CC3)C3COC3)cc2F)CC1 ZINC001324378614 867243923 /nfs/dbraw/zinc/24/39/23/867243923.db2.gz NHMKVMDOKMRLPU-UHFFFAOYSA-N 2 2 319.424 1.941 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+](C3CC3)C3COC3)cc2F)CC1 ZINC001324378614 867243943 /nfs/dbraw/zinc/24/39/43/867243943.db2.gz NHMKVMDOKMRLPU-UHFFFAOYSA-N 2 2 319.424 1.941 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+](C1CC1)[C@@H]1CCC[NH2+]C1 ZINC001236238407 889153782 /nfs/dbraw/zinc/15/37/82/889153782.db2.gz DTRFTODYMDBMFW-LJQANCHMSA-N 3 2 314.477 1.813 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+](C1CC1)[C@@H]1CCC[NH2+]C1 ZINC001236238407 889153792 /nfs/dbraw/zinc/15/37/92/889153792.db2.gz DTRFTODYMDBMFW-LJQANCHMSA-N 3 2 314.477 1.813 20 10 DDCDLP CCOc1ccc(O)c(C[N@@H+]2CC[C@@H](C[NH+]3CCOCC3)C2)c1 ZINC000093665213 407200115 /nfs/dbraw/zinc/20/01/15/407200115.db2.gz BRMFHINWGIUDOS-HNNXBMFYSA-N 2 2 320.433 1.945 20 10 DDCDLP CCOc1ccc(O)c(C[N@H+]2CC[C@@H](C[NH+]3CCOCC3)C2)c1 ZINC000093665213 407200117 /nfs/dbraw/zinc/20/01/17/407200117.db2.gz BRMFHINWGIUDOS-HNNXBMFYSA-N 2 2 320.433 1.945 20 10 DDCDLP COc1c(O)c(C[NH2+][C@H](C)Cn2cc[nH+]c2)ccc1[N+](=O)[O-] ZINC000278866144 409104327 /nfs/dbraw/zinc/10/43/27/409104327.db2.gz MKPXFZSAPDEXOO-SNVBAGLBSA-N 2 2 306.322 1.684 20 10 DDCDLP CC[N@H+](CCO)CC[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000372128669 418838766 /nfs/dbraw/zinc/83/87/66/418838766.db2.gz OHMXJGXMWUUNGY-UHFFFAOYSA-N 2 2 321.465 1.568 20 10 DDCDLP CC[N@@H+](CCO)CC[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000372128669 418838768 /nfs/dbraw/zinc/83/87/68/418838768.db2.gz OHMXJGXMWUUNGY-UHFFFAOYSA-N 2 2 321.465 1.568 20 10 DDCDLP C[C@@H](C[NH2+][C@@H](C)c1cc(F)cc(F)c1O)N1CC[NH+](C)CC1 ZINC000756544605 700626815 /nfs/dbraw/zinc/62/68/15/700626815.db2.gz KLGDSIJNERTZTF-RYUDHWBXSA-N 2 2 313.392 1.957 20 10 DDCDLP Oc1cc2c(cc1C[NH+]1CCC(n3cc[nH+]c3)CC1)[C@@H](O)CO2 ZINC000768446529 701177658 /nfs/dbraw/zinc/17/76/58/701177658.db2.gz KUAWXOVHQLQQTN-INIZCTEOSA-N 2 2 315.373 1.852 20 10 DDCDLP Cc1cc(Br)cc(C[NH2+]C[C@H]2C[NH2+]CCO2)c1O ZINC000841099427 702345732 /nfs/dbraw/zinc/34/57/32/702345732.db2.gz PVSIDXVGQYSCTR-GFCCVEGCSA-N 2 2 315.211 1.541 20 10 DDCDLP CC[C@H](O)C[NH2+]CCC[NH+]1CCN(c2ccc(OC)cc2)CC1 ZINC000818943447 704031433 /nfs/dbraw/zinc/03/14/33/704031433.db2.gz UBMRQNAYVAFAMC-KRWDZBQOSA-N 2 2 321.465 1.568 20 10 DDCDLP NC(=O)[C@@H]1CCC[N@@H+]1CCC[NH2+]Cc1cc(Cl)ccc1O ZINC000858224278 704681289 /nfs/dbraw/zinc/68/12/89/704681289.db2.gz AHNVPWKYKBFXLM-ZDUSSCGKSA-N 2 2 311.813 1.475 20 10 DDCDLP NC(=O)[C@@H]1CCC[N@H+]1CCC[NH2+]Cc1cc(Cl)ccc1O ZINC000858224278 704681291 /nfs/dbraw/zinc/68/12/91/704681291.db2.gz AHNVPWKYKBFXLM-ZDUSSCGKSA-N 2 2 311.813 1.475 20 10 DDCDLP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000925762659 714930342 /nfs/dbraw/zinc/93/03/42/714930342.db2.gz MXQZAUQNJFRFSK-YJBOKZPZSA-N 3 2 302.466 1.669 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C[NH3+])C3)cc2F)CC1 ZINC001326992058 861779777 /nfs/dbraw/zinc/77/97/77/861779777.db2.gz XWRQNHHJEFLGKD-INIZCTEOSA-N 3 2 320.456 1.748 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H](C[NH3+])C3)cc2F)CC1 ZINC001326992058 861779787 /nfs/dbraw/zinc/77/97/87/861779787.db2.gz XWRQNHHJEFLGKD-INIZCTEOSA-N 3 2 320.456 1.748 20 10 DDCDLP CN1CCN(c2ccc(C[N@@H+]3CCC[C@@H](C[NH3+])C3)cc2F)CC1 ZINC001326992058 861779793 /nfs/dbraw/zinc/77/97/93/861779793.db2.gz XWRQNHHJEFLGKD-INIZCTEOSA-N 2 2 320.456 1.748 20 10 DDCDLP CN1CCN(c2ccc(C[N@H+]3CCC[C@@H](C[NH3+])C3)cc2F)CC1 ZINC001326992058 861779799 /nfs/dbraw/zinc/77/97/99/861779799.db2.gz XWRQNHHJEFLGKD-INIZCTEOSA-N 2 2 320.456 1.748 20 10 DDCDLP C[NH+](C)CCN1CC2(C1)C[NH+](Cc1cc(F)c(F)cc1O)C2 ZINC001275774660 853725171 /nfs/dbraw/zinc/72/51/71/853725171.db2.gz SQRIVBSYKYYPOB-UHFFFAOYSA-N 2 2 311.376 1.350 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH+]3CC4(C3)CCCO4)cc2)CC1 ZINC001139408770 860391318 /nfs/dbraw/zinc/39/13/18/860391318.db2.gz QINYGBLCIRKMSE-UHFFFAOYSA-N 2 2 301.434 1.803 20 10 DDCDLP [NH3+]C[C@H]([NH3+])c1ccc(C(=O)N2CCc3cccc(O)c3C2)cc1 ZINC001160873277 866160511 /nfs/dbraw/zinc/16/05/11/866160511.db2.gz XJIGUFUUENCIOQ-INIZCTEOSA-N 2 2 311.385 1.549 20 10 DDCDLP CC[NH+](CC)CCCN1CC[NH+](Cc2ccc(O)c(O)c2)CC1 ZINC001203882964 870816367 /nfs/dbraw/zinc/81/63/67/870816367.db2.gz YXIRWKYQXSFZPR-UHFFFAOYSA-N 2 2 321.465 1.947 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](C)[C@@H]([NH3+])C3)cc2)CC1 ZINC001205872236 871881969 /nfs/dbraw/zinc/88/19/69/871881969.db2.gz IJZIPTXGVPZYJI-APWZRJJASA-N 3 2 316.493 1.998 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](C)[C@@H]([NH3+])C3)cc2)CC1 ZINC001205872236 871881988 /nfs/dbraw/zinc/88/19/88/871881988.db2.gz IJZIPTXGVPZYJI-APWZRJJASA-N 3 2 316.493 1.998 20 10 DDCDLP C[N@H+](Cc1cc2c(cc1O)OCC[NH2+]C2)[C@]1(C)CCC[NH2+]C1 ZINC001236208807 889145897 /nfs/dbraw/zinc/14/58/97/889145897.db2.gz XODNTUWDDWPEKZ-QGZVFWFLSA-N 3 2 305.422 1.448 20 10 DDCDLP C[N@@H+](Cc1cc2c(cc1O)OCC[NH2+]C2)[C@]1(C)CCC[NH2+]C1 ZINC001236208807 889145909 /nfs/dbraw/zinc/14/59/09/889145909.db2.gz XODNTUWDDWPEKZ-QGZVFWFLSA-N 3 2 305.422 1.448 20 10 DDCDLP C[N@H+](CCN1CC[NH+](C)CC1)Cc1cc(F)c(Cl)cc1O ZINC001237950427 889951341 /nfs/dbraw/zinc/95/13/41/889951341.db2.gz SXZAYMHVPFIBIS-UHFFFAOYSA-N 2 2 315.820 1.864 20 10 DDCDLP C[N@@H+](CCN1CC[NH+](C)CC1)Cc1cc(F)c(Cl)cc1O ZINC001237950427 889951348 /nfs/dbraw/zinc/95/13/48/889951348.db2.gz SXZAYMHVPFIBIS-UHFFFAOYSA-N 2 2 315.820 1.864 20 10 DDCDLP CN(C)C(=O)C[NH+]1CCC([NH2+]Cc2ccc(N(C)C)cc2)CC1 ZINC000079076913 185154403 /nfs/dbraw/zinc/15/44/03/185154403.db2.gz ZVIHWYYSUIYNOY-UHFFFAOYSA-N 2 2 318.465 1.395 20 10 DDCDLP Cc1cc(C)c([C@H](C)[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)c(O)c1 ZINC000284098299 131048925 /nfs/dbraw/zinc/04/89/25/131048925.db2.gz MRBBVRXYDWICCC-GJZGRUSLSA-N 2 2 319.449 1.999 20 10 DDCDLP Cc1cc(C)c([C@H](C)[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c(O)c1 ZINC000284098299 131048926 /nfs/dbraw/zinc/04/89/26/131048926.db2.gz MRBBVRXYDWICCC-GJZGRUSLSA-N 2 2 319.449 1.999 20 10 DDCDLP CCOc1cccc(C[N@H+](CCO)C2CC[NH+](C)CC2)c1O ZINC000269366625 408283477 /nfs/dbraw/zinc/28/34/77/408283477.db2.gz REXLABCLFWUTCC-UHFFFAOYSA-N 2 2 308.422 1.679 20 10 DDCDLP CCOc1cccc(C[N@@H+](CCO)C2CC[NH+](C)CC2)c1O ZINC000269366625 408283482 /nfs/dbraw/zinc/28/34/82/408283482.db2.gz REXLABCLFWUTCC-UHFFFAOYSA-N 2 2 308.422 1.679 20 10 DDCDLP COc1ccc([NH+]2CCC(N(C)C(=O)[C@H]3CC[NH2+]C3)CC2)cc1 ZINC000378211730 418719864 /nfs/dbraw/zinc/71/98/64/418719864.db2.gz RUJOCBCNMUVKPL-AWEZNQCLSA-N 2 2 317.433 1.732 20 10 DDCDLP COC[C@@]1(C[NH2+]Cc2cc(Cl)cc(OC)c2O)CCC[NH2+]1 ZINC000841066386 702333726 /nfs/dbraw/zinc/33/37/26/702333726.db2.gz ARNTXNKIQHSZAI-HNNXBMFYSA-N 2 2 314.813 1.912 20 10 DDCDLP [NH3+]C[C@H]1C[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)CCCO1 ZINC000841101536 702347486 /nfs/dbraw/zinc/34/74/86/702347486.db2.gz XKIMMDOIINXISM-HNNXBMFYSA-N 2 2 323.412 1.212 20 10 DDCDLP [NH3+]C[C@H]1C[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)CCCO1 ZINC000841101536 702347494 /nfs/dbraw/zinc/34/74/94/702347494.db2.gz XKIMMDOIINXISM-HNNXBMFYSA-N 2 2 323.412 1.212 20 10 DDCDLP COC[C@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)C1CCOCC1 ZINC000817940658 702530152 /nfs/dbraw/zinc/53/01/52/702530152.db2.gz GNDFTEYTDUNAHD-MSOLQXFVSA-N 2 2 321.465 1.784 20 10 DDCDLP Cc1ccc(C(=O)NCC[N@@H+](C)CCC[NH+](C)C)c(O)c1O ZINC000855414518 704484385 /nfs/dbraw/zinc/48/43/85/704484385.db2.gz FXWKBCNICHWQGU-UHFFFAOYSA-N 2 2 309.410 1.020 20 10 DDCDLP Cc1ccc(C(=O)NCC[N@H+](C)CCC[NH+](C)C)c(O)c1O ZINC000855414518 704484386 /nfs/dbraw/zinc/48/43/86/704484386.db2.gz FXWKBCNICHWQGU-UHFFFAOYSA-N 2 2 309.410 1.020 20 10 DDCDLP CCOc1ccc(C[NH+]2CCC([N@@H+]3CC[C@H](O)C3)CC2)c(O)c1 ZINC000827699105 706051910 /nfs/dbraw/zinc/05/19/10/706051910.db2.gz FASDGJMRPIFDKA-INIZCTEOSA-N 2 2 320.433 1.822 20 10 DDCDLP CCOc1ccc(C[NH+]2CCC([N@H+]3CC[C@H](O)C3)CC2)c(O)c1 ZINC000827699105 706051914 /nfs/dbraw/zinc/05/19/14/706051914.db2.gz FASDGJMRPIFDKA-INIZCTEOSA-N 2 2 320.433 1.822 20 10 DDCDLP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cnn(C)n1 ZINC000926853865 712912816 /nfs/dbraw/zinc/91/28/16/712912816.db2.gz IUVPEYKCMUTTQO-CQSZACIVSA-N 2 2 314.437 1.418 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC(=O)NC[C@H]3C)cc2)CC1 ZINC001140305530 860616352 /nfs/dbraw/zinc/61/63/52/860616352.db2.gz AWQCAJZYDSQPOV-OAHLLOKOSA-N 2 2 316.449 1.149 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CC(=O)NC[C@H]3C)cc2)CC1 ZINC001140305530 860616353 /nfs/dbraw/zinc/61/63/53/860616353.db2.gz AWQCAJZYDSQPOV-OAHLLOKOSA-N 2 2 316.449 1.149 20 10 DDCDLP COC(=O)CC[N@H+](CCC[NH+](C)C)Cc1cc(O)ccc1O ZINC001141158495 860798350 /nfs/dbraw/zinc/79/83/50/860798350.db2.gz BPWXHMAAMJLEGM-UHFFFAOYSA-N 2 2 310.394 1.415 20 10 DDCDLP COC(=O)CC[N@@H+](CCC[NH+](C)C)Cc1cc(O)ccc1O ZINC001141158495 860798356 /nfs/dbraw/zinc/79/83/56/860798356.db2.gz BPWXHMAAMJLEGM-UHFFFAOYSA-N 2 2 310.394 1.415 20 10 DDCDLP Oc1ccc(CNc2ccc(N3CC[NH2+]CC3)c[nH+]2)cc1O ZINC001158997409 865028336 /nfs/dbraw/zinc/02/83/36/865028336.db2.gz GZUAWSAYFDHVOR-UHFFFAOYSA-N 2 2 300.362 1.515 20 10 DDCDLP COc1cccc(C[NH+]2CCN(c3cc[nH+]c(C)n3)CC2)c1O ZINC000184762539 408686164 /nfs/dbraw/zinc/68/61/64/408686164.db2.gz LAOQRXNELSGNPF-UHFFFAOYSA-N 2 2 314.389 1.821 20 10 DDCDLP C[C@@H]1C(=O)N(C)CC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000779199990 698401392 /nfs/dbraw/zinc/40/13/92/698401392.db2.gz OVUBDTKLKXLITM-OAHLLOKOSA-N 2 2 316.449 1.101 20 10 DDCDLP C[C@@H]1C(=O)N(C)CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000779199990 698401394 /nfs/dbraw/zinc/40/13/94/698401394.db2.gz OVUBDTKLKXLITM-OAHLLOKOSA-N 2 2 316.449 1.101 20 10 DDCDLP CN1CCCc2cc(C[NH2+][C@H](C3CC3)[C@H]3C[NH2+]CCO3)ccc21 ZINC000817900914 702513952 /nfs/dbraw/zinc/51/39/52/702513952.db2.gz QVJAJKXPLJOYCT-RTBURBONSA-N 2 2 315.461 1.926 20 10 DDCDLP C[NH+](C)C1CC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000848557035 703562802 /nfs/dbraw/zinc/56/28/02/703562802.db2.gz GHEKHKPDCSTIBW-UHFFFAOYSA-N 3 2 302.466 1.621 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H]4CCC[C@@]4([NH3+])C3)cc2)CC1 ZINC000857226251 704565895 /nfs/dbraw/zinc/56/58/95/704565895.db2.gz JAYUETDJVOHKSC-PKOBYXMFSA-N 3 2 314.477 1.752 20 10 DDCDLP C[C@]12C[NH2+]C[C@H]1C[N@H+](Cc1ccc(N3CCOCC3)c(F)c1)C2 ZINC000873228511 707777655 /nfs/dbraw/zinc/77/76/55/707777655.db2.gz SPFZAHFBKVRUJG-MAUKXSAKSA-N 2 2 319.424 1.704 20 10 DDCDLP C[C@]12C[NH2+]C[C@H]1C[N@@H+](Cc1ccc(N3CCOCC3)c(F)c1)C2 ZINC000873228511 707777659 /nfs/dbraw/zinc/77/76/59/707777659.db2.gz SPFZAHFBKVRUJG-MAUKXSAKSA-N 2 2 319.424 1.704 20 10 DDCDLP COc1ccc(C[NH2+]CCNC(=O)Cc2c[nH]c[nH+]2)cc1C ZINC001134397102 771001126 /nfs/dbraw/zinc/00/11/26/771001126.db2.gz JARFJQRKYYQGTO-UHFFFAOYSA-N 2 2 302.378 1.175 20 10 DDCDLP Cn1cnc(C[NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)c1 ZINC001333896539 867130257 /nfs/dbraw/zinc/13/02/57/867130257.db2.gz YEPHFLAOMDGEFX-UHFFFAOYSA-N 2 2 317.412 1.601 20 10 DDCDLP Cc1cc(C[N@@H+]2C[C@@H](O)[C@@H](C[NH3+])C2)c(O)cc1Br ZINC001206499818 872386307 /nfs/dbraw/zinc/38/63/07/872386307.db2.gz CXFIDECMEQNEMV-GXFFZTMASA-N 2 2 315.211 1.215 20 10 DDCDLP Cc1cc(C[N@H+]2C[C@@H](O)[C@@H](C[NH3+])C2)c(O)cc1Br ZINC001206499818 872386326 /nfs/dbraw/zinc/38/63/26/872386326.db2.gz CXFIDECMEQNEMV-GXFFZTMASA-N 2 2 315.211 1.215 20 10 DDCDLP [NH3+][C@@H]1CN(Cc2cc3c(cc2O)OCC[NH2+]C3)CCC1(F)F ZINC001206685244 872507811 /nfs/dbraw/zinc/50/78/11/872507811.db2.gz YIMFXZBLTROOGM-CQSZACIVSA-N 2 2 313.348 1.043 20 10 DDCDLP Cc1cc(Cl)cc(C[NH+]2CC(N3CC[NH+](C)CC3)C2)c1O ZINC001237690473 889804594 /nfs/dbraw/zinc/80/45/94/889804594.db2.gz YAMRVBIQPHMRFL-UHFFFAOYSA-N 2 2 309.841 1.786 20 10 DDCDLP C[C@H]([NH2+]CCC[N@@H+]1CCC[C@@H]1C(N)=O)c1ccc(N(C)C)cc1 ZINC000268884745 299292886 /nfs/dbraw/zinc/29/28/86/299292886.db2.gz IJJQKNCHKPSWNN-WMLDXEAASA-N 2 2 318.465 1.743 20 10 DDCDLP C[C@H]([NH2+]CCC[N@H+]1CCC[C@@H]1C(N)=O)c1ccc(N(C)C)cc1 ZINC000268884745 299292889 /nfs/dbraw/zinc/29/28/89/299292889.db2.gz IJJQKNCHKPSWNN-WMLDXEAASA-N 2 2 318.465 1.743 20 10 DDCDLP Oc1c(F)cccc1C[NH+]1CCN(CC[NH+]2CCCC2)CC1 ZINC000272224707 130008882 /nfs/dbraw/zinc/00/88/82/130008882.db2.gz CQMDHMPJMYLDEF-UHFFFAOYSA-N 2 2 307.413 1.745 20 10 DDCDLP COc1cc(Cl)cc(C[N@@H+]2CCCO[C@H](C[NH3+])C2)c1O ZINC000313395055 698681809 /nfs/dbraw/zinc/68/18/09/698681809.db2.gz XBTJAUHAGQEYNC-GFCCVEGCSA-N 2 2 300.786 1.604 20 10 DDCDLP COc1cc(Cl)cc(C[N@H+]2CCCO[C@H](C[NH3+])C2)c1O ZINC000313395055 698681813 /nfs/dbraw/zinc/68/18/13/698681813.db2.gz XBTJAUHAGQEYNC-GFCCVEGCSA-N 2 2 300.786 1.604 20 10 DDCDLP C[C@@H]1CN(C)C(=O)C[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000783731023 698871585 /nfs/dbraw/zinc/87/15/85/698871585.db2.gz XNVRFFXWFDFFNW-OAHLLOKOSA-N 2 2 316.449 1.101 20 10 DDCDLP C[C@@H]1CN(C)C(=O)C[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000783731023 698871588 /nfs/dbraw/zinc/87/15/88/698871588.db2.gz XNVRFFXWFDFFNW-OAHLLOKOSA-N 2 2 316.449 1.101 20 10 DDCDLP COC[C@]1(C[NH2+]Cc2ccc(N3CCOCC3)cc2)CCC[NH2+]1 ZINC000841065848 702333229 /nfs/dbraw/zinc/33/32/29/702333229.db2.gz IBHODESFLHZHEI-GOSISDBHSA-N 2 2 319.449 1.381 20 10 DDCDLP CN(C)c1ccc(C[NH2+][C@@H](C2CC2)[C@@H]2C[NH2+]CCO2)cc1F ZINC000817900594 702513997 /nfs/dbraw/zinc/51/39/97/702513997.db2.gz ODAPINLCNHCBEQ-IRXDYDNUSA-N 2 2 307.413 1.748 20 10 DDCDLP Cc1cccc(C[N@@H+]2CCC[C@@H](N3CC[NH2+]CC3=O)C2)c1O ZINC000843063442 702811735 /nfs/dbraw/zinc/81/17/35/702811735.db2.gz AYCOSHWRPSNENE-OAHLLOKOSA-N 2 2 303.406 1.097 20 10 DDCDLP Cc1cccc(C[N@H+]2CCC[C@@H](N3CC[NH2+]CC3=O)C2)c1O ZINC000843063442 702811738 /nfs/dbraw/zinc/81/17/38/702811738.db2.gz AYCOSHWRPSNENE-OAHLLOKOSA-N 2 2 303.406 1.097 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[NH2+][C@H](C[NH3+])C(C)(C)C)cc1 ZINC000844225703 702997055 /nfs/dbraw/zinc/99/70/55/702997055.db2.gz GKOIKWLUWYDTIE-OAHLLOKOSA-N 2 2 306.454 1.332 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@@H]3[C@H](CC[NH+]3C)C2)ccc1[N+](=O)[O-] ZINC000877743564 706195749 /nfs/dbraw/zinc/19/57/49/706195749.db2.gz WVOMPDFEGZVGOE-DGCLKSJQSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@@H]3[C@H](CC[NH+]3C)C2)ccc1[N+](=O)[O-] ZINC000877743564 706195751 /nfs/dbraw/zinc/19/57/51/706195751.db2.gz WVOMPDFEGZVGOE-DGCLKSJQSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@@H]3[C@H](CC[N@@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000877743564 706195754 /nfs/dbraw/zinc/19/57/54/706195754.db2.gz WVOMPDFEGZVGOE-DGCLKSJQSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@@H]3[C@H](CC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000877743564 706195756 /nfs/dbraw/zinc/19/57/56/706195756.db2.gz WVOMPDFEGZVGOE-DGCLKSJQSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1ccc(N2CC[NH+](C[C@@]3(C)CC[NH2+]C3)CC2)c(OC)c1 ZINC000873220546 707773974 /nfs/dbraw/zinc/77/39/74/707773974.db2.gz UNHUSKVGMSHRMA-SFHVURJKSA-N 2 2 319.449 1.825 20 10 DDCDLP CC[N@@H+]1CCO[C@@H]2C[NH+](Cc3cc(OC)c(O)cc3O)C[C@@H]2C1 ZINC001231635565 885772712 /nfs/dbraw/zinc/77/27/12/885772712.db2.gz FKQUEULGXAWWAS-SUMWQHHRSA-N 2 2 322.405 1.259 20 10 DDCDLP CC[N@H+]1CCO[C@@H]2C[NH+](Cc3cc(OC)c(O)cc3O)C[C@@H]2C1 ZINC001231635565 885772718 /nfs/dbraw/zinc/77/27/18/885772718.db2.gz FKQUEULGXAWWAS-SUMWQHHRSA-N 2 2 322.405 1.259 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@H+](Cc3cc(OC)c(O)cc3O)C[C@@H]2C1 ZINC001231635565 885772724 /nfs/dbraw/zinc/77/27/24/885772724.db2.gz FKQUEULGXAWWAS-SUMWQHHRSA-N 2 2 322.405 1.259 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@@H+](Cc3cc(OC)c(O)cc3O)C[C@@H]2C1 ZINC001231635565 885772730 /nfs/dbraw/zinc/77/27/30/885772730.db2.gz FKQUEULGXAWWAS-SUMWQHHRSA-N 2 2 322.405 1.259 20 10 DDCDLP COc1ccc(N2CC[NH+]([C@@H]3CC[NH2+][C@H](C)C3)CC2)c(OC)c1 ZINC001246946115 893012445 /nfs/dbraw/zinc/01/24/45/893012445.db2.gz FYORKNRJJJEXCJ-HUUCEWRRSA-N 2 2 319.449 1.966 20 10 DDCDLP COc1ccc([NH+]2CCC(N(C)C(=O)[C@H](C)C[NH3+])CC2)cc1 ZINC000375962635 533999017 /nfs/dbraw/zinc/99/90/17/533999017.db2.gz HINWAPSPPRYBBS-CYBMUJFWSA-N 2 2 305.422 1.717 20 10 DDCDLP COc1c(O)c(C[NH2+][C@H]2CCn3cc[nH+]c3C2)ccc1[N+](=O)[O-] ZINC000775086365 697961656 /nfs/dbraw/zinc/96/16/56/697961656.db2.gz FJKGDIFFOSAYQC-NSHDSACASA-N 2 2 318.333 1.610 20 10 DDCDLP [NH3+]C[C@H]1C[N@H+](Cc2cc(Br)ccc2O)CCCO1 ZINC000313356136 698681901 /nfs/dbraw/zinc/68/19/01/698681901.db2.gz RMYRBDNBXNFEDO-LBPRGKRZSA-N 2 2 315.211 1.704 20 10 DDCDLP C[NH+](C)C[C@@](C)(O)C[NH2+]Cc1c(O)cccc1Br ZINC000706833732 699245094 /nfs/dbraw/zinc/24/50/94/699245094.db2.gz DEXGZFMFZHWXNG-ZDUSSCGKSA-N 2 2 317.227 1.557 20 10 DDCDLP C[C@@H]1CC[NH2+]C[C@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000817895114 702511390 /nfs/dbraw/zinc/51/13/90/702511390.db2.gz QMMABYLMMZPKKH-DNVCBOLYSA-N 2 2 317.477 1.983 20 10 DDCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000843125912 702825130 /nfs/dbraw/zinc/82/51/30/702825130.db2.gz KQIONABWGAZBPL-YFHUEUNASA-N 3 2 302.466 1.730 20 10 DDCDLP CN(C)c1ccc(C[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)cc1 ZINC000858223808 704681308 /nfs/dbraw/zinc/68/13/08/704681308.db2.gz POEUZNZCSRTFLK-INIZCTEOSA-N 2 2 304.438 1.182 20 10 DDCDLP CN(C)c1ccc(C[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)cc1 ZINC000858223808 704681310 /nfs/dbraw/zinc/68/13/10/704681310.db2.gz POEUZNZCSRTFLK-INIZCTEOSA-N 2 2 304.438 1.182 20 10 DDCDLP C[C@@H]([NH3+])[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001326232931 861216306 /nfs/dbraw/zinc/21/63/06/861216306.db2.gz UGHATQCCATWMTH-GDBMZVCRSA-N 3 2 320.456 1.747 20 10 DDCDLP [NH3+][C@H]1CN(Cc2cc3c(cc2O)OCC[NH2+]C3)CCC1(F)F ZINC001206685243 872507196 /nfs/dbraw/zinc/50/71/96/872507196.db2.gz YIMFXZBLTROOGM-AWEZNQCLSA-N 2 2 313.348 1.043 20 10 DDCDLP Cc1cc(C)c(CNC(=O)c2ccc([C@@H]([NH3+])C[NH3+])cc2)c(O)c1 ZINC001220825803 879290016 /nfs/dbraw/zinc/29/00/16/879290016.db2.gz RVRKAKBBLJMNTG-INIZCTEOSA-N 2 2 313.401 1.898 20 10 DDCDLP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC001222470252 880491454 /nfs/dbraw/zinc/49/14/54/880491454.db2.gz CDLFWYFSFWDMGP-GOSISDBHSA-N 3 2 316.449 1.130 20 10 DDCDLP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC001222470252 880491464 /nfs/dbraw/zinc/49/14/64/880491464.db2.gz CDLFWYFSFWDMGP-GOSISDBHSA-N 3 2 316.449 1.130 20 10 DDCDLP Cn1ccc2c1cc[nH+]c2-c1cnc(N2CC[NH+](C)CC2)nc1 ZINC001235913266 889005031 /nfs/dbraw/zinc/00/50/31/889005031.db2.gz GOQUVGYWCZWARH-UHFFFAOYSA-N 2 2 308.389 1.782 20 10 DDCDLP CC[C@@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000285969225 535803285 /nfs/dbraw/zinc/80/32/85/535803285.db2.gz HAQUWNBHDACCEW-OAHLLOKOSA-N 2 2 323.412 1.736 20 10 DDCDLP C[C@@H]([NH2+]C[C@@H](O)C[NH+](C)C)c1ccc(Br)cc1O ZINC000756556352 700627811 /nfs/dbraw/zinc/62/78/11/700627811.db2.gz NVIBKCLJSBITET-MWLCHTKSSA-N 2 2 317.227 1.728 20 10 DDCDLP Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C1CC1)[C@H]1C[NH2+]CCO1 ZINC000817895264 702512077 /nfs/dbraw/zinc/51/20/77/702512077.db2.gz WMDQKXCFVNGJRE-MSOLQXFVSA-N 2 2 303.450 1.918 20 10 DDCDLP C[C@@H]([NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1)C(C)(C)n1cncn1 ZINC000817941208 702530956 /nfs/dbraw/zinc/53/09/56/702530956.db2.gz JKCVLKAOVRWYRS-CZUORRHYSA-N 2 2 316.453 1.757 20 10 DDCDLP COc1ccc(N(C)CC[N@H+](C)C[C@H](O)C[NH+](C)C2CC2)cc1 ZINC000844403182 703026976 /nfs/dbraw/zinc/02/69/76/703026976.db2.gz ZETOKHHZGONLIW-KRWDZBQOSA-N 2 2 321.465 1.518 20 10 DDCDLP COc1ccc(N(C)CC[N@@H+](C)C[C@H](O)C[NH+](C)C2CC2)cc1 ZINC000844403182 703026978 /nfs/dbraw/zinc/02/69/78/703026978.db2.gz ZETOKHHZGONLIW-KRWDZBQOSA-N 2 2 321.465 1.518 20 10 DDCDLP COc1ccc(N(C)CC[NH+](C)C[C@H](O)C[N@H+](C)C2CC2)cc1 ZINC000844403182 703026980 /nfs/dbraw/zinc/02/69/80/703026980.db2.gz ZETOKHHZGONLIW-KRWDZBQOSA-N 2 2 321.465 1.518 20 10 DDCDLP COc1ccc(N(C)CC[NH+](C)C[C@H](O)C[N@@H+](C)C2CC2)cc1 ZINC000844403182 703026982 /nfs/dbraw/zinc/02/69/82/703026982.db2.gz ZETOKHHZGONLIW-KRWDZBQOSA-N 2 2 321.465 1.518 20 10 DDCDLP C[NH+](C)C1CC([NH2+]Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000848557064 703562900 /nfs/dbraw/zinc/56/29/00/703562900.db2.gz HBZXIUZVBQVVEJ-UHFFFAOYSA-N 2 2 307.413 1.845 20 10 DDCDLP COc1ccc(C[NH2+]CCn2cc[nH+]c2)cc1Cn1cccn1 ZINC000873009185 707692592 /nfs/dbraw/zinc/69/25/92/707692592.db2.gz YIDOGNBJKOSGCT-UHFFFAOYSA-N 2 2 311.389 1.926 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1)c1c(O)cccc1F ZINC000886524905 708773081 /nfs/dbraw/zinc/77/30/81/708773081.db2.gz TXYYIIWEINGXMN-CHWSQXEVSA-N 2 2 323.412 1.769 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1c(O)cccc1F ZINC000886524905 708773083 /nfs/dbraw/zinc/77/30/83/708773083.db2.gz TXYYIIWEINGXMN-CHWSQXEVSA-N 2 2 323.412 1.769 20 10 DDCDLP Cc1c(C[NH+]2CC(N3CC[NH+](C)CC3)C2)c2ccccc2n1C ZINC001138259903 860047806 /nfs/dbraw/zinc/04/78/06/860047806.db2.gz QPFZROFUGFRYBT-UHFFFAOYSA-N 2 2 312.461 1.918 20 10 DDCDLP [NH3+][C@@H]1CN(Cc2ccc(N3CC[NH2+]CC3)cc2)CCC1(F)F ZINC001206669080 865246342 /nfs/dbraw/zinc/24/63/42/865246342.db2.gz ZLMSGLUDSNSSRA-OAHLLOKOSA-N 2 2 310.392 1.265 20 10 DDCDLP COC(=O)Cc1ccc(C[N@@H+]2C[C@H](C)CC[C@@H]2C[NH3+])c(O)c1 ZINC001205855862 871865496 /nfs/dbraw/zinc/86/54/96/871865496.db2.gz PXUVGFPBWYBSPT-IUODEOHRSA-N 2 2 306.406 1.667 20 10 DDCDLP COC(=O)Cc1ccc(C[N@H+]2C[C@H](C)CC[C@@H]2C[NH3+])c(O)c1 ZINC001205855862 871865513 /nfs/dbraw/zinc/86/55/13/871865513.db2.gz PXUVGFPBWYBSPT-IUODEOHRSA-N 2 2 306.406 1.667 20 10 DDCDLP CC(C)(C)c1cccc(C[N@@H+]2CCN3CC[NH2+]C[C@@H]3C2)c1O ZINC001234979894 888289936 /nfs/dbraw/zinc/28/99/36/888289936.db2.gz OQXLLVWQTDOARS-OAHLLOKOSA-N 2 2 303.450 1.779 20 10 DDCDLP CC(C)(C)c1cccc(C[N@H+]2CCN3CC[NH2+]C[C@@H]3C2)c1O ZINC001234979894 888289951 /nfs/dbraw/zinc/28/99/51/888289951.db2.gz OQXLLVWQTDOARS-OAHLLOKOSA-N 2 2 303.450 1.779 20 10 DDCDLP O=C(C[NH+]1CCCC1)N1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000180067053 697444380 /nfs/dbraw/zinc/44/43/80/697444380.db2.gz OLBZNPHWFKEAMH-UHFFFAOYSA-N 2 2 321.396 1.271 20 10 DDCDLP CC(C)[C@@H]([NH3+])CC[N@H+](C)CC(=O)NCc1ccc(N(C)C)cc1 ZINC000844220484 702995480 /nfs/dbraw/zinc/99/54/80/702995480.db2.gz FDZOHXTXMTXVGQ-KRWDZBQOSA-N 2 2 320.481 1.674 20 10 DDCDLP CC(C)[C@@H]([NH3+])CC[N@@H+](C)CC(=O)NCc1ccc(N(C)C)cc1 ZINC000844220484 702995481 /nfs/dbraw/zinc/99/54/81/702995481.db2.gz FDZOHXTXMTXVGQ-KRWDZBQOSA-N 2 2 320.481 1.674 20 10 DDCDLP C[C@@H]([NH2+]Cc1ccc(N2CCC(O)CC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000854230572 704368971 /nfs/dbraw/zinc/36/89/71/704368971.db2.gz UXCTYALZGDRYMB-KDOFPFPSSA-N 2 2 303.450 1.878 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@H]3[C@@H](CC[NH+]3C)C2)ccc1[N+](=O)[O-] ZINC000877743561 706195445 /nfs/dbraw/zinc/19/54/45/706195445.db2.gz WVOMPDFEGZVGOE-AAEUAGOBSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@H]3[C@@H](CC[NH+]3C)C2)ccc1[N+](=O)[O-] ZINC000877743561 706195447 /nfs/dbraw/zinc/19/54/47/706195447.db2.gz WVOMPDFEGZVGOE-AAEUAGOBSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@H]3[C@@H](CC[N@@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000877743561 706195451 /nfs/dbraw/zinc/19/54/51/706195451.db2.gz WVOMPDFEGZVGOE-AAEUAGOBSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@H]3[C@@H](CC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000877743561 706195453 /nfs/dbraw/zinc/19/54/53/706195453.db2.gz WVOMPDFEGZVGOE-AAEUAGOBSA-N 2 2 321.377 1.835 20 10 DDCDLP C[C@@H]1C[N@H+](C)C[C@H]1NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000898451540 708644530 /nfs/dbraw/zinc/64/45/30/708644530.db2.gz ZJXHLIBEBUKSOX-ZTFGCOKTSA-N 2 2 304.482 1.895 20 10 DDCDLP C[C@@H]1C[N@@H+](C)C[C@H]1NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000898451540 708644533 /nfs/dbraw/zinc/64/45/33/708644533.db2.gz ZJXHLIBEBUKSOX-ZTFGCOKTSA-N 2 2 304.482 1.895 20 10 DDCDLP COc1ccc(O)c(C[NH2+][C@@H]2C[NH2+]CC3(CCOCC3)C2)c1 ZINC000903972106 711352731 /nfs/dbraw/zinc/35/27/31/711352731.db2.gz GRSNZWSOMGVRAS-AWEZNQCLSA-N 2 2 306.406 1.649 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCNC(=O)[C@@H]3C)cc2)CC1 ZINC001140304022 860614752 /nfs/dbraw/zinc/61/47/52/860614752.db2.gz DZNOSNCTKMAIRY-HNNXBMFYSA-N 2 2 316.449 1.149 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CCNC(=O)[C@@H]3C)cc2)CC1 ZINC001140304022 860614755 /nfs/dbraw/zinc/61/47/55/860614755.db2.gz DZNOSNCTKMAIRY-HNNXBMFYSA-N 2 2 316.449 1.149 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+](C)[C@H](C)C(=O)OC)cc2)CC1 ZINC001140304272 860615406 /nfs/dbraw/zinc/61/54/06/860615406.db2.gz LMWBMHHVUBAFJU-OAHLLOKOSA-N 2 2 319.449 1.822 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+](C)[C@H](C)C(=O)OC)cc2)CC1 ZINC001140304272 860615411 /nfs/dbraw/zinc/61/54/11/860615411.db2.gz LMWBMHHVUBAFJU-OAHLLOKOSA-N 2 2 319.449 1.822 20 10 DDCDLP C[NH+](C)C1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775653229 698020009 /nfs/dbraw/zinc/02/00/09/698020009.db2.gz AINAAZKFYUGSKA-UHFFFAOYSA-N 3 2 316.493 1.964 20 10 DDCDLP C[NH+]1CCC([NH+]2CCC(NC(=O)C3=CC(=O)CS3)CC2)CC1 ZINC000732279913 699553472 /nfs/dbraw/zinc/55/34/72/699553472.db2.gz SZBQWFMGCUALRR-UHFFFAOYSA-N 2 2 323.462 1.742 20 10 DDCDLP C[C@@H]1CC[NH2+]C[C@@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000817895113 702511979 /nfs/dbraw/zinc/51/19/79/702511979.db2.gz QMMABYLMMZPKKH-BEFAXECRSA-N 2 2 317.477 1.983 20 10 DDCDLP O=C1C[NH2+]CCN1[C@@H]1CCC[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000843066571 702812595 /nfs/dbraw/zinc/81/25/95/702812595.db2.gz YGIZGKJAKSKRGK-CQSZACIVSA-N 2 2 323.824 1.442 20 10 DDCDLP O=C1C[NH2+]CCN1[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000843066571 702812598 /nfs/dbraw/zinc/81/25/98/702812598.db2.gz YGIZGKJAKSKRGK-CQSZACIVSA-N 2 2 323.824 1.442 20 10 DDCDLP C[C@@H](CC(=O)NC[C@H]([NH3+])c1ccc(N(C)C)cc1)n1cc[nH+]c1 ZINC000846663929 703310671 /nfs/dbraw/zinc/31/06/71/703310671.db2.gz SGHJWCWADWARAJ-BBRMVZONSA-N 2 2 315.421 1.716 20 10 DDCDLP Fc1cc(C[NH2+]CC23CC(C2)C[NH2+]3)ccc1N1CCOCC1 ZINC000853246547 704224380 /nfs/dbraw/zinc/22/43/80/704224380.db2.gz MOHDVASAUABTQO-UHFFFAOYSA-N 2 2 305.397 1.504 20 10 DDCDLP CC1(C)[NH2+]CC[C@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000925715098 714920111 /nfs/dbraw/zinc/92/01/11/714920111.db2.gz CXCKXGVKZHTEEA-QGZVFWFLSA-N 2 2 303.450 1.878 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH+]3CC4(C3)CS(=O)C4)cc2)CC1 ZINC001139408796 860391233 /nfs/dbraw/zinc/39/12/33/860391233.db2.gz QZDFMXRQPNIWDF-UHFFFAOYSA-N 2 2 319.474 1.003 20 10 DDCDLP COc1ccc2ccc(O)c(C[N@@H+]3CC[C@@H](O)[C@H]([NH3+])C3)c2c1 ZINC001206101820 872056251 /nfs/dbraw/zinc/05/62/51/872056251.db2.gz ABZNXQHLVZTIFV-NVXWUHKLSA-N 2 2 302.374 1.448 20 10 DDCDLP COc1ccc2ccc(O)c(C[N@H+]3CC[C@@H](O)[C@H]([NH3+])C3)c2c1 ZINC001206101820 872056272 /nfs/dbraw/zinc/05/62/72/872056272.db2.gz ABZNXQHLVZTIFV-NVXWUHKLSA-N 2 2 302.374 1.448 20 10 DDCDLP CN1CC[N@H+](C)C[C@@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293511428 409128473 /nfs/dbraw/zinc/12/84/73/409128473.db2.gz CEYCCMUSQIYRGU-NSHDSACASA-N 2 2 301.793 1.520 20 10 DDCDLP CN1CC[N@@H+](C)C[C@@H]1C[NH2+]Cc1cc(Cl)c(F)cc1O ZINC000293511428 409128474 /nfs/dbraw/zinc/12/84/74/409128474.db2.gz CEYCCMUSQIYRGU-NSHDSACASA-N 2 2 301.793 1.520 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CC[NH2+]C3(C)C)cc2)CC1 ZINC000841086868 702340592 /nfs/dbraw/zinc/34/05/92/702340592.db2.gz PXQXCXRXFUPHEU-KRWDZBQOSA-N 3 2 302.466 1.669 20 10 DDCDLP Oc1c(F)cccc1C[NH2+]C1CCC(N2CC[NH2+]CC2)CC1 ZINC000841086969 702341799 /nfs/dbraw/zinc/34/17/99/702341799.db2.gz GLNYISNAVQGCKP-UHFFFAOYSA-N 2 2 307.413 1.837 20 10 DDCDLP CN(C)c1ccc(CN(C)C(=O)C[NH+]2CCC(C)([NH3+])CC2)cc1 ZINC000844223515 702996590 /nfs/dbraw/zinc/99/65/90/702996590.db2.gz YGZYEQSSZUHNFB-UHFFFAOYSA-N 2 2 318.465 1.524 20 10 DDCDLP C[NH+]1CCN(c2cc[nH+]c(NC(=O)C3=CC(=O)CS3)c2)CC1 ZINC000870665574 704098803 /nfs/dbraw/zinc/09/88/03/704098803.db2.gz ZNQYMQFHHBKLOQ-UHFFFAOYSA-N 2 2 318.402 1.853 20 10 DDCDLP CN(C)c1ccc(/C=C\C[NH2+]CC(=O)N2CC[NH+](C)CC2)cc1 ZINC000835035302 707160285 /nfs/dbraw/zinc/16/02/85/707160285.db2.gz GSNPTIYWMQSLSR-PLNGDYQASA-N 2 2 316.449 1.129 20 10 DDCDLP c1cc(C[NH2+][C@H]2C[NH2+]CC3(CCOCC3)C2)cc2c1OCC2 ZINC000903974541 711353804 /nfs/dbraw/zinc/35/38/04/711353804.db2.gz QBHNKHZGWMCHIO-MRXNPFEDSA-N 2 2 302.418 1.870 20 10 DDCDLP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H]1CCC[NH2+]1 ZINC000925762656 714930513 /nfs/dbraw/zinc/93/05/13/714930513.db2.gz MXQZAUQNJFRFSK-MAUKXSAKSA-N 3 2 302.466 1.669 20 10 DDCDLP C[NH+](C)CCN1CC2(C1)C[NH+](Cc1cccc(Cl)c1O)C2 ZINC001276380516 857190958 /nfs/dbraw/zinc/19/09/58/857190958.db2.gz YKKIBOXYLCBOGS-UHFFFAOYSA-N 2 2 309.841 1.725 20 10 DDCDLP COc1cc(CN2CCn3c[nH+]cc3C2)cc(C[NH+](C)C)c1O ZINC001139257520 860339575 /nfs/dbraw/zinc/33/95/75/860339575.db2.gz DHSNYXULHIQQDW-UHFFFAOYSA-N 2 2 316.405 1.675 20 10 DDCDLP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2NC(=O)[C@@H]1C[C@H]([NH3+])C[NH2+]1 ZINC001157434630 863819301 /nfs/dbraw/zinc/81/93/01/863819301.db2.gz PKARBNZEEVJDJI-RBOXIYTFSA-N 2 2 317.433 1.438 20 10 DDCDLP C[N@@H+]1CCC12CN(Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC001276875755 880888446 /nfs/dbraw/zinc/88/84/46/880888446.db2.gz HZFGAFSBLCHTTD-UHFFFAOYSA-N 2 2 300.450 1.328 20 10 DDCDLP C[N@H+]1CCC12CN(Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC001276875755 880888466 /nfs/dbraw/zinc/88/84/66/880888466.db2.gz HZFGAFSBLCHTTD-UHFFFAOYSA-N 2 2 300.450 1.328 20 10 DDCDLP CN1CCC12C[NH+](Cc1ccc(N3CC[NH+](C)CC3)cc1)C2 ZINC001276875755 880888484 /nfs/dbraw/zinc/88/84/84/880888484.db2.gz HZFGAFSBLCHTTD-UHFFFAOYSA-N 2 2 300.450 1.328 20 10 DDCDLP C[NH+]1CCC([N@@H+]2CC[C@@H](NC(=O)Cc3ccc(N)cc3)C2)CC1 ZINC000377194709 418706598 /nfs/dbraw/zinc/70/65/98/418706598.db2.gz BSYICEUSMQHWNG-MRXNPFEDSA-N 2 2 316.449 1.096 20 10 DDCDLP C[NH+]1CCC([N@H+]2CC[C@@H](NC(=O)Cc3ccc(N)cc3)C2)CC1 ZINC000377194709 418706601 /nfs/dbraw/zinc/70/66/01/418706601.db2.gz BSYICEUSMQHWNG-MRXNPFEDSA-N 2 2 316.449 1.096 20 10 DDCDLP C[NH+]1CCC([N@@H+]2CC[C@H](NC(=O)Cc3ccc(N)cc3)C2)CC1 ZINC000377194708 418706804 /nfs/dbraw/zinc/70/68/04/418706804.db2.gz BSYICEUSMQHWNG-INIZCTEOSA-N 2 2 316.449 1.096 20 10 DDCDLP C[NH+]1CCC([N@H+]2CC[C@H](NC(=O)Cc3ccc(N)cc3)C2)CC1 ZINC000377194708 418706805 /nfs/dbraw/zinc/70/68/05/418706805.db2.gz BSYICEUSMQHWNG-INIZCTEOSA-N 2 2 316.449 1.096 20 10 DDCDLP Cc1ccc(C(=O)NCC[NH+]2CCC([NH+](C)C)CC2)c(O)c1O ZINC000182560530 526164780 /nfs/dbraw/zinc/16/47/80/526164780.db2.gz ZVCZXOQSIKIWAB-UHFFFAOYSA-N 2 2 321.421 1.162 20 10 DDCDLP COC[C@@H](C)[NH2+]CCC[NH+]1CCN(c2ccc(OC)cc2)CC1 ZINC000162834816 697330822 /nfs/dbraw/zinc/33/08/22/697330822.db2.gz PNUDKEPQKGZVRQ-MRXNPFEDSA-N 2 2 321.465 1.832 20 10 DDCDLP C[C@H]1CN(C)C(=O)C[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000783731018 698871941 /nfs/dbraw/zinc/87/19/41/698871941.db2.gz XNVRFFXWFDFFNW-HNNXBMFYSA-N 2 2 316.449 1.101 20 10 DDCDLP C[C@H]1CN(C)C(=O)C[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000783731018 698871944 /nfs/dbraw/zinc/87/19/44/698871944.db2.gz XNVRFFXWFDFFNW-HNNXBMFYSA-N 2 2 316.449 1.101 20 10 DDCDLP C[C@H]1[NH2+]CCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000841063864 702332430 /nfs/dbraw/zinc/33/24/30/702332430.db2.gz RKOQQKLGFUXLNR-CRAIPNDOSA-N 3 2 302.466 1.669 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[N@@H+]1CC[C@@]2(CCC[NH2+]2)C1 ZINC000841105897 702349146 /nfs/dbraw/zinc/34/91/46/702349146.db2.gz BOFAZBCWOPGONW-SFHVURJKSA-N 2 2 301.434 1.851 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[N@H+]1CC[C@@]2(CCC[NH2+]2)C1 ZINC000841105897 702349153 /nfs/dbraw/zinc/34/91/53/702349153.db2.gz BOFAZBCWOPGONW-SFHVURJKSA-N 2 2 301.434 1.851 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CC(=O)N[C@H](C)C3)cc2)CC1 ZINC001140302625 860615385 /nfs/dbraw/zinc/61/53/85/860615385.db2.gz VYEBWQVPDLVMGC-OAHLLOKOSA-N 2 2 316.449 1.149 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC(=O)N[C@H](C)C3)cc2)CC1 ZINC001140302625 860615392 /nfs/dbraw/zinc/61/53/92/860615392.db2.gz VYEBWQVPDLVMGC-OAHLLOKOSA-N 2 2 316.449 1.149 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCO[C@H]4C[C@H]43)cc2)CC1 ZINC001140309303 860616706 /nfs/dbraw/zinc/61/67/06/860616706.db2.gz APOYIIHMOGMWJH-MSOLQXFVSA-N 2 2 301.434 1.802 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CCO[C@H]4C[C@H]43)cc2)CC1 ZINC001140309303 860616707 /nfs/dbraw/zinc/61/67/07/860616707.db2.gz APOYIIHMOGMWJH-MSOLQXFVSA-N 2 2 301.434 1.802 20 10 DDCDLP [NH3+][C@H]1CN(Cc2ccc(N3CC[NH2+]CC3)cc2)CCC1(F)F ZINC001206669079 865246857 /nfs/dbraw/zinc/24/68/57/865246857.db2.gz ZLMSGLUDSNSSRA-HNNXBMFYSA-N 2 2 310.392 1.265 20 10 DDCDLP C[NH+](C)CCN1CCC2(C[NH+](Cc3cccc(F)c3O)C2)C1 ZINC001276537151 873336201 /nfs/dbraw/zinc/33/62/01/873336201.db2.gz DGHHLWHYGKHDKC-UHFFFAOYSA-N 2 2 307.413 1.601 20 10 DDCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@@H](C)[C@H](C)O)CC2)cc1 ZINC001345604840 873452402 /nfs/dbraw/zinc/45/24/02/873452402.db2.gz GHAPCYHXXLYPCF-HOTGVXAUSA-N 2 2 321.465 1.566 20 10 DDCDLP COc1ccc(N2CCOC[C@@]3(CCC[N@H+](CC[NH3+])C3)C2)cc1 ZINC001235493435 888679957 /nfs/dbraw/zinc/67/99/57/888679957.db2.gz MPZHUEFAPNRRGZ-GOSISDBHSA-N 2 2 319.449 1.573 20 10 DDCDLP COc1ccc(N2CCOC[C@@]3(CCC[N@@H+](CC[NH3+])C3)C2)cc1 ZINC001235493435 888679974 /nfs/dbraw/zinc/67/99/74/888679974.db2.gz MPZHUEFAPNRRGZ-GOSISDBHSA-N 2 2 319.449 1.573 20 10 DDCDLP COc1ccc(N2CCOC[C@]3(CCC[N@H+](CC[NH3+])C3)C2)cc1 ZINC001235493439 888680479 /nfs/dbraw/zinc/68/04/79/888680479.db2.gz MPZHUEFAPNRRGZ-SFHVURJKSA-N 2 2 319.449 1.573 20 10 DDCDLP COc1ccc(N2CCOC[C@]3(CCC[N@@H+](CC[NH3+])C3)C2)cc1 ZINC001235493439 888680486 /nfs/dbraw/zinc/68/04/86/888680486.db2.gz MPZHUEFAPNRRGZ-SFHVURJKSA-N 2 2 319.449 1.573 20 10 DDCDLP CC[N@H+](Cc1cc2c(cc1O)OCC[NH2+]C2)[C@H]1CCC[NH2+]C1 ZINC001236010434 889057567 /nfs/dbraw/zinc/05/75/67/889057567.db2.gz RRXZHEYWDNYWBG-HNNXBMFYSA-N 3 2 305.422 1.448 20 10 DDCDLP CC[N@@H+](Cc1cc2c(cc1O)OCC[NH2+]C2)[C@H]1CCC[NH2+]C1 ZINC001236010434 889057579 /nfs/dbraw/zinc/05/75/79/889057579.db2.gz RRXZHEYWDNYWBG-HNNXBMFYSA-N 3 2 305.422 1.448 20 10 DDCDLP COC[C@H](C)[NH2+]CCC[NH+]1CCN(c2ccc(OC)cc2)CC1 ZINC000162834683 697330943 /nfs/dbraw/zinc/33/09/43/697330943.db2.gz PNUDKEPQKGZVRQ-INIZCTEOSA-N 2 2 321.465 1.832 20 10 DDCDLP COc1c(O)c(C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000775029046 697956022 /nfs/dbraw/zinc/95/60/22/697956022.db2.gz JIHLFTDLPWOSGS-JQWIXIFHSA-N 2 2 309.366 1.881 20 10 DDCDLP COc1c(O)c(C[NH2+][C@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000775029046 697956025 /nfs/dbraw/zinc/95/60/25/697956025.db2.gz JIHLFTDLPWOSGS-JQWIXIFHSA-N 2 2 309.366 1.881 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@@H+]2CCC[C@H](C[NH3+])C2)cc1 ZINC000844218150 702994319 /nfs/dbraw/zinc/99/43/19/702994319.db2.gz TWXABBSTSPLROQ-OAHLLOKOSA-N 2 2 304.438 1.040 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@H+]2CCC[C@H](C[NH3+])C2)cc1 ZINC000844218150 702994322 /nfs/dbraw/zinc/99/43/22/702994322.db2.gz TWXABBSTSPLROQ-OAHLLOKOSA-N 2 2 304.438 1.040 20 10 DDCDLP CC(C)[C@](C)(C[NH3+])[NH2+]CC(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000844220897 702995746 /nfs/dbraw/zinc/99/57/46/702995746.db2.gz ODWRYVQMYNQNSS-SFHVURJKSA-N 2 2 320.481 1.674 20 10 DDCDLP CC[NH+]1CCN(C(=O)[C@H](C)[NH2+][C@H](C)c2ccccc2O)CC1 ZINC000879650008 706749720 /nfs/dbraw/zinc/74/97/20/706749720.db2.gz XIMLTFGERARKRF-KGLIPLIRSA-N 2 2 305.422 1.595 20 10 DDCDLP COc1ccc(N2CC[C@H]([NH2+][C@H](C)C[C@H]3COCC[NH2+]3)C2)cc1 ZINC000854216720 704367444 /nfs/dbraw/zinc/36/74/44/704367444.db2.gz DHRYTJMZQQWIRA-PMPSAXMXSA-N 2 2 319.449 1.631 20 10 DDCDLP COc1cc(O)c(C[N@@H+]2CCC(F)(F)[C@H](C[NH3+])C2)c(OC)c1 ZINC001205778007 746899544 /nfs/dbraw/zinc/89/95/44/746899544.db2.gz GCBOEHBJNUKWEK-SNVBAGLBSA-N 2 2 316.348 1.825 20 10 DDCDLP COc1cc(O)c(C[N@H+]2CCC(F)(F)[C@H](C[NH3+])C2)c(OC)c1 ZINC001205778007 746899554 /nfs/dbraw/zinc/89/95/54/746899554.db2.gz GCBOEHBJNUKWEK-SNVBAGLBSA-N 2 2 316.348 1.825 20 10 DDCDLP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC[NH2+]1 ZINC001117953662 780960888 /nfs/dbraw/zinc/96/08/88/780960888.db2.gz KVLZFDVEZKIOOU-HOCLYGCPSA-N 3 2 320.456 1.808 20 10 DDCDLP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N3CCN(C)CC3)c(F)c2)CC[NH2+]1 ZINC001117953662 780960892 /nfs/dbraw/zinc/96/08/92/780960892.db2.gz KVLZFDVEZKIOOU-HOCLYGCPSA-N 2 2 320.456 1.808 20 10 DDCDLP Cc1ccc(O)c(C[NH+]2CC3(CN(CCn4cc[nH+]c4)C3)C2)c1 ZINC001275311889 852972553 /nfs/dbraw/zinc/97/25/53/852972553.db2.gz SLKUAURPXUYTKS-UHFFFAOYSA-N 2 2 312.417 1.715 20 10 DDCDLP C[N@H+](Cc1cn[nH]c1)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319823966 866318369 /nfs/dbraw/zinc/31/83/69/866318369.db2.gz WLLOOIGJQTUXNV-UHFFFAOYSA-N 2 2 317.412 1.933 20 10 DDCDLP C[N@@H+](Cc1cn[nH]c1)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319823966 866318385 /nfs/dbraw/zinc/31/83/85/866318385.db2.gz WLLOOIGJQTUXNV-UHFFFAOYSA-N 2 2 317.412 1.933 20 10 DDCDLP C[C@@H]([NH2+]C[C@H](O)C[NH+]1CCCC1)c1ccc(F)c(F)c1O ZINC000276904183 408902593 /nfs/dbraw/zinc/90/25/93/408902593.db2.gz JNCXISHTAUQGDX-MNOVXSKESA-N 2 2 300.349 1.778 20 10 DDCDLP C[C@H]([NH2+][C@H]1CCN(CC[NH+]2CCOCC2)C1)c1ccccc1O ZINC000371681360 418807919 /nfs/dbraw/zinc/80/79/19/418807919.db2.gz QDLMDKCYNUDYBH-HOTGVXAUSA-N 2 2 319.449 1.449 20 10 DDCDLP C[C@H](C[NH2+][C@H](C)c1cc(F)cc(F)c1O)N1CC[NH+](C)CC1 ZINC000756544607 700626690 /nfs/dbraw/zinc/62/66/90/700626690.db2.gz KLGDSIJNERTZTF-VXGBXAGGSA-N 2 2 313.392 1.957 20 10 DDCDLP CN(C)c1ccc(C[NH2+]C[C@@H]2C[NH2+]CCO2)c(C(F)(F)F)c1 ZINC000841100559 702346233 /nfs/dbraw/zinc/34/62/33/702346233.db2.gz HXFBMEHNVGNQJQ-ZDUSSCGKSA-N 2 2 317.355 1.849 20 10 DDCDLP C[N@@H+]1CCN(Cc2ccc(N3CCCCC3)cc2)[C@H](C[NH3+])C1 ZINC000843120375 702823460 /nfs/dbraw/zinc/82/34/60/702823460.db2.gz HYIBIGOXHFSJLI-GOSISDBHSA-N 2 2 302.466 1.752 20 10 DDCDLP C[N@H+]1CCN(Cc2ccc(N3CCCCC3)cc2)[C@H](C[NH3+])C1 ZINC000843120375 702823462 /nfs/dbraw/zinc/82/34/62/702823462.db2.gz HYIBIGOXHFSJLI-GOSISDBHSA-N 2 2 302.466 1.752 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000843127314 702825416 /nfs/dbraw/zinc/82/54/16/702825416.db2.gz PSLMRQIYKGWGGY-ZYHUDNBSSA-N 2 2 307.350 1.493 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000843127314 702825418 /nfs/dbraw/zinc/82/54/18/702825418.db2.gz PSLMRQIYKGWGGY-ZYHUDNBSSA-N 2 2 307.350 1.493 20 10 DDCDLP CN(C)c1ccc(CN(C)C(=O)C[N@H+](C)C2CC([NH3+])C2)cc1 ZINC000844225344 702997129 /nfs/dbraw/zinc/99/71/29/702997129.db2.gz NZEXZMOVSKTZFA-UHFFFAOYSA-N 2 2 304.438 1.133 20 10 DDCDLP CN(C)c1ccc(CN(C)C(=O)C[N@@H+](C)C2CC([NH3+])C2)cc1 ZINC000844225344 702997130 /nfs/dbraw/zinc/99/71/30/702997130.db2.gz NZEXZMOVSKTZFA-UHFFFAOYSA-N 2 2 304.438 1.133 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[NH2+]Cc3cnc[nH]3)cc2F)CC1 ZINC000894233044 711026988 /nfs/dbraw/zinc/02/69/88/711026988.db2.gz BOCVTCGNCIZOFN-UHFFFAOYSA-N 2 2 317.412 1.981 20 10 DDCDLP COc1ccc(O)c(C[NH+]2CCC([N@@H+]3CC[C@@H](O)C3)CC2)c1 ZINC000827698700 706051776 /nfs/dbraw/zinc/05/17/76/706051776.db2.gz AYDZAXYRKVRBOI-OAHLLOKOSA-N 2 2 306.406 1.432 20 10 DDCDLP COc1ccc(O)c(C[NH+]2CCC([N@H+]3CC[C@@H](O)C3)CC2)c1 ZINC000827698700 706051779 /nfs/dbraw/zinc/05/17/79/706051779.db2.gz AYDZAXYRKVRBOI-OAHLLOKOSA-N 2 2 306.406 1.432 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH+]3CCC([NH3+])CC3)cc2F)CC1 ZINC001326188959 861173112 /nfs/dbraw/zinc/17/31/12/861173112.db2.gz UGOXDVUXVFOBQS-UHFFFAOYSA-N 3 2 306.429 1.501 20 10 DDCDLP CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@]12C[NH2+]C[C@H]1CC[NH2+]2 ZINC001161135195 866397971 /nfs/dbraw/zinc/39/79/71/866397971.db2.gz VIEWMQWXZJHQFH-QAPCUYQASA-N 2 2 316.449 1.053 20 10 DDCDLP C[C@H]1C[N@H+](Cc2cc(O)c(Br)cc2O)C[C@H]1C[NH3+] ZINC001205150627 871397082 /nfs/dbraw/zinc/39/70/82/871397082.db2.gz GFJSLHYYHCVJMT-WCBMZHEXSA-N 2 2 315.211 1.887 20 10 DDCDLP C[C@H]1C[N@@H+](Cc2cc(O)c(Br)cc2O)C[C@H]1C[NH3+] ZINC001205150627 871397102 /nfs/dbraw/zinc/39/71/02/871397102.db2.gz GFJSLHYYHCVJMT-WCBMZHEXSA-N 2 2 315.211 1.887 20 10 DDCDLP C[NH+](C)CCN1CC[NH+](Cc2cc(Cl)c(O)cc2O)CC1 ZINC001232258759 886191646 /nfs/dbraw/zinc/19/16/46/886191646.db2.gz NWEBHBNSLFYTFU-UHFFFAOYSA-N 2 2 313.829 1.430 20 10 DDCDLP COc1cc(C[N@@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)c(O)c(OC)c1 ZINC001237682456 889802643 /nfs/dbraw/zinc/80/26/43/889802643.db2.gz ZMYPCHDFIWEGPU-CXAGYDPISA-N 2 2 306.406 1.793 20 10 DDCDLP COc1cc(C[N@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)c(O)c(OC)c1 ZINC001237682456 889802648 /nfs/dbraw/zinc/80/26/48/889802648.db2.gz ZMYPCHDFIWEGPU-CXAGYDPISA-N 2 2 306.406 1.793 20 10 DDCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@H](C)CCO)CC2)cc1 ZINC000779341469 698414910 /nfs/dbraw/zinc/41/49/10/698414910.db2.gz HZVDMUWHLMQJAV-MRXNPFEDSA-N 2 2 321.465 1.568 20 10 DDCDLP Fc1cc(C[NH2+]C[C@@H]2CCCC[NH2+]2)ccc1N1CCOCC1 ZINC000841033213 702317233 /nfs/dbraw/zinc/31/72/33/702317233.db2.gz PPZIFCALIXDZKQ-HNNXBMFYSA-N 2 2 307.413 1.894 20 10 DDCDLP COCCn1cc(C[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)cn1 ZINC000841045253 702321772 /nfs/dbraw/zinc/32/17/72/702321772.db2.gz JKDODIWOAMSNAC-KRWDZBQOSA-N 2 2 317.437 1.385 20 10 DDCDLP Fc1cc(C[NH2+][C@H]2CCCC[NH2+]C2)ccc1N1CCOCC1 ZINC000841091411 702342410 /nfs/dbraw/zinc/34/24/10/702342410.db2.gz XLKNHJBOYOXSKI-HNNXBMFYSA-N 2 2 307.413 1.894 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)cc1 ZINC000844223168 702996574 /nfs/dbraw/zinc/99/65/74/702996574.db2.gz TZRNZEBVGOJCHX-SFHVURJKSA-N 2 2 316.449 1.054 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@H+]2CC[C@]3(CC[NH2+]C3)C2)cc1 ZINC000844223168 702996576 /nfs/dbraw/zinc/99/65/76/702996576.db2.gz TZRNZEBVGOJCHX-SFHVURJKSA-N 2 2 316.449 1.054 20 10 DDCDLP COc1ccc(N(C)CC[N@H+](C)C[C@@H](O)C[NH+](C)C(C)C)cc1 ZINC000852211602 703969816 /nfs/dbraw/zinc/96/98/16/703969816.db2.gz NIKAZMQLVUEVFJ-QGZVFWFLSA-N 2 2 323.481 1.764 20 10 DDCDLP COc1ccc(N(C)CC[N@@H+](C)C[C@@H](O)C[NH+](C)C(C)C)cc1 ZINC000852211602 703969819 /nfs/dbraw/zinc/96/98/19/703969819.db2.gz NIKAZMQLVUEVFJ-QGZVFWFLSA-N 2 2 323.481 1.764 20 10 DDCDLP COc1ccc(N(C)CC[NH+](C)C[C@@H](O)C[N@H+](C)C(C)C)cc1 ZINC000852211602 703969824 /nfs/dbraw/zinc/96/98/24/703969824.db2.gz NIKAZMQLVUEVFJ-QGZVFWFLSA-N 2 2 323.481 1.764 20 10 DDCDLP COc1ccc(N(C)CC[NH+](C)C[C@@H](O)C[N@@H+](C)C(C)C)cc1 ZINC000852211602 703969827 /nfs/dbraw/zinc/96/98/27/703969827.db2.gz NIKAZMQLVUEVFJ-QGZVFWFLSA-N 2 2 323.481 1.764 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[NH2+][C@]12CCC[C@H]1[NH2+]CC2 ZINC000873229822 707778544 /nfs/dbraw/zinc/77/85/44/707778544.db2.gz HDTMPVKAESEIKT-MSOLQXFVSA-N 2 2 301.434 1.897 20 10 DDCDLP COC(=O)CC1C[NH+](Cc2cc(C[NH+](C)C)c(O)c(OC)c2)C1 ZINC001139256435 860339437 /nfs/dbraw/zinc/33/94/37/860339437.db2.gz BCXPWDUZGGJIRO-UHFFFAOYSA-N 2 2 322.405 1.457 20 10 DDCDLP C[N@H+](CCN1CC[NH+](C)CC1)Cc1cc(Cl)c(O)cc1O ZINC001232262715 886196129 /nfs/dbraw/zinc/19/61/29/886196129.db2.gz NFQLTGGGSJURNN-UHFFFAOYSA-N 2 2 313.829 1.430 20 10 DDCDLP C[N@@H+](CCN1CC[NH+](C)CC1)Cc1cc(Cl)c(O)cc1O ZINC001232262715 886196146 /nfs/dbraw/zinc/19/61/46/886196146.db2.gz NFQLTGGGSJURNN-UHFFFAOYSA-N 2 2 313.829 1.430 20 10 DDCDLP Cc1cccc(O)c1C[NH+]1CCN(CC[NH+]2CCOCC2)CC1 ZINC001237488903 889666323 /nfs/dbraw/zinc/66/63/23/889666323.db2.gz AJGOBZJKYBKQAY-UHFFFAOYSA-N 2 2 319.449 1.150 20 10 DDCDLP CN1CCc2cc(C[NH2+]C[C@@H]3C[N@@H+]4CCC[C@H]4CO3)ccc21 ZINC000317793417 409870080 /nfs/dbraw/zinc/87/00/80/409870080.db2.gz ZKYPOOJQGPSMTP-DLBZAZTESA-N 2 2 301.434 1.632 20 10 DDCDLP CN1CCc2cc(C[NH2+]C[C@@H]3C[N@H+]4CCC[C@H]4CO3)ccc21 ZINC000317793417 409870088 /nfs/dbraw/zinc/87/00/88/409870088.db2.gz ZKYPOOJQGPSMTP-DLBZAZTESA-N 2 2 301.434 1.632 20 10 DDCDLP C[N@@H+]1CCN(C2CC[NH+](Cc3cc(F)ccc3O)CC2)C(=O)C1 ZINC000374742513 418558714 /nfs/dbraw/zinc/55/87/14/418558714.db2.gz JMDUKWYFZRWSGR-UHFFFAOYSA-N 2 2 321.396 1.270 20 10 DDCDLP C[N@H+]1CCN(C2CC[NH+](Cc3cc(F)ccc3O)CC2)C(=O)C1 ZINC000374742513 418558718 /nfs/dbraw/zinc/55/87/18/418558718.db2.gz JMDUKWYFZRWSGR-UHFFFAOYSA-N 2 2 321.396 1.270 20 10 DDCDLP C[NH+]1CCN(C(=O)C[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816542237 702109923 /nfs/dbraw/zinc/10/99/23/702109923.db2.gz HZLISSLDSHRDSK-UHFFFAOYSA-N 2 2 313.401 1.409 20 10 DDCDLP Cc1cc(C[N@H+](C)CC(=O)N2CC[NH+](C)CC2)ccc1N(C)C ZINC000879355375 706659065 /nfs/dbraw/zinc/65/90/65/706659065.db2.gz CVOTVDLESXLQBO-UHFFFAOYSA-N 2 2 318.465 1.267 20 10 DDCDLP Cc1cc(C[N@@H+](C)CC(=O)N2CC[NH+](C)CC2)ccc1N(C)C ZINC000879355375 706659067 /nfs/dbraw/zinc/65/90/67/706659067.db2.gz CVOTVDLESXLQBO-UHFFFAOYSA-N 2 2 318.465 1.267 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@H](C[NH3+])C(C)(C)C)cc2)CC1 ZINC000841088054 702341756 /nfs/dbraw/zinc/34/17/56/702341756.db2.gz VJWIEQIDIUKTQM-QGZVFWFLSA-N 3 2 304.482 1.901 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@H](CN)C(C)(C)C)cc2)CC1 ZINC000841088054 702341762 /nfs/dbraw/zinc/34/17/62/702341762.db2.gz VJWIEQIDIUKTQM-QGZVFWFLSA-N 2 2 304.482 1.901 20 10 DDCDLP C[C@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCC[NH2+]1 ZINC000817887796 702508839 /nfs/dbraw/zinc/50/88/39/702508839.db2.gz FCSOAEYBTXWHKF-XJKSGUPXSA-N 2 2 307.413 1.892 20 10 DDCDLP CN(C)c1ccc(C[NH2+][C@H](C2CC2)[C@H]2C[NH2+]CCO2)cc1F ZINC000817900593 702513721 /nfs/dbraw/zinc/51/37/21/702513721.db2.gz ODAPINLCNHCBEQ-IAGOWNOFSA-N 2 2 307.413 1.748 20 10 DDCDLP C[C@H](C[C@H]1COCC[NH2+]1)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000817900877 702513989 /nfs/dbraw/zinc/51/39/89/702513989.db2.gz QBBYRFYVQKMJGJ-PBHICJAKSA-N 2 2 303.450 1.926 20 10 DDCDLP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[NH2+]1 ZINC000863484588 705938748 /nfs/dbraw/zinc/93/87/48/705938748.db2.gz JWGULEOVNNNWQH-NVXWUHKLSA-N 3 2 302.466 1.669 20 10 DDCDLP C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)[C@@H]1C[N@H+](C)CCN1C ZINC001183930410 743929072 /nfs/dbraw/zinc/92/90/72/743929072.db2.gz RLHRDQIUACSZAA-PBHICJAKSA-N 2 2 303.450 1.736 20 10 DDCDLP C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)[C@@H]1C[N@@H+](C)CCN1C ZINC001183930410 743929073 /nfs/dbraw/zinc/92/90/73/743929073.db2.gz RLHRDQIUACSZAA-PBHICJAKSA-N 2 2 303.450 1.736 20 10 DDCDLP C[C@@H]1CC[N@H+](Cc2ccc(N3CCC(O)CC3)cc2)C[C@@H]1[NH3+] ZINC001205872865 871881239 /nfs/dbraw/zinc/88/12/39/871881239.db2.gz RENHSLJCWNLJDH-KDOFPFPSSA-N 2 2 303.450 1.817 20 10 DDCDLP C[C@@H]1CC[N@@H+](Cc2ccc(N3CCC(O)CC3)cc2)C[C@@H]1[NH3+] ZINC001205872865 871881253 /nfs/dbraw/zinc/88/12/53/871881253.db2.gz RENHSLJCWNLJDH-KDOFPFPSSA-N 2 2 303.450 1.817 20 10 DDCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@H](C)[C@@H](C)O)CC2)cc1 ZINC001345604843 873451840 /nfs/dbraw/zinc/45/18/40/873451840.db2.gz GHAPCYHXXLYPCF-HZPDHXFCSA-N 2 2 321.465 1.566 20 10 DDCDLP CC[N@@H+]1CCO[C@@H]2C[NH+](Cc3c(C)cc(OC)cc3O)C[C@@H]2C1 ZINC001236808803 889368882 /nfs/dbraw/zinc/36/88/82/889368882.db2.gz CDHXEGCIWOHLIW-KBXCAEBGSA-N 2 2 320.433 1.862 20 10 DDCDLP CC[N@H+]1CCO[C@@H]2C[NH+](Cc3c(C)cc(OC)cc3O)C[C@@H]2C1 ZINC001236808803 889368892 /nfs/dbraw/zinc/36/88/92/889368892.db2.gz CDHXEGCIWOHLIW-KBXCAEBGSA-N 2 2 320.433 1.862 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@H+](Cc3c(C)cc(OC)cc3O)C[C@@H]2C1 ZINC001236808803 889368903 /nfs/dbraw/zinc/36/89/03/889368903.db2.gz CDHXEGCIWOHLIW-KBXCAEBGSA-N 2 2 320.433 1.862 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@@H+](Cc3c(C)cc(OC)cc3O)C[C@@H]2C1 ZINC001236808803 889368913 /nfs/dbraw/zinc/36/89/13/889368913.db2.gz CDHXEGCIWOHLIW-KBXCAEBGSA-N 2 2 320.433 1.862 20 10 DDCDLP Cc1cc(C)c([C@H](C)[NH2+]CCC[N@@H+]2CCC[C@@H]2C(N)=O)c(O)c1 ZINC000284098333 131048703 /nfs/dbraw/zinc/04/87/03/131048703.db2.gz MRBBVRXYDWICCC-LSDHHAIUSA-N 2 2 319.449 1.999 20 10 DDCDLP Cc1cc(C)c([C@H](C)[NH2+]CCC[N@H+]2CCC[C@@H]2C(N)=O)c(O)c1 ZINC000284098333 131048705 /nfs/dbraw/zinc/04/87/05/131048705.db2.gz MRBBVRXYDWICCC-LSDHHAIUSA-N 2 2 319.449 1.999 20 10 DDCDLP CC[C@@H]([NH2+]CCC[N@@H+]1CCC[C@H]1C(N)=O)c1ccccc1O ZINC000274931872 280186995 /nfs/dbraw/zinc/18/69/95/280186995.db2.gz RBGRMQYXEJXTRI-CABCVRRESA-N 2 2 305.422 1.773 20 10 DDCDLP CC[C@@H]([NH2+]CCC[N@H+]1CCC[C@H]1C(N)=O)c1ccccc1O ZINC000274931872 280186996 /nfs/dbraw/zinc/18/69/96/280186996.db2.gz RBGRMQYXEJXTRI-CABCVRRESA-N 2 2 305.422 1.773 20 10 DDCDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@H](O)C[NH+]2CCCC2)c1 ZINC000273375922 536792907 /nfs/dbraw/zinc/79/29/07/536792907.db2.gz HFDWIBZIBJVTTE-JSGCOSHPSA-N 2 2 322.405 1.286 20 10 DDCDLP COc1c(O)c(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000775029050 697955886 /nfs/dbraw/zinc/95/58/86/697955886.db2.gz JIHLFTDLPWOSGS-PWSUYJOCSA-N 2 2 309.366 1.881 20 10 DDCDLP COc1c(O)c(C[NH2+][C@H]2CC[N@@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000775029050 697955890 /nfs/dbraw/zinc/95/58/90/697955890.db2.gz JIHLFTDLPWOSGS-PWSUYJOCSA-N 2 2 309.366 1.881 20 10 DDCDLP C[C@@H]1CC[N@H+](CC[NH2+]Cc2ccc(N3CCOCC3)cc2)C1 ZINC000744450209 699949570 /nfs/dbraw/zinc/94/95/70/699949570.db2.gz WMIAVWUEHNKETD-MRXNPFEDSA-N 2 2 303.450 1.955 20 10 DDCDLP C[C@@H]1CC[N@@H+](CC[NH2+]Cc2ccc(N3CCOCC3)cc2)C1 ZINC000744450209 699949572 /nfs/dbraw/zinc/94/95/72/699949572.db2.gz WMIAVWUEHNKETD-MRXNPFEDSA-N 2 2 303.450 1.955 20 10 DDCDLP CCOc1ccc(C[NH+]2CCN(c3[nH+]ccn3C)CC2)c(O)c1 ZINC000827892179 706082670 /nfs/dbraw/zinc/08/26/70/706082670.db2.gz SSZCTEKVZAOPAO-UHFFFAOYSA-N 2 2 316.405 1.847 20 10 DDCDLP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC[NH2+]1 ZINC001117953660 780960994 /nfs/dbraw/zinc/96/09/94/780960994.db2.gz KVLZFDVEZKIOOU-GDBMZVCRSA-N 3 2 320.456 1.808 20 10 DDCDLP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N3CCN(C)CC3)c(F)c2)CC[NH2+]1 ZINC001117953660 780960999 /nfs/dbraw/zinc/96/09/99/780960999.db2.gz KVLZFDVEZKIOOU-GDBMZVCRSA-N 2 2 320.456 1.808 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCO[C@@H](CO)C3)cc2)CC1 ZINC001140302009 860614701 /nfs/dbraw/zinc/61/47/01/860614701.db2.gz HFJHBGKTZCDZPL-GOSISDBHSA-N 2 2 319.449 1.022 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CCO[C@@H](CO)C3)cc2)CC1 ZINC001140302009 860614703 /nfs/dbraw/zinc/61/47/03/860614703.db2.gz HFJHBGKTZCDZPL-GOSISDBHSA-N 2 2 319.449 1.022 20 10 DDCDLP CCOC(=O)[C@]12C[N@H+](Cc3cccc(F)c3O)C[C@H]1C[NH2+]CC2 ZINC001236038443 889075289 /nfs/dbraw/zinc/07/52/89/889075289.db2.gz JFTPMTPLSYHNBS-CXAGYDPISA-N 2 2 322.380 1.506 20 10 DDCDLP CCOC(=O)[C@]12C[N@@H+](Cc3cccc(F)c3O)C[C@H]1C[NH2+]CC2 ZINC001236038443 889075302 /nfs/dbraw/zinc/07/53/02/889075302.db2.gz JFTPMTPLSYHNBS-CXAGYDPISA-N 2 2 322.380 1.506 20 10 DDCDLP CCOc1cccc(C[N@@H+]2CC[C@@H](C[NH+]3CCOCC3)C2)c1O ZINC000093664465 407200350 /nfs/dbraw/zinc/20/03/50/407200350.db2.gz PZRZIWJLQZOQFZ-HNNXBMFYSA-N 2 2 320.433 1.945 20 10 DDCDLP CCOc1cccc(C[N@H+]2CC[C@@H](C[NH+]3CCOCC3)C2)c1O ZINC000093664465 407200354 /nfs/dbraw/zinc/20/03/54/407200354.db2.gz PZRZIWJLQZOQFZ-HNNXBMFYSA-N 2 2 320.433 1.945 20 10 DDCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cccc(C(N)=O)c2)cc1 ZINC000841042848 702320599 /nfs/dbraw/zinc/32/05/99/702320599.db2.gz LUKHKHJZKBWYKN-QGZVFWFLSA-N 2 2 312.417 1.641 20 10 DDCDLP CN(C)c1ccc(CN(C)C(=O)C[NH2+]CC2([NH3+])CCC2)cc1 ZINC000844222523 702996104 /nfs/dbraw/zinc/99/61/04/702996104.db2.gz FDXZQWPCKWOESI-UHFFFAOYSA-N 2 2 304.438 1.182 20 10 DDCDLP C[NH+]1CCC2(CC1)C[N@H+](Cc1cc(F)cc(F)c1O)CCO2 ZINC000895085381 711402605 /nfs/dbraw/zinc/40/26/05/711402605.db2.gz MRTAJOXUQISBNA-UHFFFAOYSA-N 2 2 312.360 1.967 20 10 DDCDLP C[NH+]1CCC2(CC1)C[N@@H+](Cc1cc(F)cc(F)c1O)CCO2 ZINC000895085381 711402607 /nfs/dbraw/zinc/40/26/07/711402607.db2.gz MRTAJOXUQISBNA-UHFFFAOYSA-N 2 2 312.360 1.967 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3C[NH2+]CC3(C)C)cc2)CC1 ZINC000904461588 711860751 /nfs/dbraw/zinc/86/07/51/711860751.db2.gz JWEKUJLJTOKVMZ-QGZVFWFLSA-N 3 2 302.466 1.526 20 10 DDCDLP O[C@@H](C[NH2+]Cc1ccc2c(c1)CCCO2)C[NH+]1CCCCC1 ZINC000921587494 713814680 /nfs/dbraw/zinc/81/46/80/713814680.db2.gz QMRRGXVQNRXEGK-KRWDZBQOSA-N 2 2 304.434 1.948 20 10 DDCDLP CCOc1cccc(C[NH+]2CC(N3CC[NH+](C)CC3)C2)c1O ZINC001203615700 744209408 /nfs/dbraw/zinc/20/94/08/744209408.db2.gz XLALOIANBDSTRI-UHFFFAOYSA-N 2 2 305.422 1.223 20 10 DDCDLP COc1ccc(C[NH2+]CCCNC(=O)Cn2cc[nH+]c2)cc1C ZINC001177404470 778581741 /nfs/dbraw/zinc/58/17/41/778581741.db2.gz AQSOAACZGQUNGQ-UHFFFAOYSA-N 2 2 316.405 1.496 20 10 DDCDLP CC(=O)[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CCO1 ZINC001139411363 860391414 /nfs/dbraw/zinc/39/14/14/860391414.db2.gz HVHKLSXIMMYHKK-GOSISDBHSA-N 2 2 317.433 1.228 20 10 DDCDLP CC(=O)[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CCO1 ZINC001139411363 860391419 /nfs/dbraw/zinc/39/14/19/860391419.db2.gz HVHKLSXIMMYHKK-GOSISDBHSA-N 2 2 317.433 1.228 20 10 DDCDLP Nc1ccc(C[NH+]2CCC(c3nnc4n3CC[NH2+]C4)CC2)cc1 ZINC001334775318 867824982 /nfs/dbraw/zinc/82/49/82/867824982.db2.gz VSYRGDPXWHBFJM-UHFFFAOYSA-N 2 2 312.421 1.343 20 10 DDCDLP Oc1cc(O)c(C[N@@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)cc1O ZINC001233486625 887021922 /nfs/dbraw/zinc/02/19/22/887021922.db2.gz VHEMSVICUUCCHG-ZDUSSCGKSA-N 2 2 302.330 1.852 20 10 DDCDLP Oc1cc(O)c(C[N@H+]2CC[C@H](Oc3cc[nH+]cc3)C2)cc1O ZINC001233486625 887021933 /nfs/dbraw/zinc/02/19/33/887021933.db2.gz VHEMSVICUUCCHG-ZDUSSCGKSA-N 2 2 302.330 1.852 20 10 DDCDLP COC(=O)Cc1ccc(C[N@@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)c(O)c1 ZINC001249215056 893871540 /nfs/dbraw/zinc/87/15/40/893871540.db2.gz VJEVVSMTDNIFPA-CRAIPNDOSA-N 2 2 318.417 1.491 20 10 DDCDLP COC(=O)Cc1ccc(C[N@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)c(O)c1 ZINC001249215056 893871552 /nfs/dbraw/zinc/87/15/52/893871552.db2.gz VJEVVSMTDNIFPA-CRAIPNDOSA-N 2 2 318.417 1.491 20 10 DDCDLP C[C@H](C[C@@H]1COCC[NH2+]1)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000817900878 702513779 /nfs/dbraw/zinc/51/37/79/702513779.db2.gz QBBYRFYVQKMJGJ-RHSMWYFYSA-N 2 2 303.450 1.926 20 10 DDCDLP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1CC(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000846708872 703322092 /nfs/dbraw/zinc/32/20/92/703322092.db2.gz XAIFGJBMRFOYKO-GDBMZVCRSA-N 2 2 318.465 1.523 20 10 DDCDLP C[C@@H]1C[C@H]([NH3+])CC[N@H+]1CC(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000846708872 703322096 /nfs/dbraw/zinc/32/20/96/703322096.db2.gz XAIFGJBMRFOYKO-GDBMZVCRSA-N 2 2 318.465 1.523 20 10 DDCDLP CN(C)c1ccc(C[NH2+]C[C@@H]2C[N@@H+]3CCC[C@@H]3CO2)cc1F ZINC001200269516 748182656 /nfs/dbraw/zinc/18/26/56/748182656.db2.gz XHNVAXLKNOQTFN-HUUCEWRRSA-N 2 2 307.413 1.845 20 10 DDCDLP CN(C)c1ccc(C[NH2+]C[C@@H]2C[N@H+]3CCC[C@@H]3CO2)cc1F ZINC001200269516 748182662 /nfs/dbraw/zinc/18/26/62/748182662.db2.gz XHNVAXLKNOQTFN-HUUCEWRRSA-N 2 2 307.413 1.845 20 10 DDCDLP C[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC[C@H]1[NH3+] ZINC001118241807 781072761 /nfs/dbraw/zinc/07/27/61/781072761.db2.gz OKXWSDSKJYDIQH-WMLDXEAASA-N 3 2 320.456 1.747 20 10 DDCDLP C[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC[C@H]1[NH3+] ZINC001118241807 781072767 /nfs/dbraw/zinc/07/27/67/781072767.db2.gz OKXWSDSKJYDIQH-WMLDXEAASA-N 3 2 320.456 1.747 20 10 DDCDLP C[C@H]1CN(Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC[C@H]1[NH3+] ZINC001118241807 781072773 /nfs/dbraw/zinc/07/27/73/781072773.db2.gz OKXWSDSKJYDIQH-WMLDXEAASA-N 2 2 320.456 1.747 20 10 DDCDLP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC(=O)N1C ZINC001327067632 861849323 /nfs/dbraw/zinc/84/93/23/861849323.db2.gz LDNUGHNRXRJKIX-OAHLLOKOSA-N 2 2 316.449 1.101 20 10 DDCDLP C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC(=O)N1C ZINC001327067632 861849336 /nfs/dbraw/zinc/84/93/36/861849336.db2.gz LDNUGHNRXRJKIX-OAHLLOKOSA-N 2 2 316.449 1.101 20 10 DDCDLP Oc1ccccc1C[N@H+]1C[C@H]2CC[C@@H](C1)N2CCn1cc[nH+]c1 ZINC001275267108 852940517 /nfs/dbraw/zinc/94/05/17/852940517.db2.gz KDWCCETURKDIBZ-CALCHBBNSA-N 2 2 312.417 1.938 20 10 DDCDLP Oc1ccccc1C[N@@H+]1C[C@H]2CC[C@@H](C1)N2CCn1cc[nH+]c1 ZINC001275267108 852940519 /nfs/dbraw/zinc/94/05/19/852940519.db2.gz KDWCCETURKDIBZ-CALCHBBNSA-N 2 2 312.417 1.938 20 10 DDCDLP C[C@H]([NH3+])C[N@@H+](C)Cc1cccc(I)c1O ZINC001236908526 889416005 /nfs/dbraw/zinc/41/60/05/889416005.db2.gz JRQUKXHCFVWSSK-QMMMGPOBSA-N 2 2 320.174 1.776 20 10 DDCDLP C[C@H]([NH3+])C[N@H+](C)Cc1cccc(I)c1O ZINC001236908526 889415998 /nfs/dbraw/zinc/41/59/98/889415998.db2.gz JRQUKXHCFVWSSK-QMMMGPOBSA-N 2 2 320.174 1.776 20 10 DDCDLP C[C@H]([NH2+]C[C@@H](O)C[NH+]1CCCC1)c1ccc(F)c(F)c1O ZINC000276904189 408902603 /nfs/dbraw/zinc/90/26/03/408902603.db2.gz JNCXISHTAUQGDX-WDEREUQCSA-N 2 2 300.349 1.778 20 10 DDCDLP C[C@@H]1CC[NH2+]C[C@@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000817894521 702511653 /nfs/dbraw/zinc/51/16/53/702511653.db2.gz LUHYDFVEVRMUHM-DYVFJYSZSA-N 2 2 321.440 1.874 20 10 DDCDLP C[C@H]([NH2+]C[C@H]1C[NH2+]CCO1)c1cc(Br)ccc1O ZINC000817982811 702542518 /nfs/dbraw/zinc/54/25/18/702542518.db2.gz HVGLAHRHUUSVPC-GXSJLCMTSA-N 2 2 315.211 1.794 20 10 DDCDLP C[C@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCOCC3)c(F)c2)C[NH2+]1 ZINC000863485149 705938957 /nfs/dbraw/zinc/93/89/57/705938957.db2.gz VMEQCBHVTKRZCU-DZGCQCFKSA-N 2 2 307.413 1.892 20 10 DDCDLP COc1cc(C)cc(C[NH2+]C[C@H]2C[N@@H+]3CCC[C@H]3CO2)c1O ZINC000894242719 711031873 /nfs/dbraw/zinc/03/18/73/711031873.db2.gz URFXJSMTBMDFEB-GJZGRUSLSA-N 2 2 306.406 1.662 20 10 DDCDLP COc1cc(C)cc(C[NH2+]C[C@H]2C[N@H+]3CCC[C@H]3CO2)c1O ZINC000894242719 711031877 /nfs/dbraw/zinc/03/18/77/711031877.db2.gz URFXJSMTBMDFEB-GJZGRUSLSA-N 2 2 306.406 1.662 20 10 DDCDLP c1cc2c(cc1C[NH2+]C[C@H]1C[N@@H+]3CCC[C@@H]3CO1)CCCO2 ZINC000921689487 713844049 /nfs/dbraw/zinc/84/40/49/713844049.db2.gz DUBJHUDOZMVYCG-SJORKVTESA-N 2 2 302.418 1.964 20 10 DDCDLP c1cc2c(cc1C[NH2+]C[C@H]1C[N@H+]3CCC[C@@H]3CO1)CCCO2 ZINC000921689487 713844052 /nfs/dbraw/zinc/84/40/52/713844052.db2.gz DUBJHUDOZMVYCG-SJORKVTESA-N 2 2 302.418 1.964 20 10 DDCDLP [NH3+]C[C@@]1(O)CCC[N@H+](Cc2cc(F)cc(Cl)c2O)CC1 ZINC001205248958 751349578 /nfs/dbraw/zinc/34/95/78/751349578.db2.gz UTGWIGJCKTWSFW-CQSZACIVSA-N 2 2 302.777 1.860 20 10 DDCDLP [NH3+]C[C@@]1(O)CCC[N@@H+](Cc2cc(F)cc(Cl)c2O)CC1 ZINC001205248958 751349585 /nfs/dbraw/zinc/34/95/85/751349585.db2.gz UTGWIGJCKTWSFW-CQSZACIVSA-N 2 2 302.777 1.860 20 10 DDCDLP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@@]2(CCC[NH2+]2)C1 ZINC001222470253 880490234 /nfs/dbraw/zinc/49/02/34/880490234.db2.gz CDLFWYFSFWDMGP-SFHVURJKSA-N 3 2 316.449 1.130 20 10 DDCDLP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CC[C@@]2(CCC[NH2+]2)C1 ZINC001222470253 880490239 /nfs/dbraw/zinc/49/02/39/880490239.db2.gz CDLFWYFSFWDMGP-SFHVURJKSA-N 3 2 316.449 1.130 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001235118601 888419017 /nfs/dbraw/zinc/41/90/17/888419017.db2.gz FYKYBRYJVDKFKQ-LJQANCHMSA-N 3 2 314.477 1.814 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCCC[C@]12CC[NH2+]C2 ZINC001235118601 888419021 /nfs/dbraw/zinc/41/90/21/888419021.db2.gz FYKYBRYJVDKFKQ-LJQANCHMSA-N 3 2 314.477 1.814 20 10 DDCDLP CC[N@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)[C@@H]1CCC[NH2+]C1 ZINC001236007431 889059217 /nfs/dbraw/zinc/05/92/17/889059217.db2.gz MKSCCRFEMIXQMG-GOSISDBHSA-N 3 2 302.466 1.670 20 10 DDCDLP CC[N@@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)[C@@H]1CCC[NH2+]C1 ZINC001236007431 889059223 /nfs/dbraw/zinc/05/92/23/889059223.db2.gz MKSCCRFEMIXQMG-GOSISDBHSA-N 3 2 302.466 1.670 20 10 DDCDLP CCOC(=O)CCCOc1ccc(C[N@H+](C)C[C@H](C)[NH3+])c(O)c1 ZINC001236912483 889415440 /nfs/dbraw/zinc/41/54/40/889415440.db2.gz QXMYGZXPYARRGX-ZDUSSCGKSA-N 2 2 324.421 1.893 20 10 DDCDLP CCOC(=O)CCCOc1ccc(C[N@@H+](C)C[C@H](C)[NH3+])c(O)c1 ZINC001236912483 889415446 /nfs/dbraw/zinc/41/54/46/889415446.db2.gz QXMYGZXPYARRGX-ZDUSSCGKSA-N 2 2 324.421 1.893 20 10 DDCDLP COc1cc(O)c(C[N@@H+]2CC[C@@H]3CC[NH+](C)C[C@@H]32)cc1OC ZINC000272352012 407881425 /nfs/dbraw/zinc/88/14/25/407881425.db2.gz YGHRAFLEJFFERA-JSGCOSHPSA-N 2 2 306.406 1.935 20 10 DDCDLP COc1cc(O)c(C[N@H+]2CC[C@@H]3CC[NH+](C)C[C@@H]32)cc1OC ZINC000272352012 407881432 /nfs/dbraw/zinc/88/14/32/407881432.db2.gz YGHRAFLEJFFERA-JSGCOSHPSA-N 2 2 306.406 1.935 20 10 DDCDLP COc1cc(O)c(C[NH+]2CC[C@@H]3CC[N@H+](C)C[C@@H]32)cc1OC ZINC000272352012 407881437 /nfs/dbraw/zinc/88/14/37/407881437.db2.gz YGHRAFLEJFFERA-JSGCOSHPSA-N 2 2 306.406 1.935 20 10 DDCDLP COc1cc(O)c(C[NH+]2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)cc1OC ZINC000272352012 407881441 /nfs/dbraw/zinc/88/14/41/407881441.db2.gz YGHRAFLEJFFERA-JSGCOSHPSA-N 2 2 306.406 1.935 20 10 DDCDLP Fc1cc(C[NH2+][C@@H]2CCCC[NH2+]C2)ccc1N1CCOCC1 ZINC000841091413 702342205 /nfs/dbraw/zinc/34/22/05/702342205.db2.gz XLKNHJBOYOXSKI-OAHLLOKOSA-N 2 2 307.413 1.894 20 10 DDCDLP Cc1cc(Br)c(O)c(C[N@H+](C)C[C@@H](O)C[NH3+])c1 ZINC000841094382 702343976 /nfs/dbraw/zinc/34/39/76/702343976.db2.gz XIQNDCNJNBVZAB-JTQLQIEISA-N 2 2 303.200 1.215 20 10 DDCDLP Cc1cc(Br)c(O)c(C[N@@H+](C)C[C@@H](O)C[NH3+])c1 ZINC000841094382 702343984 /nfs/dbraw/zinc/34/39/84/702343984.db2.gz XIQNDCNJNBVZAB-JTQLQIEISA-N 2 2 303.200 1.215 20 10 DDCDLP O=C1C[NH2+]CCN1[C@@H]1CCC[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000843065408 702811917 /nfs/dbraw/zinc/81/19/17/702811917.db2.gz LZKBSRNDZKUYRH-GFCCVEGCSA-N 2 2 323.824 1.442 20 10 DDCDLP O=C1C[NH2+]CCN1[C@@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000843065408 702811920 /nfs/dbraw/zinc/81/19/20/702811920.db2.gz LZKBSRNDZKUYRH-GFCCVEGCSA-N 2 2 323.824 1.442 20 10 DDCDLP C[C@@H]1CC[NH2+][C@H](C)[C@@H]1[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000923369876 714330512 /nfs/dbraw/zinc/33/05/12/714330512.db2.gz MZPDMLNBKQARNG-IIDMSEBBSA-N 2 2 303.450 1.999 20 10 DDCDLP CC[N@H+](CC(=O)OC)Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140309704 733517743 /nfs/dbraw/zinc/51/77/43/733517743.db2.gz RIXVKZNWJYZMTR-UHFFFAOYSA-N 2 2 319.449 1.823 20 10 DDCDLP CC[N@@H+](CC(=O)OC)Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140309704 733517744 /nfs/dbraw/zinc/51/77/44/733517744.db2.gz RIXVKZNWJYZMTR-UHFFFAOYSA-N 2 2 319.449 1.823 20 10 DDCDLP Cc1cc(C)c(CNC(=O)c2ccc([C@H]([NH3+])C[NH3+])cc2)c(O)c1 ZINC001220825804 879290955 /nfs/dbraw/zinc/29/09/55/879290955.db2.gz RVRKAKBBLJMNTG-MRXNPFEDSA-N 2 2 313.401 1.898 20 10 DDCDLP Oc1cc2c(cc1C[N@@H+]1CCCC3(C[NH2+]C3)C1)C[NH2+]CCO2 ZINC001235713579 888905767 /nfs/dbraw/zinc/90/57/67/888905767.db2.gz MIHIMIJGDOYOMO-UHFFFAOYSA-N 3 2 303.406 1.060 20 10 DDCDLP Oc1cc2c(cc1C[N@H+]1CCCC3(C[NH2+]C3)C1)C[NH2+]CCO2 ZINC001235713579 888905774 /nfs/dbraw/zinc/90/57/74/888905774.db2.gz MIHIMIJGDOYOMO-UHFFFAOYSA-N 3 2 303.406 1.060 20 10 DDCDLP CCOC(=O)[C@]12C[N@H+](Cc3c(O)cccc3F)C[C@H]1C[NH2+]CC2 ZINC001236038876 889072441 /nfs/dbraw/zinc/07/24/41/889072441.db2.gz PNKMTARKOMIXHG-SJKOYZFVSA-N 2 2 322.380 1.506 20 10 DDCDLP CCOC(=O)[C@]12C[N@@H+](Cc3c(O)cccc3F)C[C@H]1C[NH2+]CC2 ZINC001236038876 889072457 /nfs/dbraw/zinc/07/24/57/889072457.db2.gz PNKMTARKOMIXHG-SJKOYZFVSA-N 2 2 322.380 1.506 20 10 DDCDLP COC(=O)Cc1ccc(C[N@H+]2C[C@H]3[C@H](C2)CCC[NH+]3C)c(O)c1 ZINC001249214638 893873222 /nfs/dbraw/zinc/87/32/22/893873222.db2.gz OQHGSYAVXIIJHC-HOCLYGCPSA-N 2 2 318.417 1.634 20 10 DDCDLP COC(=O)Cc1ccc(C[N@@H+]2C[C@H]3[C@H](C2)CCC[NH+]3C)c(O)c1 ZINC001249214638 893873231 /nfs/dbraw/zinc/87/32/31/893873231.db2.gz OQHGSYAVXIIJHC-HOCLYGCPSA-N 2 2 318.417 1.634 20 10 DDCDLP COC(=O)Cc1ccc(C[NH+]2C[C@H]3[C@H](C2)CCC[N@@H+]3C)c(O)c1 ZINC001249214638 893873242 /nfs/dbraw/zinc/87/32/42/893873242.db2.gz OQHGSYAVXIIJHC-HOCLYGCPSA-N 2 2 318.417 1.634 20 10 DDCDLP COC(=O)Cc1ccc(C[NH+]2C[C@H]3[C@H](C2)CCC[N@H+]3C)c(O)c1 ZINC001249214638 893873251 /nfs/dbraw/zinc/87/32/51/893873251.db2.gz OQHGSYAVXIIJHC-HOCLYGCPSA-N 2 2 318.417 1.634 20 10 DDCDLP CCCN(c1ccc(C[NH3+])cc1)C1CC[NH+](CC(=O)OC)CC1 ZINC000194977041 408807062 /nfs/dbraw/zinc/80/70/62/408807062.db2.gz NCEFPNZTUZZNPB-UHFFFAOYSA-N 2 2 319.449 1.999 20 10 DDCDLP C[C@@H]1C[N@H+](Cc2cc(F)ccc2O)CC[C@H]1N1CC[NH+](C)CC1 ZINC000368605837 418723183 /nfs/dbraw/zinc/72/31/83/418723183.db2.gz ZFKJRVBKCRHHDP-RHSMWYFYSA-N 2 2 321.440 1.989 20 10 DDCDLP C[C@@H]1C[N@@H+](Cc2cc(F)ccc2O)CC[C@H]1N1CC[NH+](C)CC1 ZINC000368605837 418723186 /nfs/dbraw/zinc/72/31/86/418723186.db2.gz ZFKJRVBKCRHHDP-RHSMWYFYSA-N 2 2 321.440 1.989 20 10 DDCDLP C[C@@H]1[NH2+]CCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000841063865 702332869 /nfs/dbraw/zinc/33/28/69/702332869.db2.gz RKOQQKLGFUXLNR-MAUKXSAKSA-N 3 2 302.466 1.669 20 10 DDCDLP COc1ccc(N2CCC([NH2+][C@@H]3C[NH2+]CCOC3)CC2)cc1 ZINC000925564674 714888804 /nfs/dbraw/zinc/88/88/04/714888804.db2.gz KCEXBUVCOQNGLV-OAHLLOKOSA-N 2 2 305.422 1.242 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@](C)([NH3+])C3)cc2)CC1 ZINC001204783022 741079042 /nfs/dbraw/zinc/07/90/42/741079042.db2.gz NLFDKUZVMBHYFW-SFHVURJKSA-N 3 2 302.466 1.752 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@](C)([NH3+])C3)cc2)CC1 ZINC001204783022 741079049 /nfs/dbraw/zinc/07/90/49/741079049.db2.gz NLFDKUZVMBHYFW-SFHVURJKSA-N 3 2 302.466 1.752 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+]Cc3cc[nH]n3)cc2F)CC1 ZINC001199119149 747719237 /nfs/dbraw/zinc/71/92/37/747719237.db2.gz ZWCHWFUHIGESAY-UHFFFAOYSA-N 2 2 303.385 1.590 20 10 DDCDLP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC[NH+](C)CC1 ZINC001139404324 860388038 /nfs/dbraw/zinc/38/80/38/860388038.db2.gz AHRSYAVOPFTKAC-UHFFFAOYSA-N 3 2 316.493 1.964 20 10 DDCDLP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1)C1CC[NH+](C)CC1 ZINC001139404324 860388045 /nfs/dbraw/zinc/38/80/45/860388045.db2.gz AHRSYAVOPFTKAC-UHFFFAOYSA-N 3 2 316.493 1.964 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+]CCC[NH2+]C3CC3)cc2F)CC1 ZINC001325321280 867943293 /nfs/dbraw/zinc/94/32/93/867943293.db2.gz UBLMJVLDTHXRSO-UHFFFAOYSA-N 3 2 320.456 1.809 20 10 DDCDLP CN1CCN(c2ccc(C[NH2+]CCC[NH2+]C3CC3)cc2F)CC1 ZINC001325321280 867943300 /nfs/dbraw/zinc/94/33/00/867943300.db2.gz UBLMJVLDTHXRSO-UHFFFAOYSA-N 2 2 320.456 1.809 20 10 DDCDLP C[C@H]1CC[C@H](C[NH3+])[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2O)C1 ZINC001205844832 871859342 /nfs/dbraw/zinc/85/93/42/871859342.db2.gz YMORCAPIGVAPLJ-WMLDXEAASA-N 3 2 318.465 1.361 20 10 DDCDLP C[C@H]1CC[C@H](C[NH3+])[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2O)C1 ZINC001205844832 871859364 /nfs/dbraw/zinc/85/93/64/871859364.db2.gz YMORCAPIGVAPLJ-WMLDXEAASA-N 2 2 318.465 1.361 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H]4CC[C@@]4([NH3+])C3)cc2)CC1 ZINC001235997169 889054011 /nfs/dbraw/zinc/05/40/11/889054011.db2.gz VAIOJROSNTVAAE-PKOBYXMFSA-N 3 2 314.477 1.752 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H]4CC[C@@]4([NH3+])C3)cc2)CC1 ZINC001235997169 889054028 /nfs/dbraw/zinc/05/40/28/889054028.db2.gz VAIOJROSNTVAAE-PKOBYXMFSA-N 3 2 314.477 1.752 20 10 DDCDLP Cc1ccc(C)n1-c1ccc(-c2noc(C[C@@H]([NH3+])C[NH3+])n2)cc1 ZINC001249130194 893838347 /nfs/dbraw/zinc/83/83/47/893838347.db2.gz XETLOYCWKLYIAG-CQSZACIVSA-N 2 2 311.389 1.973 20 10 DDCDLP C[N@@H+]1CC[C@@](O)(C[NH2+]Cc2cccc(Br)c2O)C1 ZINC000702627328 699231021 /nfs/dbraw/zinc/23/10/21/699231021.db2.gz YFBNRVBCXPYDHB-CYBMUJFWSA-N 2 2 315.211 1.311 20 10 DDCDLP C[N@H+]1CC[C@@](O)(C[NH2+]Cc2cccc(Br)c2O)C1 ZINC000702627328 699231024 /nfs/dbraw/zinc/23/10/24/699231024.db2.gz YFBNRVBCXPYDHB-CYBMUJFWSA-N 2 2 315.211 1.311 20 10 DDCDLP CC[C@@H]([NH2+]CC(=O)N1CC[NH2+]CC1)c1cccc(Cl)c1O ZINC000817945517 702532745 /nfs/dbraw/zinc/53/27/45/702532745.db2.gz FKIWSYIHXFTKMV-CYBMUJFWSA-N 2 2 311.813 1.518 20 10 DDCDLP C[C@@H]([NH2+]C[C@H]1C[NH2+]CCO1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817983296 702543474 /nfs/dbraw/zinc/54/34/74/702543474.db2.gz MCZHQXXCILJZIM-UKRRQHHQSA-N 2 2 323.412 1.301 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCC[C@H]3[NH3+])cc2)CC1 ZINC000818431639 702647824 /nfs/dbraw/zinc/64/78/24/702647824.db2.gz QGXYUINLLHOFOF-QZTJIDSGSA-N 3 2 302.466 1.798 20 10 DDCDLP C[C@@H]1C[NH2+]C[C@@H]([NH2+]Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000843126803 702825605 /nfs/dbraw/zinc/82/56/05/702825605.db2.gz WMPNZQXNKQLUBE-ZFWWWQNUSA-N 2 2 307.413 1.750 20 10 DDCDLP Cc1nnc([C@@H](C)[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)[nH]1 ZINC000894773662 711266524 /nfs/dbraw/zinc/26/65/24/711266524.db2.gz ZSJBBFSEKSXCLY-CYBMUJFWSA-N 2 2 314.437 1.716 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@](C)(C[NH3+])C3)cc2F)CC1 ZINC001326520178 861422162 /nfs/dbraw/zinc/42/21/62/861422162.db2.gz XZZZEYWOHYOETF-SFHVURJKSA-N 3 2 320.456 1.748 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@](C)(C[NH3+])C3)cc2F)CC1 ZINC001326520178 861422166 /nfs/dbraw/zinc/42/21/66/861422166.db2.gz XZZZEYWOHYOETF-SFHVURJKSA-N 3 2 320.456 1.748 20 10 DDCDLP CN1CCN(c2ccc(C[N@@H+]3CC[C@@](C)(C[NH3+])C3)cc2F)CC1 ZINC001326520178 861422171 /nfs/dbraw/zinc/42/21/71/861422171.db2.gz XZZZEYWOHYOETF-SFHVURJKSA-N 2 2 320.456 1.748 20 10 DDCDLP CN1CCN(c2ccc(C[N@H+]3CC[C@@](C)(C[NH3+])C3)cc2F)CC1 ZINC001326520178 861422178 /nfs/dbraw/zinc/42/21/78/861422178.db2.gz XZZZEYWOHYOETF-SFHVURJKSA-N 2 2 320.456 1.748 20 10 DDCDLP COc1cc(C[N@H+](C2CC2)C2COC2)cc(C[NH+](C)C)c1O ZINC001139257455 860339192 /nfs/dbraw/zinc/33/91/92/860339192.db2.gz BQKSATMJHCOYNC-UHFFFAOYSA-N 2 2 306.406 1.826 20 10 DDCDLP COc1cc(C[N@@H+](C2CC2)C2COC2)cc(C[NH+](C)C)c1O ZINC001139257455 860339197 /nfs/dbraw/zinc/33/91/97/860339197.db2.gz BQKSATMJHCOYNC-UHFFFAOYSA-N 2 2 306.406 1.826 20 10 DDCDLP C[N@H+]1C[C@@H]2C[NH+](Cc3ccc(N4CCOCC4)cc3F)C[C@@H]2C1 ZINC001140664071 860670960 /nfs/dbraw/zinc/67/09/60/860670960.db2.gz XKSDRXBFMRZJRH-IYBDPMFKSA-N 2 2 319.424 1.656 20 10 DDCDLP C[N@@H+]1C[C@@H]2C[NH+](Cc3ccc(N4CCOCC4)cc3F)C[C@@H]2C1 ZINC001140664071 860670963 /nfs/dbraw/zinc/67/09/63/860670963.db2.gz XKSDRXBFMRZJRH-IYBDPMFKSA-N 2 2 319.424 1.656 20 10 DDCDLP C[NH+]1C[C@@H]2C[N@@H+](Cc3ccc(N4CCOCC4)cc3F)C[C@@H]2C1 ZINC001140664071 860670966 /nfs/dbraw/zinc/67/09/66/860670966.db2.gz XKSDRXBFMRZJRH-IYBDPMFKSA-N 2 2 319.424 1.656 20 10 DDCDLP C[NH+]1C[C@@H]2C[N@H+](Cc3ccc(N4CCOCC4)cc3F)C[C@@H]2C1 ZINC001140664071 860670969 /nfs/dbraw/zinc/67/09/69/860670969.db2.gz XKSDRXBFMRZJRH-IYBDPMFKSA-N 2 2 319.424 1.656 20 10 DDCDLP COC(=O)CC[N@H+](CCC[NH+](C)C)Cc1ccc(O)c(O)c1 ZINC001203878177 870813462 /nfs/dbraw/zinc/81/34/62/870813462.db2.gz CIVLNLRJOUZQLV-UHFFFAOYSA-N 2 2 310.394 1.415 20 10 DDCDLP COC(=O)CC[N@@H+](CCC[NH+](C)C)Cc1ccc(O)c(O)c1 ZINC001203878177 870813478 /nfs/dbraw/zinc/81/34/78/870813478.db2.gz CIVLNLRJOUZQLV-UHFFFAOYSA-N 2 2 310.394 1.415 20 10 DDCDLP C[NH+](C)CCN1CC2(C1)C[NH+](Cc1c(O)ccc(F)c1F)C2 ZINC001276471119 871133140 /nfs/dbraw/zinc/13/31/40/871133140.db2.gz ATHFIFSSPMSRMS-UHFFFAOYSA-N 2 2 311.376 1.350 20 10 DDCDLP Oc1cc(O)c(CN2CC[NH2+][C@H]3CC[NH2+]CC[C@@H]32)cc1Cl ZINC001222507322 880523132 /nfs/dbraw/zinc/52/31/32/880523132.db2.gz RRRIGNRQJVTRRD-STQMWFEESA-N 2 2 311.813 1.277 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCOC4(CC4)C3)c(F)c2)CC1 ZINC001236947311 889437635 /nfs/dbraw/zinc/43/76/35/889437635.db2.gz QGGWNPOOYNMPCQ-UHFFFAOYSA-N 2 2 319.424 1.942 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCOC4(CC4)C3)c(F)c2)CC1 ZINC001236947311 889437630 /nfs/dbraw/zinc/43/76/30/889437630.db2.gz QGGWNPOOYNMPCQ-UHFFFAOYSA-N 2 2 319.424 1.942 20 10 DDCDLP CCOc1ccc(C[N@@H+]2C[C@@H]3C[NH+](CC)CCO[C@@H]3C2)c(O)c1 ZINC001237040599 889477386 /nfs/dbraw/zinc/47/73/86/889477386.db2.gz IILZYGLJQSPZQY-MAUKXSAKSA-N 2 2 320.433 1.943 20 10 DDCDLP CCOc1ccc(C[N@H+]2C[C@@H]3C[NH+](CC)CCO[C@@H]3C2)c(O)c1 ZINC001237040599 889477395 /nfs/dbraw/zinc/47/73/95/889477395.db2.gz IILZYGLJQSPZQY-MAUKXSAKSA-N 2 2 320.433 1.943 20 10 DDCDLP CCOc1ccc(C[NH+]2C[C@@H]3C[N@H+](CC)CCO[C@@H]3C2)c(O)c1 ZINC001237040599 889477401 /nfs/dbraw/zinc/47/74/01/889477401.db2.gz IILZYGLJQSPZQY-MAUKXSAKSA-N 2 2 320.433 1.943 20 10 DDCDLP CCOc1ccc(C[NH+]2C[C@@H]3C[N@@H+](CC)CCO[C@@H]3C2)c(O)c1 ZINC001237040599 889477410 /nfs/dbraw/zinc/47/74/10/889477410.db2.gz IILZYGLJQSPZQY-MAUKXSAKSA-N 2 2 320.433 1.943 20 10 DDCDLP COc1ccc([NH+]2CCC(N(C)C(=O)[C@@H](C)C[NH3+])CC2)cc1 ZINC000375962636 418690620 /nfs/dbraw/zinc/69/06/20/418690620.db2.gz HINWAPSPPRYBBS-ZDUSSCGKSA-N 2 2 305.422 1.717 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4c[nH]nc4C3)cc2)CC1 ZINC000775714599 698025143 /nfs/dbraw/zinc/02/51/43/698025143.db2.gz UNEPTYGGUITWJN-UHFFFAOYSA-N 2 2 311.433 1.720 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4c[nH]nc4C3)cc2)CC1 ZINC000775714599 698025148 /nfs/dbraw/zinc/02/51/48/698025148.db2.gz UNEPTYGGUITWJN-UHFFFAOYSA-N 2 2 311.433 1.720 20 10 DDCDLP COc1cccc(O)c1C[NH2+]CCC[N@@H+]1CCCO[C@H](C)C1 ZINC000762484816 700894054 /nfs/dbraw/zinc/89/40/54/700894054.db2.gz WJGKDVDMGLRJGQ-CQSZACIVSA-N 2 2 308.422 1.991 20 10 DDCDLP COc1cccc(O)c1C[NH2+]CCC[N@H+]1CCCO[C@H](C)C1 ZINC000762484816 700894055 /nfs/dbraw/zinc/89/40/55/700894055.db2.gz WJGKDVDMGLRJGQ-CQSZACIVSA-N 2 2 308.422 1.991 20 10 DDCDLP Fc1cc(C[NH+]2CCC3(CC[NH2+]3)CC2)ccc1N1CCOCC1 ZINC000817866300 702504856 /nfs/dbraw/zinc/50/48/56/702504856.db2.gz XLPJEVAFAUYQIO-UHFFFAOYSA-N 2 2 319.424 1.990 20 10 DDCDLP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1CC(=O)NCc1ccc(N(C)C)cc1 ZINC000846708172 703321875 /nfs/dbraw/zinc/32/18/75/703321875.db2.gz MRKFRXBANOUAJL-DZGCQCFKSA-N 2 2 304.438 1.180 20 10 DDCDLP C[C@H]1C[C@H]([NH3+])CC[N@H+]1CC(=O)NCc1ccc(N(C)C)cc1 ZINC000846708172 703321877 /nfs/dbraw/zinc/32/18/77/703321877.db2.gz MRKFRXBANOUAJL-DZGCQCFKSA-N 2 2 304.438 1.180 20 10 DDCDLP COc1ccc(N2CC[NH+](CCNC(=[NH2+])NC(C)C)CC2)cc1 ZINC000849066502 703616064 /nfs/dbraw/zinc/61/60/64/703616064.db2.gz GZFHOYNMBJQIJT-UHFFFAOYSA-N 2 2 319.453 1.340 20 10 DDCDLP Cc1[nH+]c[nH]c1CC(=O)NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000876506936 705738667 /nfs/dbraw/zinc/73/86/67/705738667.db2.gz RBCBLRHGVBVYOE-AWEZNQCLSA-N 2 2 301.394 1.143 20 10 DDCDLP CCOc1ccc(C[NH2+]Cc2nc(C[NH3+])cc(=O)[nH]2)c(O)c1 ZINC000863648891 705976841 /nfs/dbraw/zinc/97/68/41/705976841.db2.gz MOSILXSTLIIESI-UHFFFAOYSA-N 2 2 304.350 1.035 20 10 DDCDLP CCOc1cccc(C[NH+]2CCC([N@@H+]3CC[C@H](O)C3)CC2)c1O ZINC000827700809 706052826 /nfs/dbraw/zinc/05/28/26/706052826.db2.gz XODIEYQNZIKXQC-INIZCTEOSA-N 2 2 320.433 1.822 20 10 DDCDLP CCOc1cccc(C[NH+]2CCC([N@H+]3CC[C@H](O)C3)CC2)c1O ZINC000827700809 706052829 /nfs/dbraw/zinc/05/28/29/706052829.db2.gz XODIEYQNZIKXQC-INIZCTEOSA-N 2 2 320.433 1.822 20 10 DDCDLP COc1cccc(O)c1C[NH2+][C@@H]1C[NH2+]CC2(CCOCC2)C1 ZINC000903974608 711353958 /nfs/dbraw/zinc/35/39/58/711353958.db2.gz RTUNBXVQMHRCKM-ZDUSSCGKSA-N 2 2 306.406 1.649 20 10 DDCDLP COc1cc(C[N@@H+]2CCCC[C@@H]2C(N)=O)cc(C[NH+](C)C)c1O ZINC001139257083 860338869 /nfs/dbraw/zinc/33/88/69/860338869.db2.gz QUBKUPBNUDHAKI-CQSZACIVSA-N 2 2 321.421 1.302 20 10 DDCDLP COc1cc(C[N@H+]2CCCC[C@@H]2C(N)=O)cc(C[NH+](C)C)c1O ZINC001139257083 860338888 /nfs/dbraw/zinc/33/88/88/860338888.db2.gz QUBKUPBNUDHAKI-CQSZACIVSA-N 2 2 321.421 1.302 20 10 DDCDLP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C1CC[NH2+]CC1 ZINC001349313743 875106855 /nfs/dbraw/zinc/10/68/55/875106855.db2.gz IVXBWUDKSMAWTB-UHFFFAOYSA-N 3 2 320.456 1.761 20 10 DDCDLP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)c(F)c1)C1CC[NH2+]CC1 ZINC001349313743 875106863 /nfs/dbraw/zinc/10/68/63/875106863.db2.gz IVXBWUDKSMAWTB-UHFFFAOYSA-N 3 2 320.456 1.761 20 10 DDCDLP CN1CCN(c2ccc(C[N@H+](C)C3CC[NH2+]CC3)cc2F)CC1 ZINC001349313743 875106871 /nfs/dbraw/zinc/10/68/71/875106871.db2.gz IVXBWUDKSMAWTB-UHFFFAOYSA-N 2 2 320.456 1.761 20 10 DDCDLP CN1CCN(c2ccc(C[N@@H+](C)C3CC[NH2+]CC3)cc2F)CC1 ZINC001349313743 875106878 /nfs/dbraw/zinc/10/68/78/875106878.db2.gz IVXBWUDKSMAWTB-UHFFFAOYSA-N 2 2 320.456 1.761 20 10 DDCDLP [NH3+][C@@]12CCC[C@@H]1C[N@H+](Cc1cc3c(cc1O)OCC[NH2+]C3)C2 ZINC001235247640 888503235 /nfs/dbraw/zinc/50/32/35/888503235.db2.gz GKJHHRXIFLWAMY-RHSMWYFYSA-N 3 2 303.406 1.187 20 10 DDCDLP [NH3+][C@@]12CCC[C@@H]1C[N@@H+](Cc1cc3c(cc1O)OCC[NH2+]C3)C2 ZINC001235247640 888503251 /nfs/dbraw/zinc/50/32/51/888503251.db2.gz GKJHHRXIFLWAMY-RHSMWYFYSA-N 3 2 303.406 1.187 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[N@@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000769440877 701244927 /nfs/dbraw/zinc/24/49/27/701244927.db2.gz BWQSSZIRTCLWIA-FUHWJXTLSA-N 2 2 301.434 1.707 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[N@H+]1C[C@@H]2CCC[NH2+][C@@H]2C1 ZINC000769440877 701244928 /nfs/dbraw/zinc/24/49/28/701244928.db2.gz BWQSSZIRTCLWIA-FUHWJXTLSA-N 2 2 301.434 1.707 20 10 DDCDLP C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCC[NH2+]1 ZINC000817887794 702509103 /nfs/dbraw/zinc/50/91/03/702509103.db2.gz FCSOAEYBTXWHKF-CJNGLKHVSA-N 2 2 307.413 1.892 20 10 DDCDLP C[C@H]1C[N@H+](CC(=O)NCc2ccc(N(C)C)cc2)CC[C@H]1[NH3+] ZINC000844219910 702994935 /nfs/dbraw/zinc/99/49/35/702994935.db2.gz OKVOJBQRRRVLFH-XJKSGUPXSA-N 2 2 304.438 1.038 20 10 DDCDLP C[C@H]1C[N@@H+](CC(=O)NCc2ccc(N(C)C)cc2)CC[C@H]1[NH3+] ZINC000844219910 702994937 /nfs/dbraw/zinc/99/49/37/702994937.db2.gz OKVOJBQRRRVLFH-XJKSGUPXSA-N 2 2 304.438 1.038 20 10 DDCDLP C[C@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[NH2+]1 ZINC000863484590 705938716 /nfs/dbraw/zinc/93/87/16/705938716.db2.gz JWGULEOVNNNWQH-RDJZCZTQSA-N 3 2 302.466 1.669 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4nccnc4C3)cc2)CC1 ZINC000827692475 706050914 /nfs/dbraw/zinc/05/09/14/706050914.db2.gz JGQNDTHHFVECLZ-UHFFFAOYSA-N 2 2 323.444 1.787 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4nccnc4C3)cc2)CC1 ZINC000827692475 706050918 /nfs/dbraw/zinc/05/09/18/706050918.db2.gz JGQNDTHHFVECLZ-UHFFFAOYSA-N 2 2 323.444 1.787 20 10 DDCDLP COc1cc(C[N@@H+]2C[C@H](F)C[C@H]2CO)cc(C[NH+](C)C)c1O ZINC001139253188 860336643 /nfs/dbraw/zinc/33/66/43/860336643.db2.gz PEKGZHQNSDGJMZ-KGLIPLIRSA-N 2 2 312.385 1.367 20 10 DDCDLP COc1cc(C[N@H+]2C[C@H](F)C[C@H]2CO)cc(C[NH+](C)C)c1O ZINC001139253188 860336650 /nfs/dbraw/zinc/33/66/50/860336650.db2.gz PEKGZHQNSDGJMZ-KGLIPLIRSA-N 2 2 312.385 1.367 20 10 DDCDLP COCC[N@H+](Cc1cc(O)c(O)c(OC)c1)C1CC[NH+](C)CC1 ZINC001204344177 871065290 /nfs/dbraw/zinc/06/52/90/871065290.db2.gz ZVOWLVXBCXVVGV-UHFFFAOYSA-N 2 2 324.421 1.649 20 10 DDCDLP COCC[N@@H+](Cc1cc(O)c(O)c(OC)c1)C1CC[NH+](C)CC1 ZINC001204344177 871065311 /nfs/dbraw/zinc/06/53/11/871065311.db2.gz ZVOWLVXBCXVVGV-UHFFFAOYSA-N 2 2 324.421 1.649 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@@H+]1CCC[C@@H]1C(N)=O)c1cc(F)ccc1O ZINC000273556274 296123422 /nfs/dbraw/zinc/12/34/22/296123422.db2.gz GXEXSSXGELUVKY-BXUZGUMPSA-N 2 2 309.385 1.522 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@@H]1C(N)=O)c1cc(F)ccc1O ZINC000273556274 296123424 /nfs/dbraw/zinc/12/34/24/296123424.db2.gz GXEXSSXGELUVKY-BXUZGUMPSA-N 2 2 309.385 1.522 20 10 DDCDLP CCO[C@H](C[NH2+]Cc1ccc(N2CCOCC2)cc1)C[NH+](C)C ZINC000922759605 714139837 /nfs/dbraw/zinc/13/98/37/714139837.db2.gz ILCDYOLNQOQMKX-GOSISDBHSA-N 2 2 321.465 1.580 20 10 DDCDLP CC(=O)[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CCO1 ZINC001139411364 860389413 /nfs/dbraw/zinc/38/94/13/860389413.db2.gz HVHKLSXIMMYHKK-SFHVURJKSA-N 2 2 317.433 1.228 20 10 DDCDLP CC(=O)[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CCO1 ZINC001139411364 860389414 /nfs/dbraw/zinc/38/94/14/860389414.db2.gz HVHKLSXIMMYHKK-SFHVURJKSA-N 2 2 317.433 1.228 20 10 DDCDLP C[C@@H]1CC[C@@H](C[NH3+])[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2O)C1 ZINC001205844830 871858709 /nfs/dbraw/zinc/85/87/09/871858709.db2.gz YMORCAPIGVAPLJ-PBHICJAKSA-N 3 2 318.465 1.361 20 10 DDCDLP C[C@@H]1CC[C@@H](C[NH3+])[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2O)C1 ZINC001205844830 871858729 /nfs/dbraw/zinc/85/87/29/871858729.db2.gz YMORCAPIGVAPLJ-PBHICJAKSA-N 2 2 318.465 1.361 20 10 DDCDLP CC[N@H+](Cc1cc2c(cc1O)OCC[NH2+]C2)[C@@H]1CCC[NH2+]C1 ZINC001236010435 889057048 /nfs/dbraw/zinc/05/70/48/889057048.db2.gz RRXZHEYWDNYWBG-OAHLLOKOSA-N 3 2 305.422 1.448 20 10 DDCDLP CC[N@@H+](Cc1cc2c(cc1O)OCC[NH2+]C2)[C@@H]1CCC[NH2+]C1 ZINC001236010435 889057061 /nfs/dbraw/zinc/05/70/61/889057061.db2.gz RRXZHEYWDNYWBG-OAHLLOKOSA-N 3 2 305.422 1.448 20 10 DDCDLP Cn1c[nH+]cc1[C@@H]1NC(=O)CC[C@H]1[NH2+]Cc1cc(F)ccc1O ZINC000375529829 418655622 /nfs/dbraw/zinc/65/56/22/418655622.db2.gz LOWDRQAGAWZJFD-MLGOLLRUSA-N 2 2 318.352 1.374 20 10 DDCDLP Cc1ccc(O)c(C[NH+]2CCC(N3CC[N@@H+](C)CC3=O)CC2)c1 ZINC000364113951 525339991 /nfs/dbraw/zinc/33/99/91/525339991.db2.gz YMSAPXRXDGEULX-UHFFFAOYSA-N 2 2 317.433 1.439 20 10 DDCDLP Cc1ccc(O)c(C[NH+]2CCC(N3CC[N@H+](C)CC3=O)CC2)c1 ZINC000364113951 525340000 /nfs/dbraw/zinc/34/00/00/525340000.db2.gz YMSAPXRXDGEULX-UHFFFAOYSA-N 2 2 317.433 1.439 20 10 DDCDLP O=C([C@H]1CCC[N@@H+](Cc2cccc(F)c2O)C1)N1CC[NH2+]CC1 ZINC000843046943 702807762 /nfs/dbraw/zinc/80/77/62/702807762.db2.gz IBLGMWURLXRLMK-AWEZNQCLSA-N 2 2 321.396 1.175 20 10 DDCDLP O=C([C@H]1CCC[N@H+](Cc2cccc(F)c2O)C1)N1CC[NH2+]CC1 ZINC000843046943 702807764 /nfs/dbraw/zinc/80/77/64/702807764.db2.gz IBLGMWURLXRLMK-AWEZNQCLSA-N 2 2 321.396 1.175 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@@H+]2CC[C@](C)(C[NH3+])C2)cc1 ZINC000844225171 702996812 /nfs/dbraw/zinc/99/68/12/702996812.db2.gz ZVPULXDUWUSTAS-QGZVFWFLSA-N 2 2 304.438 1.040 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@H+]2CC[C@](C)(C[NH3+])C2)cc1 ZINC000844225171 702996814 /nfs/dbraw/zinc/99/68/14/702996814.db2.gz ZVPULXDUWUSTAS-QGZVFWFLSA-N 2 2 304.438 1.040 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH+]3CC(N4CC(F)C4)C3)cc2)CC1 ZINC001139404667 860388482 /nfs/dbraw/zinc/38/84/82/860388482.db2.gz VEKHIVKEJPPGMK-UHFFFAOYSA-N 2 2 318.440 1.276 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[NH+]3CCN(C#N)CC3)cc2)CC1 ZINC001140305945 860616002 /nfs/dbraw/zinc/61/60/02/860616002.db2.gz GRTALPAFNQBPFN-UHFFFAOYSA-N 2 2 313.449 1.427 20 10 DDCDLP CC(C)(C)c1ccc(O)c(C[N@@H+]2CCN3CC[NH2+]C[C@H]3C2)c1 ZINC001234981052 888291118 /nfs/dbraw/zinc/29/11/18/888291118.db2.gz VDIPGHOLEQSNIU-INIZCTEOSA-N 2 2 303.450 1.779 20 10 DDCDLP CC(C)(C)c1ccc(O)c(C[N@H+]2CCN3CC[NH2+]C[C@H]3C2)c1 ZINC001234981052 888291135 /nfs/dbraw/zinc/29/11/35/888291135.db2.gz VDIPGHOLEQSNIU-INIZCTEOSA-N 2 2 303.450 1.779 20 10 DDCDLP C[NH2+]C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000843044055 702807340 /nfs/dbraw/zinc/80/73/40/702807340.db2.gz BQULWZMRLYYHCA-LLVKDONJSA-N 2 2 309.366 1.740 20 10 DDCDLP C[NH2+]C[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000843044055 702807341 /nfs/dbraw/zinc/80/73/41/702807341.db2.gz BQULWZMRLYYHCA-LLVKDONJSA-N 2 2 309.366 1.740 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCc4nn[nH]c4C3)cc2)CC1 ZINC000827884759 706081940 /nfs/dbraw/zinc/08/19/40/706081940.db2.gz HHZHWZUVYXOHIM-UHFFFAOYSA-N 2 2 312.421 1.115 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCc4nn[nH]c4C3)cc2)CC1 ZINC000827884759 706081944 /nfs/dbraw/zinc/08/19/44/706081944.db2.gz HHZHWZUVYXOHIM-UHFFFAOYSA-N 2 2 312.421 1.115 20 10 DDCDLP C[C@@H]1[NH2+]CCC[C@@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000925715717 714919976 /nfs/dbraw/zinc/91/99/76/714919976.db2.gz LJMCZFITAARURJ-KSSFIOAISA-N 2 2 303.450 1.878 20 10 DDCDLP Cn1ccnc1C[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001116512630 780516990 /nfs/dbraw/zinc/51/69/90/780516990.db2.gz VRAMIBGYSQPFKY-UHFFFAOYSA-N 2 2 313.449 1.804 20 10 DDCDLP Cn1ccnc1C[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001116512630 780516999 /nfs/dbraw/zinc/51/69/99/780516999.db2.gz VRAMIBGYSQPFKY-UHFFFAOYSA-N 2 2 313.449 1.804 20 10 DDCDLP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2NC(=O)[C@@H]1C[C@@H]([NH3+])C[NH2+]1 ZINC001157434629 863819699 /nfs/dbraw/zinc/81/96/99/863819699.db2.gz PKARBNZEEVJDJI-PVXIVEMSSA-N 2 2 317.433 1.438 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH+]3C[C@H]4C[NH2+]C[C@@H]4C3)cc2F)CC1 ZINC001319972376 866410312 /nfs/dbraw/zinc/41/03/12/866410312.db2.gz HABZGBLSOGJWIZ-HZPDHXFCSA-N 3 2 318.440 1.229 20 10 DDCDLP Cc1cc(=O)oc2c1ccc(O)c2C[NH+]1CCC(C[NH3+])CC1 ZINC001205040660 871340029 /nfs/dbraw/zinc/34/00/29/871340029.db2.gz GPCZBISNLMYCJE-UHFFFAOYSA-N 2 2 302.374 1.978 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@]2(CCC[NH2+]2)C1 ZINC001222353682 880416027 /nfs/dbraw/zinc/41/60/27/880416027.db2.gz FGMHQHBJKXJEPB-LJQANCHMSA-N 3 2 314.477 1.814 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCC[C@]2(CCC[NH2+]2)C1 ZINC001222353682 880416033 /nfs/dbraw/zinc/41/60/33/880416033.db2.gz FGMHQHBJKXJEPB-LJQANCHMSA-N 3 2 314.477 1.814 20 10 DDCDLP COC(=O)Cc1ccc(C[N@@H+]2C[C@@H]3CCC[NH+](C)[C@@H]3C2)c(O)c1 ZINC001249214637 893870133 /nfs/dbraw/zinc/87/01/33/893870133.db2.gz OQHGSYAVXIIJHC-GOEBONIOSA-N 2 2 318.417 1.634 20 10 DDCDLP COC(=O)Cc1ccc(C[N@H+]2C[C@@H]3CCC[NH+](C)[C@@H]3C2)c(O)c1 ZINC001249214637 893870138 /nfs/dbraw/zinc/87/01/38/893870138.db2.gz OQHGSYAVXIIJHC-GOEBONIOSA-N 2 2 318.417 1.634 20 10 DDCDLP COC(=O)Cc1ccc(C[NH+]2C[C@@H]3CCC[N@H+](C)[C@@H]3C2)c(O)c1 ZINC001249214637 893870158 /nfs/dbraw/zinc/87/01/58/893870158.db2.gz OQHGSYAVXIIJHC-GOEBONIOSA-N 2 2 318.417 1.634 20 10 DDCDLP COC(=O)Cc1ccc(C[NH+]2C[C@@H]3CCC[N@@H+](C)[C@@H]3C2)c(O)c1 ZINC001249214637 893870169 /nfs/dbraw/zinc/87/01/69/893870169.db2.gz OQHGSYAVXIIJHC-GOEBONIOSA-N 2 2 318.417 1.634 20 10 DDCDLP CC[C@H]([NH2+]CCC[N@@H+]1CCC[C@H]1C(N)=O)c1ccccc1O ZINC000274931877 130274673 /nfs/dbraw/zinc/27/46/73/130274673.db2.gz RBGRMQYXEJXTRI-GJZGRUSLSA-N 2 2 305.422 1.773 20 10 DDCDLP CC[C@H]([NH2+]CCC[N@H+]1CCC[C@H]1C(N)=O)c1ccccc1O ZINC000274931877 130274677 /nfs/dbraw/zinc/27/46/77/130274677.db2.gz RBGRMQYXEJXTRI-GJZGRUSLSA-N 2 2 305.422 1.773 20 10 DDCDLP COc1ccc(N2CC[NH+](CCc3c[nH+]cn3C)CC2)cc1F ZINC000297748294 536698793 /nfs/dbraw/zinc/69/87/93/536698793.db2.gz KXANJFSGUCDWMM-UHFFFAOYSA-N 2 2 318.396 1.933 20 10 DDCDLP C[N@H+]1C[C@@H]2C[NH+](Cc3ccc(N4CCOCC4)c(F)c3)C[C@@H]2C1 ZINC000787305013 699204387 /nfs/dbraw/zinc/20/43/87/699204387.db2.gz NCUZFQJQWAUGJR-IYBDPMFKSA-N 2 2 319.424 1.656 20 10 DDCDLP C[N@@H+]1C[C@@H]2C[NH+](Cc3ccc(N4CCOCC4)c(F)c3)C[C@@H]2C1 ZINC000787305013 699204388 /nfs/dbraw/zinc/20/43/88/699204388.db2.gz NCUZFQJQWAUGJR-IYBDPMFKSA-N 2 2 319.424 1.656 20 10 DDCDLP C[NH+]1C[C@@H]2C[N@@H+](Cc3ccc(N4CCOCC4)c(F)c3)C[C@@H]2C1 ZINC000787305013 699204389 /nfs/dbraw/zinc/20/43/89/699204389.db2.gz NCUZFQJQWAUGJR-IYBDPMFKSA-N 2 2 319.424 1.656 20 10 DDCDLP C[NH+]1C[C@@H]2C[N@H+](Cc3ccc(N4CCOCC4)c(F)c3)C[C@@H]2C1 ZINC000787305013 699204392 /nfs/dbraw/zinc/20/43/92/699204392.db2.gz NCUZFQJQWAUGJR-IYBDPMFKSA-N 2 2 319.424 1.656 20 10 DDCDLP C[C@@H](C[C@@H]1COCC[NH2+]1)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000817896179 702511624 /nfs/dbraw/zinc/51/16/24/702511624.db2.gz ZBHBNIRZOHTSMQ-DOTOQJQBSA-N 2 2 319.449 1.380 20 10 DDCDLP CC[C@@H](Cn1cncn1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817942895 702530977 /nfs/dbraw/zinc/53/09/77/702530977.db2.gz RGGWYQHATCKYDO-HOCLYGCPSA-N 2 2 302.426 1.412 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[NH2+][C@](C)(C[NH3+])C2CC2)cc1 ZINC000844220687 702995346 /nfs/dbraw/zinc/99/53/46/702995346.db2.gz JPIHUVGPCAZFPF-QGZVFWFLSA-N 2 2 304.438 1.086 20 10 DDCDLP C[NH+]1CCN(c2ccc(CNc3cc(CO)cc[nH+]3)cc2)CC1 ZINC000882879535 707834188 /nfs/dbraw/zinc/83/41/88/707834188.db2.gz AYZRFRVOUNYWII-UHFFFAOYSA-N 2 2 312.417 1.938 20 10 DDCDLP CC[N@H+](Cc1cc(C[NH+](C)C)c(O)c(OC)c1)[C@@H](C)C(=O)OC ZINC001139259810 860340600 /nfs/dbraw/zinc/34/06/00/860340600.db2.gz CIHOPWHBRKZVTC-LBPRGKRZSA-N 2 2 324.421 1.846 20 10 DDCDLP CC[N@@H+](Cc1cc(C[NH+](C)C)c(O)c(OC)c1)[C@@H](C)C(=O)OC ZINC001139259810 860340602 /nfs/dbraw/zinc/34/06/02/860340602.db2.gz CIHOPWHBRKZVTC-LBPRGKRZSA-N 2 2 324.421 1.846 20 10 DDCDLP [NH3+]C[C@H]1C[N@H+](Cc2c(O)cccc2OC(F)(F)F)C[C@@H]1O ZINC001206536075 872423015 /nfs/dbraw/zinc/42/30/15/872423015.db2.gz XRPWZLJLGLXNRP-KWQFWETISA-N 2 2 306.284 1.042 20 10 DDCDLP [NH3+]C[C@H]1C[N@@H+](Cc2c(O)cccc2OC(F)(F)F)C[C@@H]1O ZINC001206536075 872423024 /nfs/dbraw/zinc/42/30/24/872423024.db2.gz XRPWZLJLGLXNRP-KWQFWETISA-N 2 2 306.284 1.042 20 10 DDCDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@@H](O)C[NH+]2CCCC2)c1 ZINC000273375929 130113982 /nfs/dbraw/zinc/11/39/82/130113982.db2.gz HFDWIBZIBJVTTE-TZMCWYRMSA-N 2 2 322.405 1.286 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@@]3(CC[NH+](C)C3)C2)ccc1[N+](=O)[O-] ZINC000292852270 409044126 /nfs/dbraw/zinc/04/41/26/409044126.db2.gz UHIDUJSBDXDJFH-MRXNPFEDSA-N 2 2 321.377 1.837 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@@]3(CC[NH+](C)C3)C2)ccc1[N+](=O)[O-] ZINC000292852270 409044128 /nfs/dbraw/zinc/04/41/28/409044128.db2.gz UHIDUJSBDXDJFH-MRXNPFEDSA-N 2 2 321.377 1.837 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@@]3(CC[N@H+](C)C3)C2)ccc1[N+](=O)[O-] ZINC000292852270 409044130 /nfs/dbraw/zinc/04/41/30/409044130.db2.gz UHIDUJSBDXDJFH-MRXNPFEDSA-N 2 2 321.377 1.837 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@@]3(CC[N@@H+](C)C3)C2)ccc1[N+](=O)[O-] ZINC000292852270 409044133 /nfs/dbraw/zinc/04/41/33/409044133.db2.gz UHIDUJSBDXDJFH-MRXNPFEDSA-N 2 2 321.377 1.837 20 10 DDCDLP C[C@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)[C@@H]1CCC[NH2+]1 ZINC000817887793 702509130 /nfs/dbraw/zinc/50/91/30/702509130.db2.gz FCSOAEYBTXWHKF-BBRMVZONSA-N 2 2 307.413 1.892 20 10 DDCDLP COc1cc(Br)cc(C[N@H+](C)[C@H](C)C[NH3+])c1O ZINC000843051915 702808781 /nfs/dbraw/zinc/80/87/81/702808781.db2.gz MGOVTSAJMMTVSW-MRVPVSSYSA-N 2 2 303.200 1.942 20 10 DDCDLP COc1cc(Br)cc(C[N@@H+](C)[C@H](C)C[NH3+])c1O ZINC000843051915 702808783 /nfs/dbraw/zinc/80/87/83/702808783.db2.gz MGOVTSAJMMTVSW-MRVPVSSYSA-N 2 2 303.200 1.942 20 10 DDCDLP COc1cc(C)c(C[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)c(O)c1 ZINC001182883259 743744181 /nfs/dbraw/zinc/74/41/81/743744181.db2.gz YIFSYQDOVWDTAC-HNNXBMFYSA-N 2 2 321.421 1.139 20 10 DDCDLP COc1cc(C)c(C[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c(O)c1 ZINC001182883259 743744184 /nfs/dbraw/zinc/74/41/84/743744184.db2.gz YIFSYQDOVWDTAC-HNNXBMFYSA-N 2 2 321.421 1.139 20 10 DDCDLP CCOC(=O)CN(CC[NH3+])c1cc(F)c(C[NH+](C)C)c(F)c1 ZINC001170996112 772051335 /nfs/dbraw/zinc/05/13/35/772051335.db2.gz JPPMUQZOZWZXPS-UHFFFAOYSA-N 2 2 315.364 1.355 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H](C[NH3+])C3)cc2F)CC1 ZINC001326992059 861779903 /nfs/dbraw/zinc/77/99/03/861779903.db2.gz XWRQNHHJEFLGKD-MRXNPFEDSA-N 3 2 320.456 1.748 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H](C[NH3+])C3)cc2F)CC1 ZINC001326992059 861779908 /nfs/dbraw/zinc/77/99/08/861779908.db2.gz XWRQNHHJEFLGKD-MRXNPFEDSA-N 3 2 320.456 1.748 20 10 DDCDLP CN1CCN(c2ccc(C[N@@H+]3CCC[C@H](C[NH3+])C3)cc2F)CC1 ZINC001326992059 861779917 /nfs/dbraw/zinc/77/99/17/861779917.db2.gz XWRQNHHJEFLGKD-MRXNPFEDSA-N 2 2 320.456 1.748 20 10 DDCDLP CN1CCN(c2ccc(C[N@H+]3CCC[C@H](C[NH3+])C3)cc2F)CC1 ZINC001326992059 861779925 /nfs/dbraw/zinc/77/99/25/861779925.db2.gz XWRQNHHJEFLGKD-MRXNPFEDSA-N 2 2 320.456 1.748 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]([NH3+])C3CC3)cc2F)CC1 ZINC001327414924 862158001 /nfs/dbraw/zinc/15/80/01/862158001.db2.gz FLVYAVUBABJDFH-INIZCTEOSA-N 3 2 306.429 1.404 20 10 DDCDLP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2NC(=O)[C@@H]1C[C@@H]([NH3+])C[NH2+]1 ZINC001157434628 863819416 /nfs/dbraw/zinc/81/94/16/863819416.db2.gz PKARBNZEEVJDJI-FFSVYQOJSA-N 2 2 317.433 1.438 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+]Cc3ncc[nH]3)cc2F)CC1 ZINC001349632368 875273926 /nfs/dbraw/zinc/27/39/26/875273926.db2.gz HSEJWXJDPKAFNV-UHFFFAOYSA-N 2 2 303.385 1.590 20 10 DDCDLP CC(C)C[C@H](C[NH3+])[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000841038635 702318586 /nfs/dbraw/zinc/31/85/86/702318586.db2.gz MOOFRIMRAUTMQE-QGZVFWFLSA-N 3 2 304.482 1.901 20 10 DDCDLP CC(=O)c1cc(Cl)cc(C[NH+]2CCC(O)(C[NH3+])CC2)c1O ZINC000842480623 702726656 /nfs/dbraw/zinc/72/66/56/702726656.db2.gz VIYQAONJUIUXOX-UHFFFAOYSA-N 2 2 312.797 1.534 20 10 DDCDLP C[C@H]([NH2+]Cc1ccc(N2CCC(O)CC2)cc1)[C@@H]1CCC[NH2+]1 ZINC000854230573 704369082 /nfs/dbraw/zinc/36/90/82/704369082.db2.gz UXCTYALZGDRYMB-KSSFIOAISA-N 2 2 303.450 1.878 20 10 DDCDLP C[C@H]1CC[C@@H](C[NH3+])[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001205817029 871834678 /nfs/dbraw/zinc/83/46/78/871834678.db2.gz PONPBLHCXCWLOH-LPHOPBHVSA-N 3 2 316.493 1.998 20 10 DDCDLP C[C@H]1CC[C@@H](C[NH3+])[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001205817029 871834693 /nfs/dbraw/zinc/83/46/93/871834693.db2.gz PONPBLHCXCWLOH-LPHOPBHVSA-N 3 2 316.493 1.998 20 10 DDCDLP Oc1c(CN2CC[NH2+]C[C@@]23CC[NH2+]C3)cccc1C(F)(F)F ZINC001234992723 888316992 /nfs/dbraw/zinc/31/69/92/888316992.db2.gz SPLSJKKLVAUZLO-AWEZNQCLSA-N 2 2 315.339 1.548 20 10 DDCDLP Cc1ccc(O)c([C@@H](C)[NH2+]CCC[N@@H+]2CCC[C@@H]2C(N)=O)c1 ZINC000273622731 130146334 /nfs/dbraw/zinc/14/63/34/130146334.db2.gz ZMVIIFMFWKXQEJ-UKRRQHHQSA-N 2 2 305.422 1.691 20 10 DDCDLP Cc1ccc(O)c([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@@H]2C(N)=O)c1 ZINC000273622731 130146336 /nfs/dbraw/zinc/14/63/36/130146336.db2.gz ZMVIIFMFWKXQEJ-UKRRQHHQSA-N 2 2 305.422 1.691 20 10 DDCDLP COC[C@]1(C[NH2+]Cc2cc(OC)c(OC)cc2O)CCC[NH2+]1 ZINC000841067575 702334215 /nfs/dbraw/zinc/33/42/15/702334215.db2.gz NEBCUCLHYLTJOK-MRXNPFEDSA-N 2 2 310.394 1.268 20 10 DDCDLP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCO1)c1cc(Br)ccc1O ZINC000817982814 702542936 /nfs/dbraw/zinc/54/29/36/702542936.db2.gz HVGLAHRHUUSVPC-ONGXEEELSA-N 2 2 315.211 1.794 20 10 DDCDLP CC[NH+]1CCN(C(=O)[C@@H](C)[NH2+][C@@H](C)c2ccccc2O)CC1 ZINC000879652226 706750107 /nfs/dbraw/zinc/75/01/07/706750107.db2.gz XIMLTFGERARKRF-UONOGXRCSA-N 2 2 305.422 1.595 20 10 DDCDLP COc1ccc(N2CCC[N@H+](C[C@@H]3C[NH2+]CCO3)CC2)cc1 ZINC000852746576 704112720 /nfs/dbraw/zinc/11/27/20/704112720.db2.gz ONQMJTZRBJHUHC-KRWDZBQOSA-N 2 2 305.422 1.196 20 10 DDCDLP COc1ccc(N2CCC[N@@H+](C[C@@H]3C[NH2+]CCO3)CC2)cc1 ZINC000852746576 704112721 /nfs/dbraw/zinc/11/27/21/704112721.db2.gz ONQMJTZRBJHUHC-KRWDZBQOSA-N 2 2 305.422 1.196 20 10 DDCDLP Oc1ccccc1C[NH2+][C@H]1CCCN(CC[NH+]2CCOCC2)C1 ZINC000883371925 707986216 /nfs/dbraw/zinc/98/62/16/707986216.db2.gz FLNRDIKRNPPNSE-KRWDZBQOSA-N 2 2 319.449 1.278 20 10 DDCDLP COc1ccc(O)c(C[NH2+][C@H]2C[NH2+]CC3(CCOCC3)C2)c1 ZINC000903972107 711352527 /nfs/dbraw/zinc/35/25/27/711352527.db2.gz GRSNZWSOMGVRAS-CQSZACIVSA-N 2 2 306.406 1.649 20 10 DDCDLP C[NH+](C)CCN1CCC12C[NH+](Cc1ccc(Cl)cc1O)C2 ZINC001275271924 852942041 /nfs/dbraw/zinc/94/20/41/852942041.db2.gz ORVIQPZBOXYQEO-UHFFFAOYSA-N 2 2 309.841 1.867 20 10 DDCDLP COc1c(O)c(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000775029054 697955855 /nfs/dbraw/zinc/95/58/55/697955855.db2.gz JIHLFTDLPWOSGS-ZYHUDNBSSA-N 2 2 309.366 1.881 20 10 DDCDLP COc1c(O)c(C[NH2+][C@@H]2CC[N@@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000775029054 697955859 /nfs/dbraw/zinc/95/58/59/697955859.db2.gz JIHLFTDLPWOSGS-ZYHUDNBSSA-N 2 2 309.366 1.881 20 10 DDCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2cnc3cnccn23)cc1 ZINC000841046314 702321734 /nfs/dbraw/zinc/32/17/34/702321734.db2.gz ZQQIOXHNLGNUKE-INIZCTEOSA-N 2 2 310.405 1.585 20 10 DDCDLP C[C@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H]1C[NH3+] ZINC000843052258 702808902 /nfs/dbraw/zinc/80/89/02/702808902.db2.gz QZPDJJPGAQALFB-QFBILLFUSA-N 3 2 316.493 1.998 20 10 DDCDLP C[C@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H]1C[NH3+] ZINC000843052258 702808905 /nfs/dbraw/zinc/80/89/05/702808905.db2.gz QZPDJJPGAQALFB-QFBILLFUSA-N 3 2 316.493 1.998 20 10 DDCDLP CCO[C@@H](C[NH2+]Cc1ccc(OC)c(OC)c1O)C[NH+](C)C ZINC000896876678 708170314 /nfs/dbraw/zinc/17/03/14/708170314.db2.gz FCGCDDAITBQSAJ-ZDUSSCGKSA-N 2 2 312.410 1.466 20 10 DDCDLP Oc1cc(O)c(C[N@@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c(O)c1 ZINC001144515571 772558117 /nfs/dbraw/zinc/55/81/17/772558117.db2.gz QTBXVKYOLLALEW-CYBMUJFWSA-N 2 2 302.330 1.852 20 10 DDCDLP Oc1cc(O)c(C[N@H+]2CC[C@@H](Oc3cc[nH+]cc3)C2)c(O)c1 ZINC001144515571 772558120 /nfs/dbraw/zinc/55/81/20/772558120.db2.gz QTBXVKYOLLALEW-CYBMUJFWSA-N 2 2 302.330 1.852 20 10 DDCDLP COCC[N@H+](Cc1cc(OC)ccc1O)C1CC[NH+](C)CC1 ZINC001203674827 870706255 /nfs/dbraw/zinc/70/62/55/870706255.db2.gz CVIKFQFMMBWNQJ-UHFFFAOYSA-N 2 2 308.422 1.943 20 10 DDCDLP COCC[N@@H+](Cc1cc(OC)ccc1O)C1CC[NH+](C)CC1 ZINC001203674827 870706263 /nfs/dbraw/zinc/70/62/63/870706263.db2.gz CVIKFQFMMBWNQJ-UHFFFAOYSA-N 2 2 308.422 1.943 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](F)[C@@H]([NH3+])CC3)cc2)CC1 ZINC001206173997 872110626 /nfs/dbraw/zinc/11/06/26/872110626.db2.gz LCORGOOVXFOCLB-MSOLQXFVSA-N 3 2 320.456 1.700 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](F)[C@@H]([NH3+])CC3)cc2)CC1 ZINC001206173997 872110633 /nfs/dbraw/zinc/11/06/33/872110633.db2.gz LCORGOOVXFOCLB-MSOLQXFVSA-N 3 2 320.456 1.700 20 10 DDCDLP Cc1cccc(C[NH+]2CCN(CC[NH+]3CCOCC3)CC2)c1O ZINC001231592341 885756563 /nfs/dbraw/zinc/75/65/63/885756563.db2.gz KKLRICZLEXLLLZ-UHFFFAOYSA-N 2 2 319.449 1.150 20 10 DDCDLP Oc1cc2c(cc1C[NH+]1CCC3(CC[NH2+]3)CC1)C[NH2+]CCO2 ZINC001235111121 888415645 /nfs/dbraw/zinc/41/56/45/888415645.db2.gz OWVIWCLDWMNNEP-UHFFFAOYSA-N 3 2 303.406 1.202 20 10 DDCDLP C[NH+]1CCN(C2C[NH+](Cc3cc4ccccc4cc3O)C2)CC1 ZINC001236834834 889378219 /nfs/dbraw/zinc/37/82/19/889378219.db2.gz DOMXQJGQCFSXJC-UHFFFAOYSA-N 2 2 311.429 1.977 20 10 DDCDLP CC[N@@H+]1CCO[C@@H](CN2CC[NH+](Cc3ccccc3O)CC2)C1 ZINC000378493656 418724371 /nfs/dbraw/zinc/72/43/71/418724371.db2.gz IWXIYONMCDPXRJ-QGZVFWFLSA-N 2 2 319.449 1.231 20 10 DDCDLP CC[N@H+]1CCO[C@@H](CN2CC[NH+](Cc3ccccc3O)CC2)C1 ZINC000378493656 418724372 /nfs/dbraw/zinc/72/43/72/418724372.db2.gz IWXIYONMCDPXRJ-QGZVFWFLSA-N 2 2 319.449 1.231 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@@H]3CC[NH+](C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000278531594 484296042 /nfs/dbraw/zinc/29/60/42/484296042.db2.gz VCHVJWYCCXOSFO-SMDDNHRTSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@@H]3CC[NH+](C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000278531594 484296049 /nfs/dbraw/zinc/29/60/49/484296049.db2.gz VCHVJWYCCXOSFO-SMDDNHRTSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@@H]3CC[N@H+](C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000278531594 484296053 /nfs/dbraw/zinc/29/60/53/484296053.db2.gz VCHVJWYCCXOSFO-SMDDNHRTSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@@H]3CC[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000278531594 484296057 /nfs/dbraw/zinc/29/60/57/484296057.db2.gz VCHVJWYCCXOSFO-SMDDNHRTSA-N 2 2 321.377 1.835 20 10 DDCDLP C[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1cc(F)cc(F)c1O ZINC000756555981 700627851 /nfs/dbraw/zinc/62/78/51/700627851.db2.gz YJSDXGFDTZMFHC-NWDGAFQWSA-N 2 2 313.392 1.957 20 10 DDCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@H]2CCC(=O)NC2(C)C)cc1 ZINC000817942525 702531602 /nfs/dbraw/zinc/53/16/02/702531602.db2.gz PKAKFNIKVVHFLN-CABCVRRESA-N 2 2 304.438 1.399 20 10 DDCDLP C[C@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1c(O)cccc1F ZINC000886522986 708772684 /nfs/dbraw/zinc/77/26/84/708772684.db2.gz USYFFRDADYKDTK-LBPRGKRZSA-N 2 2 309.385 1.346 20 10 DDCDLP C[NH+]1CCN(c2ccc(CNC(=O)Cc3[nH]cc[nH+]3)cc2)CC1 ZINC000918843978 713568354 /nfs/dbraw/zinc/56/83/54/713568354.db2.gz ATQVGZNGMNEOSR-UHFFFAOYSA-N 2 2 313.405 1.020 20 10 DDCDLP [NH3+]C[C@]1(O)CCCC[N@H+](Cc2cc(Cl)c(O)cc2O)C1 ZINC001205689763 746552180 /nfs/dbraw/zinc/55/21/80/746552180.db2.gz RJJMQNTXJDLWJJ-CQSZACIVSA-N 2 2 300.786 1.427 20 10 DDCDLP [NH3+]C[C@]1(O)CCCC[N@@H+](Cc2cc(Cl)c(O)cc2O)C1 ZINC001205689763 746552181 /nfs/dbraw/zinc/55/21/81/746552181.db2.gz RJJMQNTXJDLWJJ-CQSZACIVSA-N 2 2 300.786 1.427 20 10 DDCDLP COc1cc(O)c(C[N@@H+]2CCCC[C@](O)(C[NH3+])C2)c(Cl)c1 ZINC001205725449 871753030 /nfs/dbraw/zinc/75/30/30/871753030.db2.gz HRJCKISGVHJFTR-HNNXBMFYSA-N 2 2 314.813 1.730 20 10 DDCDLP COc1cc(O)c(C[N@H+]2CCCC[C@](O)(C[NH3+])C2)c(Cl)c1 ZINC001205725449 871753041 /nfs/dbraw/zinc/75/30/41/871753041.db2.gz HRJCKISGVHJFTR-HNNXBMFYSA-N 2 2 314.813 1.730 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[NH+]3CC(C)(C[NH3+])C3)cc2)CC1 ZINC001206723723 872535684 /nfs/dbraw/zinc/53/56/84/872535684.db2.gz UGLKFDUSQAPHIM-UHFFFAOYSA-N 3 2 302.466 1.609 20 10 DDCDLP CC(C)(C)c1ccc(O)c(C[N@@H+]2CCN3CC[NH2+]C[C@@H]3C2)c1 ZINC001234981053 888292300 /nfs/dbraw/zinc/29/23/00/888292300.db2.gz VDIPGHOLEQSNIU-MRXNPFEDSA-N 2 2 303.450 1.779 20 10 DDCDLP CC(C)(C)c1ccc(O)c(C[N@H+]2CCN3CC[NH2+]C[C@@H]3C2)c1 ZINC001234981053 888292315 /nfs/dbraw/zinc/29/23/15/888292315.db2.gz VDIPGHOLEQSNIU-MRXNPFEDSA-N 2 2 303.450 1.779 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@H]4CC[C@@]4([NH3+])C3)cc2)CC1 ZINC001235995906 889051899 /nfs/dbraw/zinc/05/18/99/889051899.db2.gz ROLSDVIQPMOADD-SJLPKXTDSA-N 3 2 300.450 1.362 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@H]4CC[C@@]4([NH3+])C3)cc2)CC1 ZINC001235995906 889051910 /nfs/dbraw/zinc/05/19/10/889051910.db2.gz ROLSDVIQPMOADD-SJLPKXTDSA-N 3 2 300.450 1.362 20 10 DDCDLP C[N@H+](Cc1cc2c(cc1O)OCC[NH2+]C2)[C@@]1(C)CCC[NH2+]C1 ZINC001236208804 889146711 /nfs/dbraw/zinc/14/67/11/889146711.db2.gz XODNTUWDDWPEKZ-KRWDZBQOSA-N 3 2 305.422 1.448 20 10 DDCDLP C[N@@H+](Cc1cc2c(cc1O)OCC[NH2+]C2)[C@@]1(C)CCC[NH2+]C1 ZINC001236208804 889146716 /nfs/dbraw/zinc/14/67/16/889146716.db2.gz XODNTUWDDWPEKZ-KRWDZBQOSA-N 3 2 305.422 1.448 20 10 DDCDLP C[NH+]1CCN(C(=O)CC[NH2+]Cc2c(O)cccc2Cl)CC1 ZINC000264935445 523872423 /nfs/dbraw/zinc/87/24/23/523872423.db2.gz CPDLUUXYJLUHQU-UHFFFAOYSA-N 2 2 311.813 1.299 20 10 DDCDLP COc1cc(Br)cc(C[NH2+][C@H](C[NH3+])C2CC2)c1O ZINC000841028090 702315972 /nfs/dbraw/zinc/31/59/72/702315972.db2.gz LLSJMFMQNONYMP-LLVKDONJSA-N 2 2 315.211 1.990 20 10 DDCDLP C[C@@H]([NH2+]Cc1ccc(N2CCOCC2)c(F)c1)[C@H]1CCC[NH2+]1 ZINC000817887795 702508669 /nfs/dbraw/zinc/50/86/69/702508669.db2.gz FCSOAEYBTXWHKF-CZUORRHYSA-N 2 2 307.413 1.892 20 10 DDCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]CC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000903917074 711330756 /nfs/dbraw/zinc/33/07/56/711330756.db2.gz KOEIWBREFQTXDM-NZZOQPFGSA-N 3 2 302.466 1.873 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@]34CCOC4)cc2F)CC1 ZINC001328791595 863229251 /nfs/dbraw/zinc/22/92/51/863229251.db2.gz ISGVSCRNWWSJRZ-GOSISDBHSA-N 2 2 319.424 1.942 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@]34CCOC4)cc2F)CC1 ZINC001328791595 863229263 /nfs/dbraw/zinc/22/92/63/863229263.db2.gz ISGVSCRNWWSJRZ-GOSISDBHSA-N 2 2 319.424 1.942 20 10 DDCDLP CC[N@@H+]1CCO[C@@H]2C[NH+](Cc3ccc(N(C)C)cc3)C[C@@H]2C1 ZINC001203933032 870842109 /nfs/dbraw/zinc/84/21/09/870842109.db2.gz GIHBMTVUANVOME-FUHWJXTLSA-N 2 2 303.450 1.905 20 10 DDCDLP CC[N@H+]1CCO[C@@H]2C[NH+](Cc3ccc(N(C)C)cc3)C[C@@H]2C1 ZINC001203933032 870842113 /nfs/dbraw/zinc/84/21/13/870842113.db2.gz GIHBMTVUANVOME-FUHWJXTLSA-N 2 2 303.450 1.905 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@H+](Cc3ccc(N(C)C)cc3)C[C@@H]2C1 ZINC001203933032 870842119 /nfs/dbraw/zinc/84/21/19/870842119.db2.gz GIHBMTVUANVOME-FUHWJXTLSA-N 2 2 303.450 1.905 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@@H+](Cc3ccc(N(C)C)cc3)C[C@@H]2C1 ZINC001203933032 870842122 /nfs/dbraw/zinc/84/21/22/870842122.db2.gz GIHBMTVUANVOME-FUHWJXTLSA-N 2 2 303.450 1.905 20 10 DDCDLP COc1cc(O)c(C[N@@H+]2CCCC[C@@](O)(C[NH3+])C2)c(Cl)c1 ZINC001205725450 871753746 /nfs/dbraw/zinc/75/37/46/871753746.db2.gz HRJCKISGVHJFTR-OAHLLOKOSA-N 2 2 314.813 1.730 20 10 DDCDLP COc1cc(O)c(C[N@H+]2CCCC[C@@](O)(C[NH3+])C2)c(Cl)c1 ZINC001205725450 871753751 /nfs/dbraw/zinc/75/37/51/871753751.db2.gz HRJCKISGVHJFTR-OAHLLOKOSA-N 2 2 314.813 1.730 20 10 DDCDLP Cc1cc(Br)cc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](O)C2)c1O ZINC001205967796 871964212 /nfs/dbraw/zinc/96/42/12/871964212.db2.gz YCVXECRMHSQSIZ-VXGBXAGGSA-N 2 2 315.211 1.357 20 10 DDCDLP Cc1cc(Br)cc(C[N@H+]2CC[C@@H]([NH3+])[C@H](O)C2)c1O ZINC001205967796 871964216 /nfs/dbraw/zinc/96/42/16/871964216.db2.gz YCVXECRMHSQSIZ-VXGBXAGGSA-N 2 2 315.211 1.357 20 10 DDCDLP COc1cc(N(C)C)ccc1C[N@H+]1C[C@H]2COC[C@@H](C1)C2[NH3+] ZINC001235998065 889052031 /nfs/dbraw/zinc/05/20/31/889052031.db2.gz IZQHULKXRRBOEM-VMZNBEPHSA-N 2 2 305.422 1.167 20 10 DDCDLP COc1cc(N(C)C)ccc1C[N@@H+]1C[C@H]2COC[C@@H](C1)C2[NH3+] ZINC001235998065 889052045 /nfs/dbraw/zinc/05/20/45/889052045.db2.gz IZQHULKXRRBOEM-VMZNBEPHSA-N 2 2 305.422 1.167 20 10 DDCDLP COc1ccc(N2CC[NH+]([C@@H]3CC[NH2+][C@@H](C)C3)CC2)c(OC)c1 ZINC001246946116 893010240 /nfs/dbraw/zinc/01/02/40/893010240.db2.gz FYORKNRJJJEXCJ-LSDHHAIUSA-N 2 2 319.449 1.966 20 10 DDCDLP Oc1ccc(Br)cc1C[NH2+]C[C@@H]1C[C@H](F)C[NH2+]1 ZINC000841080729 702338383 /nfs/dbraw/zinc/33/83/83/702338383.db2.gz YBPMYKORZUDXBU-QWRGUYRKSA-N 2 2 303.175 1.944 20 10 DDCDLP Oc1c(Br)cccc1C[NH2+]C[C@@H]1C[NH2+]CCCO1 ZINC000841085641 702340778 /nfs/dbraw/zinc/34/07/78/702340778.db2.gz JDNNEKFVTHLZGL-NSHDSACASA-N 2 2 315.211 1.623 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)ccc1[N+](=O)[O-] ZINC000843123941 702824544 /nfs/dbraw/zinc/82/45/44/702824544.db2.gz SLGVZRYBPYDJOW-MRXNPFEDSA-N 2 2 321.377 1.885 20 10 DDCDLP COc1c(O)c(C[N@H+]2CCC[C@]3(CC[NH2+]C3)C2)ccc1[N+](=O)[O-] ZINC000843123941 702824547 /nfs/dbraw/zinc/82/45/47/702824547.db2.gz SLGVZRYBPYDJOW-MRXNPFEDSA-N 2 2 321.377 1.885 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@H]4CCC[C@]4([NH3+])C3)cc2)CC1 ZINC000857226250 704565918 /nfs/dbraw/zinc/56/59/18/704565918.db2.gz JAYUETDJVOHKSC-MJGOQNOKSA-N 3 2 314.477 1.752 20 10 DDCDLP Cc1cccc(O)c1C[NH2+][C@H]1CCN(CC[NH+]2CCOCC2)C1 ZINC000877031374 705965944 /nfs/dbraw/zinc/96/59/44/705965944.db2.gz QNCJZAHYDHHICP-INIZCTEOSA-N 2 2 319.449 1.197 20 10 DDCDLP Oc1c(Br)cccc1CN1CC[NH2+]CC[NH2+]CC1 ZINC000904397145 711852273 /nfs/dbraw/zinc/85/22/73/711852273.db2.gz AKYIQNNYFRWBPN-UHFFFAOYSA-N 2 2 314.227 1.150 20 10 DDCDLP CC1(C)[NH2+]CC[C@@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000925715097 714920017 /nfs/dbraw/zinc/92/00/17/714920017.db2.gz CXCKXGVKZHTEEA-KRWDZBQOSA-N 2 2 303.450 1.878 20 10 DDCDLP C[NH+]1CCN(C2CC[NH+](Cc3ccc(O)c(O)c3)CC2)CC1 ZINC001203878316 870812794 /nfs/dbraw/zinc/81/27/94/870812794.db2.gz DFGJGLVDWRAEJM-UHFFFAOYSA-N 2 2 305.422 1.310 20 10 DDCDLP C[NH+]1CCC2(CC1)C[N@H+](Cc1cc(F)c(F)cc1O)CCO2 ZINC001206408499 872292561 /nfs/dbraw/zinc/29/25/61/872292561.db2.gz AZHRNJYCMRLELO-UHFFFAOYSA-N 2 2 312.360 1.967 20 10 DDCDLP C[NH+]1CCC2(CC1)C[N@@H+](Cc1cc(F)c(F)cc1O)CCO2 ZINC001206408499 872292572 /nfs/dbraw/zinc/29/25/72/872292572.db2.gz AZHRNJYCMRLELO-UHFFFAOYSA-N 2 2 312.360 1.967 20 10 DDCDLP CCOc1cccc(CN2CC[NH2+][C@H]3CC[NH2+]CC[C@@H]32)c1O ZINC001222492113 880506228 /nfs/dbraw/zinc/50/62/28/880506228.db2.gz OMDSQDYOQXTHRW-GJZGRUSLSA-N 2 2 305.422 1.317 20 10 DDCDLP COc1ccc(CN2CC[NH2+]C[C@]23CC[NH2+]C3)c(O)c1Cl ZINC001234993850 888318699 /nfs/dbraw/zinc/31/86/99/888318699.db2.gz WHJILAKXXQOVBX-OAHLLOKOSA-N 2 2 311.813 1.192 20 10 DDCDLP COc1cc(O)c(C[N@@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)cc1OC ZINC001236757334 889334545 /nfs/dbraw/zinc/33/45/45/889334545.db2.gz KKCBLRFYFIPXOR-CXAGYDPISA-N 2 2 306.406 1.793 20 10 DDCDLP COc1cc(O)c(C[N@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)cc1OC ZINC001236757334 889334560 /nfs/dbraw/zinc/33/45/60/889334560.db2.gz KKCBLRFYFIPXOR-CXAGYDPISA-N 2 2 306.406 1.793 20 10 DDCDLP COc1ccc(O)c([C@@H](C)[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)c1 ZINC000273595862 130141339 /nfs/dbraw/zinc/14/13/39/130141339.db2.gz QMQCBQWYDVPPNF-DOMZBBRYSA-N 2 2 321.421 1.391 20 10 DDCDLP COc1ccc(O)c([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c1 ZINC000273595862 130141341 /nfs/dbraw/zinc/14/13/41/130141341.db2.gz QMQCBQWYDVPPNF-DOMZBBRYSA-N 2 2 321.421 1.391 20 10 DDCDLP C[C@@H]([NH2+][C@@H]1CCN(CC[NH+]2CCOCC2)C1)c1ccccc1O ZINC000371681361 418808320 /nfs/dbraw/zinc/80/83/20/418808320.db2.gz QDLMDKCYNUDYBH-HZPDHXFCSA-N 2 2 319.449 1.449 20 10 DDCDLP COc1cc(Br)cc(C[NH2+][C@@H](C[NH3+])C2CC2)c1O ZINC000841028091 702315470 /nfs/dbraw/zinc/31/54/70/702315470.db2.gz LLSJMFMQNONYMP-NSHDSACASA-N 2 2 315.211 1.990 20 10 DDCDLP [NH3+]CCNC(=O)[C@H]1CCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000843048165 702807905 /nfs/dbraw/zinc/80/79/05/702807905.db2.gz QUAWNEUENZLNGJ-LBPRGKRZSA-N 2 2 311.813 1.333 20 10 DDCDLP [NH3+]CCNC(=O)[C@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000843048165 702807908 /nfs/dbraw/zinc/80/79/08/702807908.db2.gz QUAWNEUENZLNGJ-LBPRGKRZSA-N 2 2 311.813 1.333 20 10 DDCDLP C[C@H]1C[N@H+](CC(=O)NCc2ccc(N(C)C)cc2)CC[C@@H]1[NH3+] ZINC000844219906 702995075 /nfs/dbraw/zinc/99/50/75/702995075.db2.gz OKVOJBQRRRVLFH-BBRMVZONSA-N 2 2 304.438 1.038 20 10 DDCDLP C[C@H]1C[N@@H+](CC(=O)NCc2ccc(N(C)C)cc2)CC[C@@H]1[NH3+] ZINC000844219906 702995077 /nfs/dbraw/zinc/99/50/77/702995077.db2.gz OKVOJBQRRRVLFH-BBRMVZONSA-N 2 2 304.438 1.038 20 10 DDCDLP Cn1c[nH+]cc1CC[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000838785243 707977813 /nfs/dbraw/zinc/97/78/13/707977813.db2.gz GSWKNBQBQVGPIZ-UHFFFAOYSA-N 2 2 314.433 1.931 20 10 DDCDLP Cn1c[nH+]cc1CC[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000838785243 707977816 /nfs/dbraw/zinc/97/78/16/707977816.db2.gz GSWKNBQBQVGPIZ-UHFFFAOYSA-N 2 2 314.433 1.931 20 10 DDCDLP CCO[C@H](C[NH2+]Cc1cc(OC)c(OC)cc1O)C[NH+](C)C ZINC000896879665 708171071 /nfs/dbraw/zinc/17/10/71/708171071.db2.gz DMDNGTVSTQCZGQ-CYBMUJFWSA-N 2 2 312.410 1.466 20 10 DDCDLP COc1ccc(C[N@H+](CCO)C2CC[NH+](C)CC2)c(O)c1OC ZINC000891401977 710186565 /nfs/dbraw/zinc/18/65/65/710186565.db2.gz MIQCVNHZDRCTDQ-UHFFFAOYSA-N 2 2 324.421 1.298 20 10 DDCDLP COc1ccc(C[N@@H+](CCO)C2CC[NH+](C)CC2)c(O)c1OC ZINC000891401977 710186566 /nfs/dbraw/zinc/18/65/66/710186566.db2.gz MIQCVNHZDRCTDQ-UHFFFAOYSA-N 2 2 324.421 1.298 20 10 DDCDLP COc1cc(C)cc(C[NH2+]C[C@@H]2C[N@@H+]3CCC[C@H]3CO2)c1O ZINC000894242721 711031560 /nfs/dbraw/zinc/03/15/60/711031560.db2.gz URFXJSMTBMDFEB-LSDHHAIUSA-N 2 2 306.406 1.662 20 10 DDCDLP COc1cc(C)cc(C[NH2+]C[C@@H]2C[N@H+]3CCC[C@H]3CO2)c1O ZINC000894242721 711031564 /nfs/dbraw/zinc/03/15/64/711031564.db2.gz URFXJSMTBMDFEB-LSDHHAIUSA-N 2 2 306.406 1.662 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH+]3CC4(C3)CCOC4)cc2F)CC1 ZINC001326343718 861294756 /nfs/dbraw/zinc/29/47/56/861294756.db2.gz OJFPLNZXKREVAE-UHFFFAOYSA-N 2 2 319.424 1.800 20 10 DDCDLP Oc1ccccc1C[N@@H+]1CC[C@H]2[C@@H]1CCN2CCn1cc[nH+]c1 ZINC001275266910 852940413 /nfs/dbraw/zinc/94/04/13/852940413.db2.gz FKMLXYNYWORBQT-IRXDYDNUSA-N 2 2 312.417 1.938 20 10 DDCDLP Oc1ccccc1C[N@H+]1CC[C@H]2[C@@H]1CCN2CCn1cc[nH+]c1 ZINC001275266910 852940415 /nfs/dbraw/zinc/94/04/15/852940415.db2.gz FKMLXYNYWORBQT-IRXDYDNUSA-N 2 2 312.417 1.938 20 10 DDCDLP C[NH2+]C[C@@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001332340728 865774453 /nfs/dbraw/zinc/77/44/53/865774453.db2.gz ZHCAQIJMMLJKBF-INIZCTEOSA-N 3 2 320.456 1.619 20 10 DDCDLP C[NH2+]C[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001332340728 865774455 /nfs/dbraw/zinc/77/44/55/865774455.db2.gz ZHCAQIJMMLJKBF-INIZCTEOSA-N 3 2 320.456 1.619 20 10 DDCDLP CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@]12C[NH2+]C[C@@H]1CC[NH2+]2 ZINC001161135192 866395862 /nfs/dbraw/zinc/39/58/62/866395862.db2.gz VIEWMQWXZJHQFH-MAUKXSAKSA-N 2 2 316.449 1.053 20 10 DDCDLP COc1ccc(C[NH2+]C[C@@H]2C[N@@H+]3CCC[C@@H]3CO2)c(O)c1OC ZINC001334168162 867347871 /nfs/dbraw/zinc/34/78/71/867347871.db2.gz JHQKOOQHZYCBKD-ZIAGYGMSSA-N 2 2 322.405 1.362 20 10 DDCDLP COc1ccc(C[NH2+]C[C@@H]2C[N@H+]3CCC[C@@H]3CO2)c(O)c1OC ZINC001334168162 867347891 /nfs/dbraw/zinc/34/78/91/867347891.db2.gz JHQKOOQHZYCBKD-ZIAGYGMSSA-N 2 2 322.405 1.362 20 10 DDCDLP CN(C)C1=[NH+]OC2(C1)CC[NH+](Cc1cc(O)c(O)c(O)c1)CC2 ZINC001233010941 886722034 /nfs/dbraw/zinc/72/20/34/886722034.db2.gz ACSCIINRHCXTET-UHFFFAOYSA-N 2 2 321.377 1.433 20 10 DDCDLP [NH3+][C@@]12C[C@@H]1CC[N@H+](Cc1ccc(N3CCC(O)CC3)cc1)C2 ZINC001235153692 888442823 /nfs/dbraw/zinc/44/28/23/888442823.db2.gz BTEGTGPVSBSYEF-MAUKXSAKSA-N 2 2 301.434 1.571 20 10 DDCDLP [NH3+][C@@]12C[C@@H]1CC[N@@H+](Cc1ccc(N3CCC(O)CC3)cc1)C2 ZINC001235153692 888442830 /nfs/dbraw/zinc/44/28/30/888442830.db2.gz BTEGTGPVSBSYEF-MAUKXSAKSA-N 2 2 301.434 1.571 20 10 DDCDLP COc1c(O)c(C[NH2+]C[C@H]2CCC[N@H+](C)C2)ccc1[N+](=O)[O-] ZINC000775010845 697953932 /nfs/dbraw/zinc/95/39/32/697953932.db2.gz FYEHJHDAZWUURS-LLVKDONJSA-N 2 2 309.366 1.740 20 10 DDCDLP COc1c(O)c(C[NH2+]C[C@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000775010845 697953934 /nfs/dbraw/zinc/95/39/34/697953934.db2.gz FYEHJHDAZWUURS-LLVKDONJSA-N 2 2 309.366 1.740 20 10 DDCDLP COc1c(O)c(C[NH2+][C@@H](C[NH3+])C2CCCC2)ccc1[N+](=O)[O-] ZINC000841087493 702341416 /nfs/dbraw/zinc/34/14/16/702341416.db2.gz QJXPXXSFFABFDS-LBPRGKRZSA-N 2 2 309.366 1.916 20 10 DDCDLP C[C@@H]1CC[NH2+]C[C@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000854230738 704368900 /nfs/dbraw/zinc/36/89/00/704368900.db2.gz XLOGKSLTNOAQLC-RDTXWAMCSA-N 2 2 303.450 1.735 20 10 DDCDLP CC[N@H+](C)C[C@H](O)C[NH+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000821391877 704402848 /nfs/dbraw/zinc/40/28/48/704402848.db2.gz RTGBHFBPIZCVIX-DLBZAZTESA-N 2 2 322.449 1.686 20 10 DDCDLP CC[N@@H+](C)C[C@H](O)C[NH+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000821391877 704402849 /nfs/dbraw/zinc/40/28/49/704402849.db2.gz RTGBHFBPIZCVIX-DLBZAZTESA-N 2 2 322.449 1.686 20 10 DDCDLP CC[NH+](C)C[C@H](O)C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000821391877 704402851 /nfs/dbraw/zinc/40/28/51/704402851.db2.gz RTGBHFBPIZCVIX-DLBZAZTESA-N 2 2 322.449 1.686 20 10 DDCDLP CC[NH+](C)C[C@H](O)C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000821391877 704402852 /nfs/dbraw/zinc/40/28/52/704402852.db2.gz RTGBHFBPIZCVIX-DLBZAZTESA-N 2 2 322.449 1.686 20 10 DDCDLP Oc1c(F)cc(F)cc1C[NH2+]CCCC[NH+]1CCOCC1 ZINC000882893948 707841653 /nfs/dbraw/zinc/84/16/53/707841653.db2.gz GDKZEXZHEGRHML-UHFFFAOYSA-N 2 2 300.349 1.872 20 10 DDCDLP COC(=O)CC[N@H+](CCC[NH+](C)C)Cc1c(O)cccc1F ZINC001137837678 751475234 /nfs/dbraw/zinc/47/52/34/751475234.db2.gz QRWSTICYSXAHGA-UHFFFAOYSA-N 2 2 312.385 1.848 20 10 DDCDLP COC(=O)CC[N@@H+](CCC[NH+](C)C)Cc1c(O)cccc1F ZINC001137837678 751475241 /nfs/dbraw/zinc/47/52/41/751475241.db2.gz QRWSTICYSXAHGA-UHFFFAOYSA-N 2 2 312.385 1.848 20 10 DDCDLP C[C@@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC[C@@H]1[NH3+] ZINC001118241805 781072852 /nfs/dbraw/zinc/07/28/52/781072852.db2.gz OKXWSDSKJYDIQH-PBHICJAKSA-N 3 2 320.456 1.747 20 10 DDCDLP C[C@@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC[C@@H]1[NH3+] ZINC001118241805 781072857 /nfs/dbraw/zinc/07/28/57/781072857.db2.gz OKXWSDSKJYDIQH-PBHICJAKSA-N 3 2 320.456 1.747 20 10 DDCDLP C[C@@H]1CN(Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC[C@@H]1[NH3+] ZINC001118241805 781072859 /nfs/dbraw/zinc/07/28/59/781072859.db2.gz OKXWSDSKJYDIQH-PBHICJAKSA-N 2 2 320.456 1.747 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@H]4C[NH2+]C[C@H]4C3)cc2F)CC1 ZINC001319972379 866411037 /nfs/dbraw/zinc/41/10/37/866411037.db2.gz HABZGBLSOGJWIZ-IYBDPMFKSA-N 3 2 318.440 1.229 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@H]4C[NH2+]C[C@H]4C3)cc2F)CC1 ZINC001319972379 866411049 /nfs/dbraw/zinc/41/10/49/866411049.db2.gz HABZGBLSOGJWIZ-IYBDPMFKSA-N 3 2 318.440 1.229 20 10 DDCDLP CC[NH+](CC)CC(=O)N1CC[NH+](Cc2ccc(N)cc2)CC1 ZINC001334774494 867824661 /nfs/dbraw/zinc/82/46/61/867824661.db2.gz KCHPLSIFIZQXGA-UHFFFAOYSA-N 2 2 304.438 1.255 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+]C3(C)CC[NH2+]CC3)cc2F)CC1 ZINC001325319682 867940976 /nfs/dbraw/zinc/94/09/76/867940976.db2.gz NMWCGXIWGVSQSN-UHFFFAOYSA-N 3 2 320.456 1.809 20 10 DDCDLP CN1CCN(c2ccc(C[NH2+]C3(C)CC[NH2+]CC3)cc2F)CC1 ZINC001325319682 867940986 /nfs/dbraw/zinc/94/09/86/867940986.db2.gz NMWCGXIWGVSQSN-UHFFFAOYSA-N 2 2 320.456 1.809 20 10 DDCDLP [NH3+]C[C@]1(O)CCCC[N@H+](Cc2c(O)ccc(F)c2Cl)C1 ZINC001205724925 871753905 /nfs/dbraw/zinc/75/39/05/871753905.db2.gz AREMXRUEWZXGFU-CQSZACIVSA-N 2 2 302.777 1.860 20 10 DDCDLP [NH3+]C[C@]1(O)CCCC[N@@H+](Cc2c(O)ccc(F)c2Cl)C1 ZINC001205724925 871753911 /nfs/dbraw/zinc/75/39/11/871753911.db2.gz AREMXRUEWZXGFU-CQSZACIVSA-N 2 2 302.777 1.860 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@H]3C(N)=O)c(F)c2)CC1 ZINC001236931241 889428000 /nfs/dbraw/zinc/42/80/00/889428000.db2.gz HZBGGDYUGAAGLT-INIZCTEOSA-N 2 2 320.412 1.027 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@H]3C(N)=O)c(F)c2)CC1 ZINC001236931241 889428008 /nfs/dbraw/zinc/42/80/08/889428008.db2.gz HZBGGDYUGAAGLT-INIZCTEOSA-N 2 2 320.412 1.027 20 10 DDCDLP C[C@H]([NH2+]CCC[N@H+]1CCC[C@@H]1C(=O)N(C)C)c1ccccc1O ZINC000272898576 130072313 /nfs/dbraw/zinc/07/23/13/130072313.db2.gz UQHNLRQPLWCYDI-GOEBONIOSA-N 2 2 319.449 1.986 20 10 DDCDLP COc1ccc(N2CC[NH+](CCn3cc[nH+]c3)CC2)cc1F ZINC000131672094 407747095 /nfs/dbraw/zinc/74/70/95/407747095.db2.gz YORXAILKMQBCHP-UHFFFAOYSA-N 2 2 304.369 1.853 20 10 DDCDLP Oc1c(Br)cccc1C[NH2+]CCN1CC[NH2+]CC1 ZINC000841041671 702320045 /nfs/dbraw/zinc/32/00/45/702320045.db2.gz DIYGBPWZWYNRKD-UHFFFAOYSA-N 2 2 314.227 1.150 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCC[C@@H]3[NH3+])cc2F)CC1 ZINC000817902688 702514909 /nfs/dbraw/zinc/51/49/09/702514909.db2.gz XCLZUULZTNDWBT-IRXDYDNUSA-N 3 2 320.456 1.937 20 10 DDCDLP CC[NH+]1CCN(c2ccc(CN[C@H]3CCC[C@@H]3[NH3+])cc2F)CC1 ZINC000817902688 702514913 /nfs/dbraw/zinc/51/49/13/702514913.db2.gz XCLZUULZTNDWBT-IRXDYDNUSA-N 2 2 320.456 1.937 20 10 DDCDLP COc1cccc(C[N@H+]2C[C@@H](c3cnn(C)c3)[C@H]([NH3+])C2)c1O ZINC000818431697 702647568 /nfs/dbraw/zinc/64/75/68/702647568.db2.gz RBMREAAODBDQEC-UONOGXRCSA-N 2 2 302.378 1.061 20 10 DDCDLP COc1cccc(C[N@@H+]2C[C@@H](c3cnn(C)c3)[C@H]([NH3+])C2)c1O ZINC000818431697 702647571 /nfs/dbraw/zinc/64/75/71/702647571.db2.gz RBMREAAODBDQEC-UONOGXRCSA-N 2 2 302.378 1.061 20 10 DDCDLP COc1cc(Br)cc(C[N@H+](C)[C@@H](C)C[NH3+])c1O ZINC000843051917 702808853 /nfs/dbraw/zinc/80/88/53/702808853.db2.gz MGOVTSAJMMTVSW-QMMMGPOBSA-N 2 2 303.200 1.942 20 10 DDCDLP COc1cc(Br)cc(C[N@@H+](C)[C@@H](C)C[NH3+])c1O ZINC000843051917 702808855 /nfs/dbraw/zinc/80/88/55/702808855.db2.gz MGOVTSAJMMTVSW-QMMMGPOBSA-N 2 2 303.200 1.942 20 10 DDCDLP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[NH2+]1 ZINC000863484593 705938812 /nfs/dbraw/zinc/93/88/12/705938812.db2.gz JWGULEOVNNNWQH-WBVHZDCISA-N 3 2 302.466 1.669 20 10 DDCDLP COc1cccc(C[NH+]2CCC([N@@H+]3CC[C@@H](O)C3)CC2)c1O ZINC000827700041 706052037 /nfs/dbraw/zinc/05/20/37/706052037.db2.gz OOUROWPEZYVFHU-OAHLLOKOSA-N 2 2 306.406 1.432 20 10 DDCDLP COc1cccc(C[NH+]2CCC([N@H+]3CC[C@@H](O)C3)CC2)c1O ZINC000827700041 706052040 /nfs/dbraw/zinc/05/20/40/706052040.db2.gz OOUROWPEZYVFHU-OAHLLOKOSA-N 2 2 306.406 1.432 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+]CC3([NH3+])CCC3)cc2F)CC1 ZINC001328683207 863147393 /nfs/dbraw/zinc/14/73/93/863147393.db2.gz YEISRZRUGVKBSY-UHFFFAOYSA-N 3 2 306.429 1.549 20 10 DDCDLP CC[N@H+](CC(=O)NC)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319689924 866221699 /nfs/dbraw/zinc/22/16/99/866221699.db2.gz AMCKKVKYINGTAE-UHFFFAOYSA-N 2 2 322.428 1.145 20 10 DDCDLP CC[N@@H+](CC(=O)NC)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001319689924 866221722 /nfs/dbraw/zinc/22/17/22/866221722.db2.gz AMCKKVKYINGTAE-UHFFFAOYSA-N 2 2 322.428 1.145 20 10 DDCDLP C[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)[C@@H]1C[N@H+](C)CCN1C ZINC001207622155 873421257 /nfs/dbraw/zinc/42/12/57/873421257.db2.gz LEVWHIHKQYCZIK-WENXUGBFSA-N 2 2 316.493 1.990 20 10 DDCDLP C[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)[C@@H]1C[N@@H+](C)CCN1C ZINC001207622155 873421263 /nfs/dbraw/zinc/42/12/63/873421263.db2.gz LEVWHIHKQYCZIK-WENXUGBFSA-N 2 2 316.493 1.990 20 10 DDCDLP N=c1ccc(/N=N/c2ccccc2)c(N)n1C(=O)[C@@H]([NH3+])CC[NH3+] ZINC001218581036 877589338 /nfs/dbraw/zinc/58/93/38/877589338.db2.gz DHKLLAYXTKQKOT-SGOGOUDHSA-N 2 2 313.365 1.281 20 10 DDCDLP CN(C)c1ccc(C[N@@H+]2CCN3CC[NH2+]C[C@@H]3C2)c2ccccc21 ZINC001234975283 888289243 /nfs/dbraw/zinc/28/92/43/888289243.db2.gz QECOLTFGUGSELW-QGZVFWFLSA-N 2 2 324.472 1.995 20 10 DDCDLP CN(C)c1ccc(C[N@H+]2CCN3CC[NH2+]C[C@@H]3C2)c2ccccc21 ZINC001234975283 888289256 /nfs/dbraw/zinc/28/92/56/888289256.db2.gz QECOLTFGUGSELW-QGZVFWFLSA-N 2 2 324.472 1.995 20 10 DDCDLP COc1ccc(N2CC[NH+]([C@H]3CC[NH2+][C@H](C)C3)CC2)c(OC)c1 ZINC001246946113 893009931 /nfs/dbraw/zinc/00/99/31/893009931.db2.gz FYORKNRJJJEXCJ-CABCVRRESA-N 2 2 319.449 1.966 20 10 DDCDLP Cc1cc(C)c([C@@H](C)[NH2+]CCC[N@@H+]2CCC[C@@H]2C(N)=O)c(O)c1 ZINC000284098315 131048907 /nfs/dbraw/zinc/04/89/07/131048907.db2.gz MRBBVRXYDWICCC-HUUCEWRRSA-N 2 2 319.449 1.999 20 10 DDCDLP Cc1cc(C)c([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@@H]2C(N)=O)c(O)c1 ZINC000284098315 131048908 /nfs/dbraw/zinc/04/89/08/131048908.db2.gz MRBBVRXYDWICCC-HUUCEWRRSA-N 2 2 319.449 1.999 20 10 DDCDLP C[N@@H+]1CC[C@](O)(C[NH2+]Cc2cc(Br)ccc2O)C1 ZINC000705763456 699241922 /nfs/dbraw/zinc/24/19/22/699241922.db2.gz ZXTNGEGWTSFCIM-ZDUSSCGKSA-N 2 2 315.211 1.311 20 10 DDCDLP C[N@H+]1CC[C@](O)(C[NH2+]Cc2cc(Br)ccc2O)C1 ZINC000705763456 699241925 /nfs/dbraw/zinc/24/19/25/699241925.db2.gz ZXTNGEGWTSFCIM-ZDUSSCGKSA-N 2 2 315.211 1.311 20 10 DDCDLP C[C@H]([NH2+]CC(=O)N1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000765416856 701010846 /nfs/dbraw/zinc/01/08/46/701010846.db2.gz MZJBWZGGTNOQGJ-AWEZNQCLSA-N 2 2 304.438 1.177 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CCCC[NH2+]3)cc2)CC1 ZINC000841032218 702316354 /nfs/dbraw/zinc/31/63/54/702316354.db2.gz APDVIXKCLOEJON-KRWDZBQOSA-N 3 2 302.466 1.670 20 10 DDCDLP C[C@@H](C[C@H]1COCC[NH2+]1)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000817900880 702513949 /nfs/dbraw/zinc/51/39/49/702513949.db2.gz QBBYRFYVQKMJGJ-YOEHRIQHSA-N 2 2 303.450 1.926 20 10 DDCDLP Fc1cc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)ccc1N1CCOCC1 ZINC000843126997 702825591 /nfs/dbraw/zinc/82/55/91/702825591.db2.gz NTEWNNYEOOCMQT-NVXWUHKLSA-N 2 2 319.424 1.846 20 10 DDCDLP Fc1cc(C[N@H+]2CC[C@H]3[NH2+]CC[C@@H]3C2)ccc1N1CCOCC1 ZINC000843126997 702825594 /nfs/dbraw/zinc/82/55/94/702825594.db2.gz NTEWNNYEOOCMQT-NVXWUHKLSA-N 2 2 319.424 1.846 20 10 DDCDLP COc1cc(C[N@@H+]2CCCC23COC3)cc(C[NH+](C)C)c1O ZINC001139257125 860338703 /nfs/dbraw/zinc/33/87/03/860338703.db2.gz SFGDDFLILXROSG-UHFFFAOYSA-N 2 2 306.406 1.827 20 10 DDCDLP COc1cc(C[N@H+]2CCCC23COC3)cc(C[NH+](C)C)c1O ZINC001139257125 860338711 /nfs/dbraw/zinc/33/87/11/860338711.db2.gz SFGDDFLILXROSG-UHFFFAOYSA-N 2 2 306.406 1.827 20 10 DDCDLP C[N@@H+]1CCN(C2CC[NH+](Cc3cccc(F)c3O)CC2)C(=O)C1 ZINC000374756417 418560692 /nfs/dbraw/zinc/56/06/92/418560692.db2.gz ZTZPMHUVNOWOSI-UHFFFAOYSA-N 2 2 321.396 1.270 20 10 DDCDLP C[N@H+]1CCN(C2CC[NH+](Cc3cccc(F)c3O)CC2)C(=O)C1 ZINC000374756417 418560694 /nfs/dbraw/zinc/56/06/94/418560694.db2.gz ZTZPMHUVNOWOSI-UHFFFAOYSA-N 2 2 321.396 1.270 20 10 DDCDLP CCOC(=O)C[N@H+](CC)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775664558 698021187 /nfs/dbraw/zinc/02/11/87/698021187.db2.gz YBWDAQPKWCOOPK-UHFFFAOYSA-N 2 2 319.449 1.823 20 10 DDCDLP CCOC(=O)C[N@@H+](CC)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775664558 698021188 /nfs/dbraw/zinc/02/11/88/698021188.db2.gz YBWDAQPKWCOOPK-UHFFFAOYSA-N 2 2 319.449 1.823 20 10 DDCDLP C[N@@H+]1CC[C@](O)(C[NH2+]Cc2cccc(Br)c2O)C1 ZINC000702627329 699231474 /nfs/dbraw/zinc/23/14/74/699231474.db2.gz YFBNRVBCXPYDHB-ZDUSSCGKSA-N 2 2 315.211 1.311 20 10 DDCDLP C[N@H+]1CC[C@](O)(C[NH2+]Cc2cccc(Br)c2O)C1 ZINC000702627329 699231476 /nfs/dbraw/zinc/23/14/76/699231476.db2.gz YFBNRVBCXPYDHB-ZDUSSCGKSA-N 2 2 315.211 1.311 20 10 DDCDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@H]2C[NH2+]CCCO2)c1 ZINC000817981564 702542682 /nfs/dbraw/zinc/54/26/82/702542682.db2.gz LFYKRYYJTVOVDH-DGCLKSJQSA-N 2 2 308.378 1.208 20 10 DDCDLP NC(=O)[C@@H]1CCC[N@@H+]1CCC[NH2+]Cc1ccc2c(c1)CCO2 ZINC000858224947 704681401 /nfs/dbraw/zinc/68/14/01/704681401.db2.gz XRVPJCMRSBNRTM-HNNXBMFYSA-N 2 2 303.406 1.051 20 10 DDCDLP NC(=O)[C@@H]1CCC[N@H+]1CCC[NH2+]Cc1ccc2c(c1)CCO2 ZINC000858224947 704681402 /nfs/dbraw/zinc/68/14/02/704681402.db2.gz XRVPJCMRSBNRTM-HNNXBMFYSA-N 2 2 303.406 1.051 20 10 DDCDLP COc1cccc(C[NH2+][C@H]2C[NH2+]CC3(CCOCC3)C2)c1O ZINC000903974094 711354331 /nfs/dbraw/zinc/35/43/31/711354331.db2.gz LKBMCQYOXUQKAI-CQSZACIVSA-N 2 2 306.406 1.649 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCCOCC3)cc2F)CC1 ZINC001116440069 780508866 /nfs/dbraw/zinc/50/88/66/780508866.db2.gz JQYNRWQWVFMVIY-UHFFFAOYSA-N 2 2 307.413 1.800 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCCOCC3)cc2F)CC1 ZINC001116440069 780508871 /nfs/dbraw/zinc/50/88/71/780508871.db2.gz JQYNRWQWVFMVIY-UHFFFAOYSA-N 2 2 307.413 1.800 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC(F)(F)[C@H](N)C3)cc2)CC1 ZINC001206668834 865172499 /nfs/dbraw/zinc/17/24/99/865172499.db2.gz VTIJWKJYMQBWAU-MRXNPFEDSA-N 2 2 324.419 1.607 20 10 DDCDLP Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC(=O)N1CC[NH+](C)CC1 ZINC001325338994 867955128 /nfs/dbraw/zinc/95/51/28/867955128.db2.gz FTTCXDNHKZKKSP-KGLIPLIRSA-N 2 2 317.433 1.613 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H]([NH3+])[C@H](F)CC3)cc2)CC1 ZINC001206173998 872111214 /nfs/dbraw/zinc/11/12/14/872111214.db2.gz LCORGOOVXFOCLB-QZTJIDSGSA-N 3 2 320.456 1.700 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H]([NH3+])[C@H](F)CC3)cc2)CC1 ZINC001206173998 872111219 /nfs/dbraw/zinc/11/12/19/872111219.db2.gz LCORGOOVXFOCLB-QZTJIDSGSA-N 3 2 320.456 1.700 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[NH+]1CC2(C1)CCC[NH2+]C2 ZINC001222335550 880406216 /nfs/dbraw/zinc/40/62/16/880406216.db2.gz UQMXDKRIZNSRCG-UHFFFAOYSA-N 3 2 300.450 1.282 20 10 DDCDLP COC(=O)Cc1ccc(C[N@@H+]2CCCC[C@@]23CC[NH2+]C3)c(O)c1 ZINC001235129652 888425708 /nfs/dbraw/zinc/42/57/08/888425708.db2.gz RPRHTBOXBZURCR-SFHVURJKSA-N 2 2 318.417 1.826 20 10 DDCDLP COC(=O)Cc1ccc(C[N@H+]2CCCC[C@@]23CC[NH2+]C3)c(O)c1 ZINC001235129652 888425714 /nfs/dbraw/zinc/42/57/14/888425714.db2.gz RPRHTBOXBZURCR-SFHVURJKSA-N 2 2 318.417 1.826 20 10 DDCDLP C[N@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)[C@@]1(C)CCC[NH2+]C1 ZINC001236204748 889143562 /nfs/dbraw/zinc/14/35/62/889143562.db2.gz BGISIPBLMFBLTN-SFHVURJKSA-N 3 2 302.466 1.670 20 10 DDCDLP C[N@@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)[C@@]1(C)CCC[NH2+]C1 ZINC001236204748 889143570 /nfs/dbraw/zinc/14/35/70/889143570.db2.gz BGISIPBLMFBLTN-SFHVURJKSA-N 3 2 302.466 1.670 20 10 DDCDLP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000278880512 285382178 /nfs/dbraw/zinc/38/21/78/285382178.db2.gz OCGCKQZOWJYHOG-LLVKDONJSA-N 2 2 309.366 1.740 20 10 DDCDLP CC[N@H+]1CC[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000278880512 285382179 /nfs/dbraw/zinc/38/21/79/285382179.db2.gz OCGCKQZOWJYHOG-LLVKDONJSA-N 2 2 309.366 1.740 20 10 DDCDLP COCC[N@H+](C)CCC[NH2+][C@@H](C)c1cc(C(=O)OC)ccc1O ZINC000273297520 408143602 /nfs/dbraw/zinc/14/36/02/408143602.db2.gz ALZTVDCAJPDARN-ZDUSSCGKSA-N 2 2 324.421 1.798 20 10 DDCDLP COCC[N@@H+](C)CCC[NH2+][C@@H](C)c1cc(C(=O)OC)ccc1O ZINC000273297520 408143607 /nfs/dbraw/zinc/14/36/07/408143607.db2.gz ALZTVDCAJPDARN-ZDUSSCGKSA-N 2 2 324.421 1.798 20 10 DDCDLP COc1c(O)c(C[NH2+]CCC[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000775050333 697958173 /nfs/dbraw/zinc/95/81/73/697958173.db2.gz HBISIRHOAVCPCJ-UHFFFAOYSA-N 2 2 309.366 1.885 20 10 DDCDLP CCn1ncnc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000793346909 699751809 /nfs/dbraw/zinc/75/18/09/699751809.db2.gz UKVRXBMHHSRFSO-UHFFFAOYSA-N 2 2 314.437 1.340 20 10 DDCDLP CCOc1ccc(C[N@H+](CCO)C2CC[NH+](C)CC2)c(O)c1 ZINC000771937465 701337641 /nfs/dbraw/zinc/33/76/41/701337641.db2.gz DDCKXXIYBQXMGA-UHFFFAOYSA-N 2 2 308.422 1.679 20 10 DDCDLP CCOc1ccc(C[N@@H+](CCO)C2CC[NH+](C)CC2)c(O)c1 ZINC000771937465 701337642 /nfs/dbraw/zinc/33/76/42/701337642.db2.gz DDCKXXIYBQXMGA-UHFFFAOYSA-N 2 2 308.422 1.679 20 10 DDCDLP CCc1cccc(C[N@@H+]2CCN(CC[NH+](C)C)C(=O)C2)c1O ZINC000848920220 703603745 /nfs/dbraw/zinc/60/37/45/703603745.db2.gz ZJLPNSGSDAIJTM-UHFFFAOYSA-N 2 2 305.422 1.160 20 10 DDCDLP CCc1cccc(C[N@H+]2CCN(CC[NH+](C)C)C(=O)C2)c1O ZINC000848920220 703603747 /nfs/dbraw/zinc/60/37/47/703603747.db2.gz ZJLPNSGSDAIJTM-UHFFFAOYSA-N 2 2 305.422 1.160 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCN(C)C(=O)C3)cc2)CC1 ZINC001140300463 860614958 /nfs/dbraw/zinc/61/49/58/860614958.db2.gz QBOSKSQLMFLPOD-UHFFFAOYSA-N 2 2 316.449 1.103 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CCN(C)C(=O)C3)cc2)CC1 ZINC001140300463 860614961 /nfs/dbraw/zinc/61/49/61/860614961.db2.gz QBOSKSQLMFLPOD-UHFFFAOYSA-N 2 2 316.449 1.103 20 10 DDCDLP COC[C@@H]([NH3+])C(=O)N(C)C1CC[NH+](c2ccc(OC)cc2)CC1 ZINC000375966184 418691542 /nfs/dbraw/zinc/69/15/42/418691542.db2.gz XFIIGGJLHCTKKX-MRXNPFEDSA-N 2 2 321.421 1.096 20 10 DDCDLP COc1ccc(N2CC[NH+](C[C@H](O)Cn3cc[nH+]c3)CC2)cc1 ZINC000754099666 700483636 /nfs/dbraw/zinc/48/36/36/700483636.db2.gz XBLMGEWVJLBJJE-INIZCTEOSA-N 2 2 316.405 1.075 20 10 DDCDLP Fc1cc(C[NH2+]C[C@H]2CCCC[NH2+]2)ccc1N1CCOCC1 ZINC000841033214 702317740 /nfs/dbraw/zinc/31/77/40/702317740.db2.gz PPZIFCALIXDZKQ-OAHLLOKOSA-N 2 2 307.413 1.894 20 10 DDCDLP [NH3+]Cc1cn([C@@H]2CCC[N@H+](Cc3cccc(Cl)c3O)C2)nn1 ZINC000841099341 702346174 /nfs/dbraw/zinc/34/61/74/702346174.db2.gz IIACAZOAVMURDB-CYBMUJFWSA-N 2 2 321.812 1.933 20 10 DDCDLP [NH3+]Cc1cn([C@@H]2CCC[N@@H+](Cc3cccc(Cl)c3O)C2)nn1 ZINC000841099341 702346182 /nfs/dbraw/zinc/34/61/82/702346182.db2.gz IIACAZOAVMURDB-CYBMUJFWSA-N 2 2 321.812 1.933 20 10 DDCDLP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCO1)c1cc(Br)ccc1O ZINC000817982812 702542719 /nfs/dbraw/zinc/54/27/19/702542719.db2.gz HVGLAHRHUUSVPC-KOLCDFICSA-N 2 2 315.211 1.794 20 10 DDCDLP C[C@@H]([NH2+]CC(=O)N1CC[NH+](C)CC1)c1ccc(Cl)cc1O ZINC000841748364 702556190 /nfs/dbraw/zinc/55/61/90/702556190.db2.gz XBIHHRHTKQKPBR-LLVKDONJSA-N 2 2 311.813 1.470 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000843127298 702825494 /nfs/dbraw/zinc/82/54/94/702825494.db2.gz PSLMRQIYKGWGGY-CMPLNLGQSA-N 2 2 307.350 1.493 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000843127298 702825497 /nfs/dbraw/zinc/82/54/97/702825497.db2.gz PSLMRQIYKGWGGY-CMPLNLGQSA-N 2 2 307.350 1.493 20 10 DDCDLP Cc1nonc1[C@H](C)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000926854489 712913144 /nfs/dbraw/zinc/91/31/44/712913144.db2.gz NWPIVYRNLDDYOS-ZDUSSCGKSA-N 2 2 315.421 1.981 20 10 DDCDLP C[C@@H]1CC[NH2+][C@@H](C)[C@@H]1[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000923369880 714330723 /nfs/dbraw/zinc/33/07/23/714330723.db2.gz MZPDMLNBKQARNG-RVKKMQEKSA-N 2 2 303.450 1.999 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+](C)CC(=O)OC)cc2)CC1 ZINC001140305658 860616679 /nfs/dbraw/zinc/61/66/79/860616679.db2.gz FCLPFXGPZCXNQE-UHFFFAOYSA-N 2 2 305.422 1.433 20 10 DDCDLP COCC[N@H+](Cc1ccc(OC)cc1O)C1CC[NH+](C)CC1 ZINC001203630397 870684847 /nfs/dbraw/zinc/68/48/47/870684847.db2.gz SBBMWCCQGTVVPD-UHFFFAOYSA-N 2 2 308.422 1.943 20 10 DDCDLP COCC[N@@H+](Cc1ccc(OC)cc1O)C1CC[NH+](C)CC1 ZINC001203630397 870684857 /nfs/dbraw/zinc/68/48/57/870684857.db2.gz SBBMWCCQGTVVPD-UHFFFAOYSA-N 2 2 308.422 1.943 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H]4CC[C@]4([NH3+])C3)cc2)CC1 ZINC001235997166 889051837 /nfs/dbraw/zinc/05/18/37/889051837.db2.gz VAIOJROSNTVAAE-HKUYNNGSSA-N 3 2 314.477 1.752 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H]4CC[C@]4([NH3+])C3)cc2)CC1 ZINC001235997166 889051849 /nfs/dbraw/zinc/05/18/49/889051849.db2.gz VAIOJROSNTVAAE-HKUYNNGSSA-N 3 2 314.477 1.752 20 10 DDCDLP C[N@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C1(C)COC1 ZINC001236937459 889432879 /nfs/dbraw/zinc/43/28/79/889432879.db2.gz IRHLGAFHYGMTKD-UHFFFAOYSA-N 2 2 307.413 1.798 20 10 DDCDLP C[N@@H+](Cc1ccc(N2CC[NH+](C)CC2)cc1F)C1(C)COC1 ZINC001236937459 889432885 /nfs/dbraw/zinc/43/28/85/889432885.db2.gz IRHLGAFHYGMTKD-UHFFFAOYSA-N 2 2 307.413 1.798 20 10 DDCDLP Oc1cc2c(cc1C[N@@H+]1CC[C@@H](C[NH+]3CCOCC3)C1)OCO2 ZINC000172935426 407854847 /nfs/dbraw/zinc/85/48/47/407854847.db2.gz QVMTYTLDZPKPPP-ZDUSSCGKSA-N 2 2 320.389 1.275 20 10 DDCDLP Oc1cc2c(cc1C[N@H+]1CC[C@@H](C[NH+]3CCOCC3)C1)OCO2 ZINC000172935426 407854854 /nfs/dbraw/zinc/85/48/54/407854854.db2.gz QVMTYTLDZPKPPP-ZDUSSCGKSA-N 2 2 320.389 1.275 20 10 DDCDLP CC[NH+]1CCC([NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)CC1 ZINC000278902433 409109738 /nfs/dbraw/zinc/10/97/38/409109738.db2.gz RHQJHLFEHPJGDP-UHFFFAOYSA-N 2 2 309.366 1.883 20 10 DDCDLP C[C@@H]1CC[NH2+]C[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000841059297 702329524 /nfs/dbraw/zinc/32/95/24/702329524.db2.gz PRMNLCJRZSAGCM-CRAIPNDOSA-N 3 2 302.466 1.526 20 10 DDCDLP C[C@@H]1[NH2+]CCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000841063868 702332623 /nfs/dbraw/zinc/33/26/23/702332623.db2.gz RKOQQKLGFUXLNR-YJBOKZPZSA-N 3 2 302.466 1.669 20 10 DDCDLP Oc1ccc(Br)cc1C[NH2+]C[C@@H]1C[NH2+]CCO1 ZINC000841098516 702344658 /nfs/dbraw/zinc/34/46/58/702344658.db2.gz HHEXQRIRUZGQHP-NSHDSACASA-N 2 2 301.184 1.233 20 10 DDCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000843125910 702824918 /nfs/dbraw/zinc/82/49/18/702824918.db2.gz KQIONABWGAZBPL-LISAXSMJSA-N 3 2 302.466 1.730 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@@H+]2CC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC000844223167 702996558 /nfs/dbraw/zinc/99/65/58/702996558.db2.gz TZRNZEBVGOJCHX-GOSISDBHSA-N 2 2 316.449 1.054 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@H+]2CC[C@@]3(CC[NH2+]C3)C2)cc1 ZINC000844223167 702996559 /nfs/dbraw/zinc/99/65/59/702996559.db2.gz TZRNZEBVGOJCHX-GOSISDBHSA-N 2 2 316.449 1.054 20 10 DDCDLP COc1ccc(N(C)CC[N@H+](C)C[C@H](O)C[NH+]2CCCC2)cc1 ZINC000844399694 703026034 /nfs/dbraw/zinc/02/60/34/703026034.db2.gz MSGOYIZKNMAOJO-KRWDZBQOSA-N 2 2 321.465 1.520 20 10 DDCDLP COc1ccc(N(C)CC[N@@H+](C)C[C@H](O)C[NH+]2CCCC2)cc1 ZINC000844399694 703026036 /nfs/dbraw/zinc/02/60/36/703026036.db2.gz MSGOYIZKNMAOJO-KRWDZBQOSA-N 2 2 321.465 1.520 20 10 DDCDLP COc1ccc(N(C)CC[N@H+](C)C[C@@H](O)C[NH+](C)C2CC2)cc1 ZINC000844403184 703026701 /nfs/dbraw/zinc/02/67/01/703026701.db2.gz ZETOKHHZGONLIW-QGZVFWFLSA-N 2 2 321.465 1.518 20 10 DDCDLP COc1ccc(N(C)CC[N@@H+](C)C[C@@H](O)C[NH+](C)C2CC2)cc1 ZINC000844403184 703026703 /nfs/dbraw/zinc/02/67/03/703026703.db2.gz ZETOKHHZGONLIW-QGZVFWFLSA-N 2 2 321.465 1.518 20 10 DDCDLP COc1ccc(N(C)CC[NH+](C)C[C@@H](O)C[N@H+](C)C2CC2)cc1 ZINC000844403184 703026705 /nfs/dbraw/zinc/02/67/05/703026705.db2.gz ZETOKHHZGONLIW-QGZVFWFLSA-N 2 2 321.465 1.518 20 10 DDCDLP COc1ccc(N(C)CC[NH+](C)C[C@@H](O)C[N@@H+](C)C2CC2)cc1 ZINC000844403184 703026708 /nfs/dbraw/zinc/02/67/08/703026708.db2.gz ZETOKHHZGONLIW-QGZVFWFLSA-N 2 2 321.465 1.518 20 10 DDCDLP COc1ccc(N(C)CC[N@H+](C)C[C@H](O)C[NH+](C)C(C)C)cc1 ZINC000852211600 703970027 /nfs/dbraw/zinc/97/00/27/703970027.db2.gz NIKAZMQLVUEVFJ-KRWDZBQOSA-N 2 2 323.481 1.764 20 10 DDCDLP COc1ccc(N(C)CC[N@@H+](C)C[C@H](O)C[NH+](C)C(C)C)cc1 ZINC000852211600 703970030 /nfs/dbraw/zinc/97/00/30/703970030.db2.gz NIKAZMQLVUEVFJ-KRWDZBQOSA-N 2 2 323.481 1.764 20 10 DDCDLP COc1ccc(N(C)CC[NH+](C)C[C@H](O)C[N@H+](C)C(C)C)cc1 ZINC000852211600 703970032 /nfs/dbraw/zinc/97/00/32/703970032.db2.gz NIKAZMQLVUEVFJ-KRWDZBQOSA-N 2 2 323.481 1.764 20 10 DDCDLP COc1ccc(N(C)CC[NH+](C)C[C@H](O)C[N@@H+](C)C(C)C)cc1 ZINC000852211600 703970035 /nfs/dbraw/zinc/97/00/35/703970035.db2.gz NIKAZMQLVUEVFJ-KRWDZBQOSA-N 2 2 323.481 1.764 20 10 DDCDLP Oc1cc2c(cc1C[NH+]1CCC([N@@H+]3CC[C@H](O)C3)CC1)OCO2 ZINC000827699093 706052195 /nfs/dbraw/zinc/05/21/95/706052195.db2.gz DYTUWNAXTPZJLM-AWEZNQCLSA-N 2 2 320.389 1.152 20 10 DDCDLP Oc1cc2c(cc1C[NH+]1CCC([N@H+]3CC[C@H](O)C3)CC1)OCO2 ZINC000827699093 706052196 /nfs/dbraw/zinc/05/21/96/706052196.db2.gz DYTUWNAXTPZJLM-AWEZNQCLSA-N 2 2 320.389 1.152 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@]34CCC[C@@H]3[NH2+]CC4)cc2)CC1 ZINC000873229815 707778789 /nfs/dbraw/zinc/77/87/89/707778789.db2.gz GKYJJLMDUDFTKF-OALUTQOASA-N 3 2 314.477 1.813 20 10 DDCDLP [NH3+]C[C@@H]([NH3+])c1ccc(C(=O)N2CCc3cccc(O)c3C2)cc1 ZINC001160873279 866161449 /nfs/dbraw/zinc/16/14/49/866161449.db2.gz XJIGUFUUENCIOQ-MRXNPFEDSA-N 2 2 311.385 1.549 20 10 DDCDLP C[C@@H]1CC[C@@H](C[NH3+])[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001205817027 871833832 /nfs/dbraw/zinc/83/38/32/871833832.db2.gz PONPBLHCXCWLOH-APWZRJJASA-N 3 2 316.493 1.998 20 10 DDCDLP C[C@@H]1CC[C@@H](C[NH3+])[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001205817027 871833851 /nfs/dbraw/zinc/83/38/51/871833851.db2.gz PONPBLHCXCWLOH-APWZRJJASA-N 3 2 316.493 1.998 20 10 DDCDLP Oc1cc2c(cc1C[NH+]1CCC3(CCC[NH2+]3)CC1)C[NH2+]CCO2 ZINC001228556796 883550202 /nfs/dbraw/zinc/55/02/02/883550202.db2.gz QIUAOYOSYUCGBR-UHFFFAOYSA-N 3 2 317.433 1.592 20 10 DDCDLP CC[C@H]([NH2+]CCC[N@@H+]1CCC[C@H]1C(N)=O)c1ccc(F)cc1O ZINC000286161824 131222904 /nfs/dbraw/zinc/22/29/04/131222904.db2.gz PWWTVMGTPFZLIP-GJZGRUSLSA-N 2 2 323.412 1.912 20 10 DDCDLP CC[C@H]([NH2+]CCC[N@H+]1CCC[C@H]1C(N)=O)c1ccc(F)cc1O ZINC000286161824 131222905 /nfs/dbraw/zinc/22/29/05/131222905.db2.gz PWWTVMGTPFZLIP-GJZGRUSLSA-N 2 2 323.412 1.912 20 10 DDCDLP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1CC(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000846708873 703322114 /nfs/dbraw/zinc/32/21/14/703322114.db2.gz XAIFGJBMRFOYKO-GOEBONIOSA-N 2 2 318.465 1.523 20 10 DDCDLP C[C@H]1C[C@H]([NH3+])CC[N@H+]1CC(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000846708873 703322116 /nfs/dbraw/zinc/32/21/16/703322116.db2.gz XAIFGJBMRFOYKO-GOEBONIOSA-N 2 2 318.465 1.523 20 10 DDCDLP CN(C)c1ccc(C[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)cc1F ZINC000858224996 704681339 /nfs/dbraw/zinc/68/13/39/704681339.db2.gz ZQMMDFFXQASSHB-INIZCTEOSA-N 2 2 322.428 1.321 20 10 DDCDLP CN(C)c1ccc(C[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)cc1F ZINC000858224996 704681341 /nfs/dbraw/zinc/68/13/41/704681341.db2.gz ZQMMDFFXQASSHB-INIZCTEOSA-N 2 2 322.428 1.321 20 10 DDCDLP C[NH+]1CCN(c2ccc(CNC(=O)Cc3c[nH]c[nH+]3)cc2)CC1 ZINC000918914654 713573857 /nfs/dbraw/zinc/57/38/57/713573857.db2.gz YVYJHEIDKFUKLD-UHFFFAOYSA-N 2 2 313.405 1.020 20 10 DDCDLP COc1cc(O)c(C[N@@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)c(OC)c1 ZINC001205778006 746898975 /nfs/dbraw/zinc/89/89/75/746898975.db2.gz GCBOEHBJNUKWEK-JTQLQIEISA-N 2 2 316.348 1.825 20 10 DDCDLP COc1cc(O)c(C[N@H+]2CCC(F)(F)[C@@H](C[NH3+])C2)c(OC)c1 ZINC001205778006 746898986 /nfs/dbraw/zinc/89/89/86/746898986.db2.gz GCBOEHBJNUKWEK-JTQLQIEISA-N 2 2 316.348 1.825 20 10 DDCDLP C[NH+](C)CCCN1CC[NH+](Cc2c(O)ccc(F)c2F)CC1 ZINC001233335108 886928138 /nfs/dbraw/zinc/92/81/38/886928138.db2.gz HMWVHAXXZKQDOP-UHFFFAOYSA-N 2 2 313.392 1.740 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H]4CC[C@@]4([NH3+])C3)cc2)CC1 ZINC001235995901 889052503 /nfs/dbraw/zinc/05/25/03/889052503.db2.gz ROLSDVIQPMOADD-FUHWJXTLSA-N 3 2 300.450 1.362 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H]4CC[C@@]4([NH3+])C3)cc2)CC1 ZINC001235995901 889052519 /nfs/dbraw/zinc/05/25/19/889052519.db2.gz ROLSDVIQPMOADD-FUHWJXTLSA-N 3 2 300.450 1.362 20 10 DDCDLP COc1cc(C[N@@H+](C)C[C@H](C)[NH3+])c(O)cc1Br ZINC001236904421 889412465 /nfs/dbraw/zinc/41/24/65/889412465.db2.gz MJGOKSSKCRZFRH-QMMMGPOBSA-N 2 2 303.200 1.942 20 10 DDCDLP COc1cc(C[N@H+](C)C[C@H](C)[NH3+])c(O)cc1Br ZINC001236904421 889412457 /nfs/dbraw/zinc/41/24/57/889412457.db2.gz MJGOKSSKCRZFRH-QMMMGPOBSA-N 2 2 303.200 1.942 20 10 DDCDLP C[C@@H]([NH2+][C@H]1CCN(CC[NH+]2CCOCC2)C1)c1ccccc1O ZINC000371681359 418808306 /nfs/dbraw/zinc/80/83/06/418808306.db2.gz QDLMDKCYNUDYBH-CVEARBPZSA-N 2 2 319.449 1.449 20 10 DDCDLP CC[N@@H+](CC(=O)OC)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775676263 698021757 /nfs/dbraw/zinc/02/17/57/698021757.db2.gz ORVXISGHTNBFJS-UHFFFAOYSA-N 2 2 305.422 1.433 20 10 DDCDLP C[C@@H]([NH2+]C[C@H](O)C[NH+](C)C)c1ccc(Br)cc1O ZINC000756556351 700627905 /nfs/dbraw/zinc/62/79/05/700627905.db2.gz NVIBKCLJSBITET-KOLCDFICSA-N 2 2 317.227 1.728 20 10 DDCDLP C[C@@H](CC(=O)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)n1cc[nH+]c1 ZINC000846663932 703310532 /nfs/dbraw/zinc/31/05/32/703310532.db2.gz SGHJWCWADWARAJ-XJKSGUPXSA-N 2 2 315.421 1.716 20 10 DDCDLP CC[N@H+](C)C[C@@H](O)C[NH+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000821391878 704402753 /nfs/dbraw/zinc/40/27/53/704402753.db2.gz RTGBHFBPIZCVIX-IAGOWNOFSA-N 2 2 322.449 1.686 20 10 DDCDLP CC[N@@H+](C)C[C@@H](O)C[NH+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000821391878 704402754 /nfs/dbraw/zinc/40/27/54/704402754.db2.gz RTGBHFBPIZCVIX-IAGOWNOFSA-N 2 2 322.449 1.686 20 10 DDCDLP CC[NH+](C)C[C@@H](O)C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000821391878 704402755 /nfs/dbraw/zinc/40/27/55/704402755.db2.gz RTGBHFBPIZCVIX-IAGOWNOFSA-N 2 2 322.449 1.686 20 10 DDCDLP CC[NH+](C)C[C@@H](O)C[N@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000821391878 704402756 /nfs/dbraw/zinc/40/27/56/704402756.db2.gz RTGBHFBPIZCVIX-IAGOWNOFSA-N 2 2 322.449 1.686 20 10 DDCDLP C[N@H+](CCN1CC[NH+](C)CC1)Cc1cc(F)cc(Cl)c1O ZINC001237799259 846708754 /nfs/dbraw/zinc/70/87/54/846708754.db2.gz QJTPDYHQGGMEOB-UHFFFAOYSA-N 2 2 315.820 1.864 20 10 DDCDLP C[N@@H+](CCN1CC[NH+](C)CC1)Cc1cc(F)cc(Cl)c1O ZINC001237799259 846708757 /nfs/dbraw/zinc/70/87/57/846708757.db2.gz QJTPDYHQGGMEOB-UHFFFAOYSA-N 2 2 315.820 1.864 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@]34CCOC4)cc2F)CC1 ZINC001328791600 863229606 /nfs/dbraw/zinc/22/96/06/863229606.db2.gz ISGVSCRNWWSJRZ-SFHVURJKSA-N 2 2 319.424 1.942 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@]34CCOC4)cc2F)CC1 ZINC001328791600 863229619 /nfs/dbraw/zinc/22/96/19/863229619.db2.gz ISGVSCRNWWSJRZ-SFHVURJKSA-N 2 2 319.424 1.942 20 10 DDCDLP C[C@@H](NC(=O)NCC[NH+]1CCC([NH3+])CC1)c1ccccc1O ZINC001335622829 868432117 /nfs/dbraw/zinc/43/21/17/868432117.db2.gz JHJZOGGGUVBZQA-GFCCVEGCSA-N 2 2 306.410 1.176 20 10 DDCDLP COc1cc(O)c(C[NH2+][C@@H](C)[C@H]2C[N@H+](C)CCN2C)cc1OC ZINC001308948997 871535970 /nfs/dbraw/zinc/53/59/70/871535970.db2.gz VVHMVNTVYAHOEX-GXTWGEPZSA-N 2 2 323.437 1.133 20 10 DDCDLP COc1cc(O)c(C[NH2+][C@@H](C)[C@H]2C[N@@H+](C)CCN2C)cc1OC ZINC001308948997 871535981 /nfs/dbraw/zinc/53/59/81/871535981.db2.gz VVHMVNTVYAHOEX-GXTWGEPZSA-N 2 2 323.437 1.133 20 10 DDCDLP COc1ccc(C[NH2+][C@@H](C)CNC(=O)Cn2cc[nH+]c2)cc1C ZINC001265873716 902522518 /nfs/dbraw/zinc/52/25/18/902522518.db2.gz ZOMASGIZFGNAFE-AWEZNQCLSA-N 2 2 316.405 1.495 20 10 DDCDLP CC[NH+]1CCN([C@H]2CC[N@H+](Cc3cccc(F)c3O)C2)CC1 ZINC000272297505 130016978 /nfs/dbraw/zinc/01/69/78/130016978.db2.gz PCSXCOZIUBTMIL-HNNXBMFYSA-N 2 2 307.413 1.743 20 10 DDCDLP CC[NH+]1CCN([C@H]2CC[N@@H+](Cc3cccc(F)c3O)C2)CC1 ZINC000272297505 130016980 /nfs/dbraw/zinc/01/69/80/130016980.db2.gz PCSXCOZIUBTMIL-HNNXBMFYSA-N 2 2 307.413 1.743 20 10 DDCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+]Cc2ccc3c(c2)nnn3C)cc1 ZINC000841044123 702320897 /nfs/dbraw/zinc/32/08/97/702320897.db2.gz TWQKCLUTRBCZPS-INIZCTEOSA-N 2 2 324.432 1.824 20 10 DDCDLP C[C@H]1CC[NH2+]C[C@H]1[NH2+]Cc1ccc(N2CCC(CO)CC2)cc1 ZINC000817895115 702511470 /nfs/dbraw/zinc/51/14/70/702511470.db2.gz QMMABYLMMZPKKH-HNAYVOBHSA-N 2 2 317.477 1.983 20 10 DDCDLP CN(C)c1ccc(C[N@@H+]2CCC[C@H](N3CC[NH2+]CC3=O)C2)cc1 ZINC000843065212 702812032 /nfs/dbraw/zinc/81/20/32/702812032.db2.gz KIILLRMKHYMQMX-KRWDZBQOSA-N 2 2 316.449 1.149 20 10 DDCDLP CN(C)c1ccc(C[N@H+]2CCC[C@H](N3CC[NH2+]CC3=O)C2)cc1 ZINC000843065212 702812034 /nfs/dbraw/zinc/81/20/34/702812034.db2.gz KIILLRMKHYMQMX-KRWDZBQOSA-N 2 2 316.449 1.149 20 10 DDCDLP COc1ccc(N2CC[NH+](CCC[NH2+]CC(C)(C)O)CC2)cc1 ZINC000818942752 704031451 /nfs/dbraw/zinc/03/14/51/704031451.db2.gz JUESEHSISWEFQH-UHFFFAOYSA-N 2 2 321.465 1.568 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@H]([NH3+])C(C)(C)C3)cc2)CC1 ZINC000903987191 711359811 /nfs/dbraw/zinc/35/98/11/711359811.db2.gz YEPVGOOCQHPXRN-KRWDZBQOSA-N 3 2 302.466 1.608 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@H]([NH3+])C(C)(C)C3)cc2)CC1 ZINC000903987191 711359817 /nfs/dbraw/zinc/35/98/17/711359817.db2.gz YEPVGOOCQHPXRN-KRWDZBQOSA-N 3 2 302.466 1.608 20 10 DDCDLP COc1ccc(C[NH2+]CCCNC(=O)Cc2c[nH]c[nH+]2)cc1C ZINC001167350532 733271643 /nfs/dbraw/zinc/27/16/43/733271643.db2.gz ZBBKAFROEUCRDP-UHFFFAOYSA-N 2 2 316.405 1.565 20 10 DDCDLP C[C@H](Cn1cc[nH+]c1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001199208618 747742821 /nfs/dbraw/zinc/74/28/21/747742821.db2.gz REJRIKPNLYWVIN-MRXNPFEDSA-N 3 2 313.449 1.813 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@H]1C(=O)N(C)C)c1ccccc1O ZINC000272898579 130072507 /nfs/dbraw/zinc/07/25/07/130072507.db2.gz UQHNLRQPLWCYDI-ZBFHGGJFSA-N 2 2 319.449 1.986 20 10 DDCDLP CCOCc1cc(C[NH2+]C[C@](C)(O)C[NH+](C)C)ccc1OC ZINC000178998408 407685469 /nfs/dbraw/zinc/68/54/69/407685469.db2.gz KBVNYUOIKWWTFV-KRWDZBQOSA-N 2 2 310.438 1.634 20 10 DDCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@@H](C)CCO)CC2)cc1 ZINC000779341467 698414940 /nfs/dbraw/zinc/41/49/40/698414940.db2.gz HZVDMUWHLMQJAV-INIZCTEOSA-N 2 2 321.465 1.568 20 10 DDCDLP C[C@@H]([NH2+]C[C@@H](O)C[NH+](C)C)c1cc(Br)ccc1O ZINC000756558280 700628302 /nfs/dbraw/zinc/62/83/02/700628302.db2.gz ZDGTVNLZZPQGCQ-MWLCHTKSSA-N 2 2 317.227 1.728 20 10 DDCDLP C[C@@H]1CC[NH2+]C[C@@H]1[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000841059869 702330093 /nfs/dbraw/zinc/33/00/93/702330093.db2.gz YFLKHIZQKNHLDD-CJNGLKHVSA-N 2 2 307.413 1.750 20 10 DDCDLP CCN(CC)C(=O)C[C@H](C)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817938233 702530516 /nfs/dbraw/zinc/53/05/16/702530516.db2.gz HDGVZSOHGTZYAM-YOEHRIQHSA-N 2 2 320.481 1.989 20 10 DDCDLP C[C@H]([NH2+]C[C@@H]1C[NH2+]CCO1)c1ccc(Br)cc1O ZINC000817982579 702542700 /nfs/dbraw/zinc/54/27/00/702542700.db2.gz GJTNLFGJZNVAME-ONGXEEELSA-N 2 2 315.211 1.794 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[NH2+][C@@](C)(C[NH3+])C2CC2)cc1 ZINC000844220686 702995440 /nfs/dbraw/zinc/99/54/40/702995440.db2.gz JPIHUVGPCAZFPF-KRWDZBQOSA-N 2 2 304.438 1.086 20 10 DDCDLP C[C@H](CC(=O)NC[C@H]([NH3+])c1ccc(N(C)C)cc1)n1cc[nH+]c1 ZINC000846663930 703310434 /nfs/dbraw/zinc/31/04/34/703310434.db2.gz SGHJWCWADWARAJ-CJNGLKHVSA-N 2 2 315.421 1.716 20 10 DDCDLP c1cc2c(cc1C[NH2+]C[C@H]1C[N@@H+]3CCC[C@H]3CO1)CCCO2 ZINC000921689486 713843900 /nfs/dbraw/zinc/84/39/00/713843900.db2.gz DUBJHUDOZMVYCG-IRXDYDNUSA-N 2 2 302.418 1.964 20 10 DDCDLP c1cc2c(cc1C[NH2+]C[C@H]1C[N@H+]3CCC[C@H]3CO1)CCCO2 ZINC000921689486 713843902 /nfs/dbraw/zinc/84/39/02/713843902.db2.gz DUBJHUDOZMVYCG-IRXDYDNUSA-N 2 2 302.418 1.964 20 10 DDCDLP CC(=O)N(C)C1C[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC001139409802 860389454 /nfs/dbraw/zinc/38/94/54/860389454.db2.gz SXZLMHFVMPAEOT-UHFFFAOYSA-N 2 2 316.449 1.101 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCN4CC[C@@H]4C3)cc2)CC1 ZINC001139411450 860389560 /nfs/dbraw/zinc/38/95/60/860389560.db2.gz MTJXDFBGABDXFK-GOSISDBHSA-N 2 2 300.450 1.328 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCN4CC[C@@H]4C3)cc2)CC1 ZINC001139411450 860389568 /nfs/dbraw/zinc/38/95/68/860389568.db2.gz MTJXDFBGABDXFK-GOSISDBHSA-N 2 2 300.450 1.328 20 10 DDCDLP C[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)[C@@H]1C[N@H+](C)CCN1C ZINC001207622151 873421494 /nfs/dbraw/zinc/42/14/94/873421494.db2.gz LEVWHIHKQYCZIK-FQEKARNZSA-N 2 2 316.493 1.990 20 10 DDCDLP C[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)[C@@H]1C[N@@H+](C)CCN1C ZINC001207622151 873421499 /nfs/dbraw/zinc/42/14/99/873421499.db2.gz LEVWHIHKQYCZIK-FQEKARNZSA-N 2 2 316.493 1.990 20 10 DDCDLP C[NH+]1CCN(c2ccc(CNC[C@@H]3C[C@H](F)C[NH2+]3)cc2F)CC1 ZINC001348516514 874607514 /nfs/dbraw/zinc/60/75/14/874607514.db2.gz TYEBABSTFDZYNO-GJZGRUSLSA-N 2 2 324.419 1.367 20 10 DDCDLP COCC[N@H+](C)CCC[NH2+][C@H](C)c1cc(C(=O)OC)ccc1O ZINC000273297517 408144677 /nfs/dbraw/zinc/14/46/77/408144677.db2.gz ALZTVDCAJPDARN-CYBMUJFWSA-N 2 2 324.421 1.798 20 10 DDCDLP COCC[N@@H+](C)CCC[NH2+][C@H](C)c1cc(C(=O)OC)ccc1O ZINC000273297517 408144685 /nfs/dbraw/zinc/14/46/85/408144685.db2.gz ALZTVDCAJPDARN-CYBMUJFWSA-N 2 2 324.421 1.798 20 10 DDCDLP C[C@@H]([NH2+]CC(=O)N1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000765416857 701010881 /nfs/dbraw/zinc/01/08/81/701010881.db2.gz MZJBWZGGTNOQGJ-CQSZACIVSA-N 2 2 304.438 1.177 20 10 DDCDLP Cc1nn(C)c(C)c1C[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841042880 702320655 /nfs/dbraw/zinc/32/06/55/702320655.db2.gz MLWNAIPVYWDKKF-KRWDZBQOSA-N 2 2 301.438 1.893 20 10 DDCDLP C[C@H]1CC[NH2+]C[C@@H]1[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000841059865 702330325 /nfs/dbraw/zinc/33/03/25/702330325.db2.gz YFLKHIZQKNHLDD-BBRMVZONSA-N 2 2 307.413 1.750 20 10 DDCDLP COc1ccc(N2CCC[N@H+](C[C@H]3C[NH2+]CCO3)CC2)cc1 ZINC000852746577 704112582 /nfs/dbraw/zinc/11/25/82/704112582.db2.gz ONQMJTZRBJHUHC-QGZVFWFLSA-N 2 2 305.422 1.196 20 10 DDCDLP COc1ccc(N2CCC[N@@H+](C[C@H]3C[NH2+]CCO3)CC2)cc1 ZINC000852746577 704112585 /nfs/dbraw/zinc/11/25/85/704112585.db2.gz ONQMJTZRBJHUHC-QGZVFWFLSA-N 2 2 305.422 1.196 20 10 DDCDLP CN(C)c1ccc(C[NH2+]Cc2nc(C[NH3+])cc(=O)[nH]2)cc1F ZINC000863648154 705976242 /nfs/dbraw/zinc/97/62/42/705976242.db2.gz LMYLYEPRAJROKY-UHFFFAOYSA-N 2 2 305.357 1.136 20 10 DDCDLP C[C@@H](Cn1cc[nH+]c1)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001199208617 747742507 /nfs/dbraw/zinc/74/25/07/747742507.db2.gz REJRIKPNLYWVIN-INIZCTEOSA-N 3 2 313.449 1.813 20 10 DDCDLP Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CC(=O)N1CC[NH+](C)CC1 ZINC001325338996 867954636 /nfs/dbraw/zinc/95/46/36/867954636.db2.gz FTTCXDNHKZKKSP-UONOGXRCSA-N 2 2 317.433 1.613 20 10 DDCDLP CC(C)(C)c1ccc(C[N@@H+]2CCN3CC[NH2+]C[C@H]3C2)c(O)c1 ZINC001234978382 888288690 /nfs/dbraw/zinc/28/86/90/888288690.db2.gz KIXULHNYOWQZHF-INIZCTEOSA-N 2 2 303.450 1.779 20 10 DDCDLP CC(C)(C)c1ccc(C[N@H+]2CCN3CC[NH2+]C[C@H]3C2)c(O)c1 ZINC001234978382 888288705 /nfs/dbraw/zinc/28/87/05/888288705.db2.gz KIXULHNYOWQZHF-INIZCTEOSA-N 2 2 303.450 1.779 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H]4C[C@@]4([NH3+])C3)cc2)CC1 ZINC001235159317 888446429 /nfs/dbraw/zinc/44/64/29/888446429.db2.gz IGNMSTPUEOEHCV-FUHWJXTLSA-N 3 2 300.450 1.362 20 10 DDCDLP CCOC(=O)[C@]12C[N@H+](Cc3ccc(O)c(O)c3)C[C@H]1C[NH2+]CC2 ZINC001236038824 889074834 /nfs/dbraw/zinc/07/48/34/889074834.db2.gz UATZDJHOBGMPTH-CXAGYDPISA-N 2 2 320.389 1.072 20 10 DDCDLP CCOC(=O)[C@]12C[N@@H+](Cc3ccc(O)c(O)c3)C[C@H]1C[NH2+]CC2 ZINC001236038824 889074847 /nfs/dbraw/zinc/07/48/47/889074847.db2.gz UATZDJHOBGMPTH-CXAGYDPISA-N 2 2 320.389 1.072 20 10 DDCDLP C[C@H]([NH3+])C[N@@H+](C)Cc1ccc(I)cc1O ZINC001236903483 889412139 /nfs/dbraw/zinc/41/21/39/889412139.db2.gz DMIXGCNUUNIPCO-QMMMGPOBSA-N 2 2 320.174 1.776 20 10 DDCDLP COCCOC1C[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000779432542 698423057 /nfs/dbraw/zinc/42/30/57/698423057.db2.gz UQEQTXZMAHRTCS-UHFFFAOYSA-N 2 2 319.449 1.286 20 10 DDCDLP C[C@@H]1CC[NH2+]C[C@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000817894520 702511939 /nfs/dbraw/zinc/51/19/39/702511939.db2.gz LUHYDFVEVRMUHM-CXAGYDPISA-N 2 2 321.440 1.874 20 10 DDCDLP CC[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)CC[C@@H]1[NH3+] ZINC000843051044 702808471 /nfs/dbraw/zinc/80/84/71/702808471.db2.gz UFLQLAXAAAPHMU-JQWIXIFHSA-N 2 2 309.366 1.868 20 10 DDCDLP CC[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)CC[C@@H]1[NH3+] ZINC000843051044 702808472 /nfs/dbraw/zinc/80/84/72/702808472.db2.gz UFLQLAXAAAPHMU-JQWIXIFHSA-N 2 2 309.366 1.868 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)ccc1[N+](=O)[O-] ZINC000843119358 702823029 /nfs/dbraw/zinc/82/30/29/702823029.db2.gz ZNBKVTVPFTXBDW-MRXNPFEDSA-N 2 2 321.377 1.885 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@]3(C2)CCC[NH2+]C3)ccc1[N+](=O)[O-] ZINC000843119358 702823032 /nfs/dbraw/zinc/82/30/32/702823032.db2.gz ZNBKVTVPFTXBDW-MRXNPFEDSA-N 2 2 321.377 1.885 20 10 DDCDLP C[C@@H]1C[N@H+](CC(=O)NCc2ccc(N(C)C)cc2)CC[C@H]1[NH3+] ZINC000844219909 702995108 /nfs/dbraw/zinc/99/51/08/702995108.db2.gz OKVOJBQRRRVLFH-CZUORRHYSA-N 2 2 304.438 1.038 20 10 DDCDLP C[C@@H]1C[N@@H+](CC(=O)NCc2ccc(N(C)C)cc2)CC[C@H]1[NH3+] ZINC000844219909 702995109 /nfs/dbraw/zinc/99/51/09/702995109.db2.gz OKVOJBQRRRVLFH-CZUORRHYSA-N 2 2 304.438 1.038 20 10 DDCDLP CC[N@H+](C)C[C@@H](O)C[NH+](C)CCN(C)c1ccc(OC)cc1 ZINC000847007304 703364876 /nfs/dbraw/zinc/36/48/76/703364876.db2.gz DKXLGRGNDCKVMF-MRXNPFEDSA-N 2 2 309.454 1.376 20 10 DDCDLP CC[N@@H+](C)C[C@@H](O)C[NH+](C)CCN(C)c1ccc(OC)cc1 ZINC000847007304 703364878 /nfs/dbraw/zinc/36/48/78/703364878.db2.gz DKXLGRGNDCKVMF-MRXNPFEDSA-N 2 2 309.454 1.376 20 10 DDCDLP CC[NH+](C)C[C@@H](O)C[N@H+](C)CCN(C)c1ccc(OC)cc1 ZINC000847007304 703364880 /nfs/dbraw/zinc/36/48/80/703364880.db2.gz DKXLGRGNDCKVMF-MRXNPFEDSA-N 2 2 309.454 1.376 20 10 DDCDLP CC[NH+](C)C[C@@H](O)C[N@@H+](C)CCN(C)c1ccc(OC)cc1 ZINC000847007304 703364881 /nfs/dbraw/zinc/36/48/81/703364881.db2.gz DKXLGRGNDCKVMF-MRXNPFEDSA-N 2 2 309.454 1.376 20 10 DDCDLP COc1ccc(N2CC[C@@H](C[NH2+][C@H]3C[NH2+]CCOC3)C2)cc1 ZINC000925706327 714918324 /nfs/dbraw/zinc/91/83/24/714918324.db2.gz NKHVHWZKABGIGE-GJZGRUSLSA-N 2 2 305.422 1.100 20 10 DDCDLP Cc1cccc(C[NH+]2CC3(CN(CCn4cc[nH+]c4)C3)C2)c1O ZINC001276080236 854712848 /nfs/dbraw/zinc/71/28/48/854712848.db2.gz KZKQWYMLJSQYNR-UHFFFAOYSA-N 2 2 312.417 1.715 20 10 DDCDLP COc1cc(C[N@@H+]2CC[C@@](F)(CO)C2)cc(C[NH+](C)C)c1O ZINC001139253380 860337419 /nfs/dbraw/zinc/33/74/19/860337419.db2.gz SWSITPRRXSGFOW-INIZCTEOSA-N 2 2 312.385 1.369 20 10 DDCDLP COc1cc(C[N@H+]2CC[C@@](F)(CO)C2)cc(C[NH+](C)C)c1O ZINC001139253380 860337427 /nfs/dbraw/zinc/33/74/27/860337427.db2.gz SWSITPRRXSGFOW-INIZCTEOSA-N 2 2 312.385 1.369 20 10 DDCDLP COc1ccc(C[NH2+]C[C@@H]2C[N@@H+]3CCC[C@H]3CO2)c(O)c1OC ZINC001334168161 867348654 /nfs/dbraw/zinc/34/86/54/867348654.db2.gz JHQKOOQHZYCBKD-UONOGXRCSA-N 2 2 322.405 1.362 20 10 DDCDLP COc1ccc(C[NH2+]C[C@@H]2C[N@H+]3CCC[C@H]3CO2)c(O)c1OC ZINC001334168161 867348666 /nfs/dbraw/zinc/34/86/66/867348666.db2.gz JHQKOOQHZYCBKD-UONOGXRCSA-N 2 2 322.405 1.362 20 10 DDCDLP COc1cc(O)c(C[NH2+][C@H](C)[C@H]2C[N@H+](C)CCN2C)cc1OC ZINC001308949000 871537201 /nfs/dbraw/zinc/53/72/01/871537201.db2.gz VVHMVNTVYAHOEX-TZMCWYRMSA-N 2 2 323.437 1.133 20 10 DDCDLP COc1cc(O)c(C[NH2+][C@H](C)[C@H]2C[N@@H+](C)CCN2C)cc1OC ZINC001308949000 871537218 /nfs/dbraw/zinc/53/72/18/871537218.db2.gz VVHMVNTVYAHOEX-TZMCWYRMSA-N 2 2 323.437 1.133 20 10 DDCDLP Cc1cc(C[N@@H+]2C[C@H](O)[C@@H](C[NH3+])C2)c(O)cc1Br ZINC001206540783 872428011 /nfs/dbraw/zinc/42/80/11/872428011.db2.gz CXFIDECMEQNEMV-GWCFXTLKSA-N 2 2 315.211 1.215 20 10 DDCDLP Cc1cc(C[N@H+]2C[C@H](O)[C@@H](C[NH3+])C2)c(O)cc1Br ZINC001206540783 872428025 /nfs/dbraw/zinc/42/80/25/872428025.db2.gz CXFIDECMEQNEMV-GWCFXTLKSA-N 2 2 315.211 1.215 20 10 DDCDLP C[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)[C@H]1C[N@H+](C)CCN1C ZINC001207622153 873421141 /nfs/dbraw/zinc/42/11/41/873421141.db2.gz LEVWHIHKQYCZIK-NTWLCTACSA-N 2 2 316.493 1.990 20 10 DDCDLP C[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)[C@H]1C[N@@H+](C)CCN1C ZINC001207622153 873421151 /nfs/dbraw/zinc/42/11/51/873421151.db2.gz LEVWHIHKQYCZIK-NTWLCTACSA-N 2 2 316.493 1.990 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@H]4CC[C@@H](C3)O4)c(F)c2)CC1 ZINC001236931339 889427405 /nfs/dbraw/zinc/42/74/05/889427405.db2.gz JHVUYWZPWHZFFC-CALCHBBNSA-N 2 2 319.424 1.941 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@H]4CC[C@@H](C3)O4)c(F)c2)CC1 ZINC001236931339 889427413 /nfs/dbraw/zinc/42/74/13/889427413.db2.gz JHVUYWZPWHZFFC-CALCHBBNSA-N 2 2 319.424 1.941 20 10 DDCDLP COc1ccc(N2CC[NH+]([C@H]3CC[NH2+][C@@H](C)C3)CC2)c(OC)c1 ZINC001246946114 893009258 /nfs/dbraw/zinc/00/92/58/893009258.db2.gz FYORKNRJJJEXCJ-GJZGRUSLSA-N 2 2 319.449 1.966 20 10 DDCDLP COc1ccc(C[NH2+][C@H](C)CNC(=O)Cn2cc[nH+]c2)cc1C ZINC001265873717 902525106 /nfs/dbraw/zinc/52/51/06/902525106.db2.gz ZOMASGIZFGNAFE-CQSZACIVSA-N 2 2 316.405 1.495 20 10 DDCDLP CCN(CC)c1ccc(C[NH2+]C[C@@H]2C[N@H+](C)CCN2C)cc1 ZINC000264769356 222335500 /nfs/dbraw/zinc/33/55/00/222335500.db2.gz QWYCCBZNBYKJBI-GOSISDBHSA-N 2 2 304.482 1.868 20 10 DDCDLP CCN(CC)c1ccc(C[NH2+]C[C@@H]2C[N@@H+](C)CCN2C)cc1 ZINC000264769356 222335507 /nfs/dbraw/zinc/33/55/07/222335507.db2.gz QWYCCBZNBYKJBI-GOSISDBHSA-N 2 2 304.482 1.868 20 10 DDCDLP C[N@H+](CCCn1cc[nH+]c1)Cc1cc2c(cc1O)OC[C@@H]2O ZINC000768464133 701180050 /nfs/dbraw/zinc/18/00/50/701180050.db2.gz ZZDCLQAIBQXJRP-HNNXBMFYSA-N 2 2 303.362 1.537 20 10 DDCDLP C[N@@H+](CCCn1cc[nH+]c1)Cc1cc2c(cc1O)OC[C@@H]2O ZINC000768464133 701180051 /nfs/dbraw/zinc/18/00/51/701180051.db2.gz ZZDCLQAIBQXJRP-HNNXBMFYSA-N 2 2 303.362 1.537 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCO[C@@H](CF)C3)cc2)CC1 ZINC000840954620 702292624 /nfs/dbraw/zinc/29/26/24/702292624.db2.gz LJNYIYGPIMJKKL-KRWDZBQOSA-N 2 2 307.413 1.609 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCO[C@@H](CF)C3)cc2)CC1 ZINC000840954620 702292627 /nfs/dbraw/zinc/29/26/27/702292627.db2.gz LJNYIYGPIMJKKL-KRWDZBQOSA-N 2 2 307.413 1.609 20 10 DDCDLP Cc1cc(N(C)C)ccc1C[NH2+][C@H](C1CC1)[C@@H]1C[NH2+]CCO1 ZINC000817895267 702512095 /nfs/dbraw/zinc/51/20/95/702512095.db2.gz WMDQKXCFVNGJRE-ZWKOTPCHSA-N 2 2 303.450 1.918 20 10 DDCDLP COC[C@@]1(C[NH2+][C@H](C)c2cc(C(=O)OC)ccc2O)CCC[NH2+]1 ZINC000817974202 702541065 /nfs/dbraw/zinc/54/10/65/702541065.db2.gz JIPHSEKISFQNIG-PXAZEXFGSA-N 2 2 322.405 1.598 20 10 DDCDLP COc1ccc(N2CC[NH+](CCC[NH2+]C[C@H](C)O)CC2)cc1 ZINC000818942889 704031616 /nfs/dbraw/zinc/03/16/16/704031616.db2.gz LTQXLQOKWCYGKD-HNNXBMFYSA-N 2 2 307.438 1.178 20 10 DDCDLP C[NH2+]C[C@@H](C)[NH2+]Cc1cc(Br)cc(OC)c1O ZINC000853248511 704224613 /nfs/dbraw/zinc/22/46/13/704224613.db2.gz HDVOMDLDLPWJSF-MRVPVSSYSA-N 2 2 303.200 1.861 20 10 DDCDLP Oc1cc2c(cc1C[NH+]1CCC([N@@H+]3CC[C@@H](O)C3)CC1)OCO2 ZINC000827699094 706052109 /nfs/dbraw/zinc/05/21/09/706052109.db2.gz DYTUWNAXTPZJLM-CQSZACIVSA-N 2 2 320.389 1.152 20 10 DDCDLP Oc1cc2c(cc1C[NH+]1CCC([N@H+]3CC[C@@H](O)C3)CC1)OCO2 ZINC000827699094 706052112 /nfs/dbraw/zinc/05/21/12/706052112.db2.gz DYTUWNAXTPZJLM-CQSZACIVSA-N 2 2 320.389 1.152 20 10 DDCDLP C[C@H]1[NH2+]CCC[C@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000925715718 714920048 /nfs/dbraw/zinc/92/00/48/714920048.db2.gz LJMCZFITAARURJ-RDTXWAMCSA-N 2 2 303.450 1.878 20 10 DDCDLP COc1cc(C[N@H+](C)C2CC[NH+](C)CC2)cc(C[NH+](C)C)c1O ZINC001139253034 757191771 /nfs/dbraw/zinc/19/17/71/757191771.db2.gz JFXXRUNAWNCNDJ-UHFFFAOYSA-N 3 2 321.465 1.988 20 10 DDCDLP COc1cc(C[N@@H+](C)C2CC[NH+](C)CC2)cc(C[NH+](C)C)c1O ZINC001139253034 757191774 /nfs/dbraw/zinc/19/17/74/757191774.db2.gz JFXXRUNAWNCNDJ-UHFFFAOYSA-N 3 2 321.465 1.988 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+]C3CC[NH2+]CC3)cc2F)CC1 ZINC001117953929 780961980 /nfs/dbraw/zinc/96/19/80/780961980.db2.gz UITRSCDRANBQIM-UHFFFAOYSA-N 2 2 306.429 1.419 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@](C)(C[NH3+])C3)cc2F)CC1 ZINC001326520177 861422259 /nfs/dbraw/zinc/42/22/59/861422259.db2.gz XZZZEYWOHYOETF-GOSISDBHSA-N 3 2 320.456 1.748 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@](C)(C[NH3+])C3)cc2F)CC1 ZINC001326520177 861422265 /nfs/dbraw/zinc/42/22/65/861422265.db2.gz XZZZEYWOHYOETF-GOSISDBHSA-N 3 2 320.456 1.748 20 10 DDCDLP CN1CCN(c2ccc(C[N@@H+]3CC[C@](C)(C[NH3+])C3)cc2F)CC1 ZINC001326520177 861422271 /nfs/dbraw/zinc/42/22/71/861422271.db2.gz XZZZEYWOHYOETF-GOSISDBHSA-N 2 2 320.456 1.748 20 10 DDCDLP CN1CCN(c2ccc(C[N@H+]3CC[C@](C)(C[NH3+])C3)cc2F)CC1 ZINC001326520177 861422277 /nfs/dbraw/zinc/42/22/77/861422277.db2.gz XZZZEYWOHYOETF-GOSISDBHSA-N 2 2 320.456 1.748 20 10 DDCDLP [NH3+][C@]12CC[C@@H]1C[N@H+](Cc1ccc(N3CCC(O)CC3)cc1)C2 ZINC001235998390 889052148 /nfs/dbraw/zinc/05/21/48/889052148.db2.gz YINJRXBEWCRYMS-QAPCUYQASA-N 2 2 301.434 1.571 20 10 DDCDLP [NH3+][C@]12CC[C@@H]1C[N@@H+](Cc1ccc(N3CCC(O)CC3)cc1)C2 ZINC001235998390 889052166 /nfs/dbraw/zinc/05/21/66/889052166.db2.gz YINJRXBEWCRYMS-QAPCUYQASA-N 2 2 301.434 1.571 20 10 DDCDLP COc1cc(O)c(C[N@@H+](C)C[C@H](C)[NH3+])cc1Br ZINC001236903498 889412852 /nfs/dbraw/zinc/41/28/52/889412852.db2.gz DTHVOFUNRCCKCM-QMMMGPOBSA-N 2 2 303.200 1.942 20 10 DDCDLP COc1c(O)c(C[NH2+]C[C@@H]2CCC[N@H+](C)C2)ccc1[N+](=O)[O-] ZINC000775010846 697953738 /nfs/dbraw/zinc/95/37/38/697953738.db2.gz FYEHJHDAZWUURS-NSHDSACASA-N 2 2 309.366 1.740 20 10 DDCDLP COc1c(O)c(C[NH2+]C[C@@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000775010846 697953741 /nfs/dbraw/zinc/95/37/41/697953741.db2.gz FYEHJHDAZWUURS-NSHDSACASA-N 2 2 309.366 1.740 20 10 DDCDLP [NH3+]Cc1cn([C@H]2CCC[N@H+](Cc3cccc(Cl)c3O)C2)nn1 ZINC000841099342 702345830 /nfs/dbraw/zinc/34/58/30/702345830.db2.gz IIACAZOAVMURDB-ZDUSSCGKSA-N 2 2 321.812 1.933 20 10 DDCDLP [NH3+]Cc1cn([C@H]2CCC[N@@H+](Cc3cccc(Cl)c3O)C2)nn1 ZINC000841099342 702345838 /nfs/dbraw/zinc/34/58/38/702345838.db2.gz IIACAZOAVMURDB-ZDUSSCGKSA-N 2 2 321.812 1.933 20 10 DDCDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CCCO2)c1 ZINC000817981566 702542565 /nfs/dbraw/zinc/54/25/65/702542565.db2.gz LFYKRYYJTVOVDH-YPMHNXCESA-N 2 2 308.378 1.208 20 10 DDCDLP Cc1cc(O)c(C[N@H+]2C[C@@H](c3cnn(C)c3)[C@H]([NH3+])C2)cc1C ZINC000818430984 702647546 /nfs/dbraw/zinc/64/75/46/702647546.db2.gz COWNCXDPOOPMCT-JKSUJKDBSA-N 2 2 300.406 1.669 20 10 DDCDLP Cc1cc(O)c(C[N@@H+]2C[C@@H](c3cnn(C)c3)[C@H]([NH3+])C2)cc1C ZINC000818430984 702647549 /nfs/dbraw/zinc/64/75/49/702647549.db2.gz COWNCXDPOOPMCT-JKSUJKDBSA-N 2 2 300.406 1.669 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@]3(CC[NH2+]C3)C2)ccc1[N+](=O)[O-] ZINC000843120319 702823412 /nfs/dbraw/zinc/82/34/12/702823412.db2.gz FHZLSGJRXXPLFF-HNNXBMFYSA-N 2 2 307.350 1.494 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@]3(CC[NH2+]C3)C2)ccc1[N+](=O)[O-] ZINC000843120319 702823414 /nfs/dbraw/zinc/82/34/14/702823414.db2.gz FHZLSGJRXXPLFF-HNNXBMFYSA-N 2 2 307.350 1.494 20 10 DDCDLP COc1ccc(N2CC[C@H]([NH2+][C@@H](C)C[C@H]3COCC[NH2+]3)C2)cc1 ZINC000854216718 704367500 /nfs/dbraw/zinc/36/75/00/704367500.db2.gz DHRYTJMZQQWIRA-JYJNAYRXSA-N 2 2 319.449 1.631 20 10 DDCDLP CC[C@@H]1[NH2+]CC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000863482127 705937789 /nfs/dbraw/zinc/93/77/89/705937789.db2.gz UKYMIYVKFIDHJN-ZWKOTPCHSA-N 3 2 302.466 1.669 20 10 DDCDLP [NH3+]C1(C[NH2+]Cc2cccc(Br)c2O)CCOCC1 ZINC000863481647 705937804 /nfs/dbraw/zinc/93/78/04/705937804.db2.gz LFSYDFYZFIKYLS-UHFFFAOYSA-N 2 2 315.211 1.752 20 10 DDCDLP CCOc1ccc(C[NH+]2CCC([N@@H+]3CC[C@@H](O)C3)CC2)c(O)c1 ZINC000827699106 706052121 /nfs/dbraw/zinc/05/21/21/706052121.db2.gz FASDGJMRPIFDKA-MRXNPFEDSA-N 2 2 320.433 1.822 20 10 DDCDLP CCOc1ccc(C[NH+]2CCC([N@H+]3CC[C@@H](O)C3)CC2)c(O)c1 ZINC000827699106 706052123 /nfs/dbraw/zinc/05/21/23/706052123.db2.gz FASDGJMRPIFDKA-MRXNPFEDSA-N 2 2 320.433 1.822 20 10 DDCDLP NC(=O)[C@@H]1CCC[N@@H+]1CCC[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000922285388 714011910 /nfs/dbraw/zinc/01/19/10/714011910.db2.gz BJNJJNHBFSLPKD-INIZCTEOSA-N 2 2 317.433 1.441 20 10 DDCDLP NC(=O)[C@@H]1CCC[N@H+]1CCC[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000922285388 714011913 /nfs/dbraw/zinc/01/19/13/714011913.db2.gz BJNJJNHBFSLPKD-INIZCTEOSA-N 2 2 317.433 1.441 20 10 DDCDLP C[C@@H]1CC(=O)CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139408464 759411779 /nfs/dbraw/zinc/41/17/79/759411779.db2.gz MTPRBROZKIEFFB-OAHLLOKOSA-N 2 2 301.434 1.992 20 10 DDCDLP C[C@@H]1CC(=O)CC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139408464 759411785 /nfs/dbraw/zinc/41/17/85/759411785.db2.gz MTPRBROZKIEFFB-OAHLLOKOSA-N 2 2 301.434 1.992 20 10 DDCDLP COc1cc(C[N@H+](C)Cc2cncnc2)cc(C[NH+](C)C)c1O ZINC001139260012 860340315 /nfs/dbraw/zinc/34/03/15/860340315.db2.gz HQBSJICEIULJOM-UHFFFAOYSA-N 2 2 316.405 1.884 20 10 DDCDLP COc1cc(C[N@@H+](C)Cc2cncnc2)cc(C[NH+](C)C)c1O ZINC001139260012 860340319 /nfs/dbraw/zinc/34/03/19/860340319.db2.gz HQBSJICEIULJOM-UHFFFAOYSA-N 2 2 316.405 1.884 20 10 DDCDLP [NH3+]C[C@H]1CCCC[N@@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001204932479 871292139 /nfs/dbraw/zinc/29/21/39/871292139.db2.gz KBPCBWBAQHTUEJ-MRXNPFEDSA-N 3 2 304.438 1.115 20 10 DDCDLP [NH3+]C[C@H]1CCCC[N@H+]1Cc1ccc(N2CC[NH2+]CC2)cc1O ZINC001204932479 871292158 /nfs/dbraw/zinc/29/21/58/871292158.db2.gz KBPCBWBAQHTUEJ-MRXNPFEDSA-N 3 2 304.438 1.115 20 10 DDCDLP C[C@H]1C[N@H+](Cc2cc(F)ccc2O)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000368605839 418723148 /nfs/dbraw/zinc/72/31/48/418723148.db2.gz ZFKJRVBKCRHHDP-YOEHRIQHSA-N 2 2 321.440 1.989 20 10 DDCDLP C[C@H]1C[N@@H+](Cc2cc(F)ccc2O)CC[C@@H]1N1CC[NH+](C)CC1 ZINC000368605839 418723150 /nfs/dbraw/zinc/72/31/50/418723150.db2.gz ZFKJRVBKCRHHDP-YOEHRIQHSA-N 2 2 321.440 1.989 20 10 DDCDLP C[C@H](C[NH2+][C@@H](C)c1cc(F)cc(F)c1O)N1CC[NH+](C)CC1 ZINC000756544601 700626847 /nfs/dbraw/zinc/62/68/47/700626847.db2.gz KLGDSIJNERTZTF-NEPJUHHUSA-N 2 2 313.392 1.957 20 10 DDCDLP COC(=O)c1ccc(C[NH2+]C[C@H]([NH3+])c2ccc(N(C)C)cc2)[nH]1 ZINC000841041696 702319771 /nfs/dbraw/zinc/31/97/71/702319771.db2.gz AGQORKDRYYWBIS-HNNXBMFYSA-N 2 2 316.405 1.657 20 10 DDCDLP CC[NH+]1CCN(C(=O)[C@H](C)[NH2+][C@@H](C)c2ccccc2O)CC1 ZINC000879652225 706750259 /nfs/dbraw/zinc/75/02/59/706750259.db2.gz XIMLTFGERARKRF-KBPBESRZSA-N 2 2 305.422 1.595 20 10 DDCDLP C[C@H]([NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1)c1c(O)cccc1F ZINC000886524908 708773244 /nfs/dbraw/zinc/77/32/44/708773244.db2.gz TXYYIIWEINGXMN-STQMWFEESA-N 2 2 323.412 1.769 20 10 DDCDLP C[C@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1c(O)cccc1F ZINC000886524908 708773245 /nfs/dbraw/zinc/77/32/45/708773245.db2.gz TXYYIIWEINGXMN-STQMWFEESA-N 2 2 323.412 1.769 20 10 DDCDLP CN(C)C(=O)C[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001341523874 871692775 /nfs/dbraw/zinc/69/27/75/871692775.db2.gz LUZDUBNWSUAKLJ-UHFFFAOYSA-N 2 2 322.428 1.098 20 10 DDCDLP CN(C)C(=O)C[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001341523874 871692786 /nfs/dbraw/zinc/69/27/86/871692786.db2.gz LUZDUBNWSUAKLJ-UHFFFAOYSA-N 2 2 322.428 1.098 20 10 DDCDLP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@]12CCC[NH2+]C2 ZINC001222198607 880324041 /nfs/dbraw/zinc/32/40/41/880324041.db2.gz XRIOTLOGXCBORN-SFHVURJKSA-N 3 2 316.449 1.130 20 10 DDCDLP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CC[C@]12CCC[NH2+]C2 ZINC001222198607 880324049 /nfs/dbraw/zinc/32/40/49/880324049.db2.gz XRIOTLOGXCBORN-SFHVURJKSA-N 3 2 316.449 1.130 20 10 DDCDLP C[N@H+](CCCO)C1CC[NH+](Cc2cc3c(cc2O)OCO3)CC1 ZINC000093412973 696600802 /nfs/dbraw/zinc/60/08/02/696600802.db2.gz GAVBYWVOIVGIDR-UHFFFAOYSA-N 2 2 322.405 1.400 20 10 DDCDLP C[N@@H+](CCCO)C1CC[NH+](Cc2cc3c(cc2O)OCO3)CC1 ZINC000093412973 696600804 /nfs/dbraw/zinc/60/08/04/696600804.db2.gz GAVBYWVOIVGIDR-UHFFFAOYSA-N 2 2 322.405 1.400 20 10 DDCDLP CC[NH+]1CCN(C(=O)[C@@H](C)[N@H+](C)Cc2ccccc2O)CC1 ZINC000111235939 696642914 /nfs/dbraw/zinc/64/29/14/696642914.db2.gz QOPBUFABRRWRJD-CQSZACIVSA-N 2 2 305.422 1.377 20 10 DDCDLP CC[NH+]1CCN(C(=O)[C@@H](C)[N@@H+](C)Cc2ccccc2O)CC1 ZINC000111235939 696642916 /nfs/dbraw/zinc/64/29/16/696642916.db2.gz QOPBUFABRRWRJD-CQSZACIVSA-N 2 2 305.422 1.377 20 10 DDCDLP CCOc1ccc(O)c(C[N@H+](CCO)C2CC[NH+](C)CC2)c1 ZINC000305212885 698641670 /nfs/dbraw/zinc/64/16/70/698641670.db2.gz QFKRPCBCKSLHQM-UHFFFAOYSA-N 2 2 308.422 1.679 20 10 DDCDLP CCOc1ccc(O)c(C[N@@H+](CCO)C2CC[NH+](C)CC2)c1 ZINC000305212885 698641673 /nfs/dbraw/zinc/64/16/73/698641673.db2.gz QFKRPCBCKSLHQM-UHFFFAOYSA-N 2 2 308.422 1.679 20 10 DDCDLP C[C@H]([NH2+]CC(=O)N1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000756491301 700623859 /nfs/dbraw/zinc/62/38/59/700623859.db2.gz UUYZESFXYIDDFD-NSHDSACASA-N 2 2 311.813 1.470 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCCC[NH2+]C3)cc2)CC1 ZINC000841091338 702342134 /nfs/dbraw/zinc/34/21/34/702342134.db2.gz VQOSNOMWVMIDLU-KRWDZBQOSA-N 3 2 302.466 1.670 20 10 DDCDLP Fc1cc(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)ccc1N1CCOCC1 ZINC000843126998 702825574 /nfs/dbraw/zinc/82/55/74/702825574.db2.gz NTEWNNYEOOCMQT-RDJZCZTQSA-N 2 2 319.424 1.846 20 10 DDCDLP Fc1cc(C[N@H+]2CC[C@@H]3[NH2+]CC[C@H]3C2)ccc1N1CCOCC1 ZINC000843126998 702825576 /nfs/dbraw/zinc/82/55/76/702825576.db2.gz NTEWNNYEOOCMQT-RDJZCZTQSA-N 2 2 319.424 1.846 20 10 DDCDLP COc1cccc([C@H](C)[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)c1O ZINC000858468351 704715271 /nfs/dbraw/zinc/71/52/71/704715271.db2.gz FBJJEECREUFAPW-JSGCOSHPSA-N 2 2 321.421 1.391 20 10 DDCDLP COc1cccc([C@H](C)[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c1O ZINC000858468351 704715273 /nfs/dbraw/zinc/71/52/73/704715273.db2.gz FBJJEECREUFAPW-JSGCOSHPSA-N 2 2 321.421 1.391 20 10 DDCDLP Cc1ccc(C[NH2+][C@H]2CCN(CC[NH+]3CCOCC3)C2)c(O)c1 ZINC000877032068 705966587 /nfs/dbraw/zinc/96/65/87/705966587.db2.gz YFJYZDYRJUGKOF-KRWDZBQOSA-N 2 2 319.449 1.197 20 10 DDCDLP CCOc1ccc(O)c(C[NH+]2CCC([N@@H+]3CC[C@@H](O)C3)CC2)c1 ZINC000827699498 706052057 /nfs/dbraw/zinc/05/20/57/706052057.db2.gz ICRUWDHIPAEVCR-MRXNPFEDSA-N 2 2 320.433 1.822 20 10 DDCDLP CCOc1ccc(O)c(C[NH+]2CCC([N@H+]3CC[C@@H](O)C3)CC2)c1 ZINC000827699498 706052059 /nfs/dbraw/zinc/05/20/59/706052059.db2.gz ICRUWDHIPAEVCR-MRXNPFEDSA-N 2 2 320.433 1.822 20 10 DDCDLP CO[C@H]1C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CCO1 ZINC000895968110 711657843 /nfs/dbraw/zinc/65/78/43/711657843.db2.gz HQDDBKCQBRKQAU-QGZVFWFLSA-N 2 2 305.422 1.243 20 10 DDCDLP CO[C@H]1C[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CCO1 ZINC000895968110 711657844 /nfs/dbraw/zinc/65/78/44/711657844.db2.gz HQDDBKCQBRKQAU-QGZVFWFLSA-N 2 2 305.422 1.243 20 10 DDCDLP Oc1cccc(F)c1C[NH+]1CCN(CC[NH+]2CCCC2)CC1 ZINC001137838716 751829376 /nfs/dbraw/zinc/82/93/76/751829376.db2.gz IPGGAUDVYBRZBK-UHFFFAOYSA-N 2 2 307.413 1.745 20 10 DDCDLP [NH3+]C[C@@]1(O)CCC[N@H+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC001205247874 751330522 /nfs/dbraw/zinc/33/05/22/751330522.db2.gz KKYCCAOWXHMTFG-CQSZACIVSA-N 2 2 302.777 1.860 20 10 DDCDLP [NH3+]C[C@@]1(O)CCC[N@@H+](Cc2cc(Cl)cc(F)c2O)CC1 ZINC001205247874 751330528 /nfs/dbraw/zinc/33/05/28/751330528.db2.gz KKYCCAOWXHMTFG-CQSZACIVSA-N 2 2 302.777 1.860 20 10 DDCDLP C[NH+](C)CC(=O)N[C@@H]1CCC[N@H+](Cc2cccc(F)c2O)C1 ZINC001138130989 860013286 /nfs/dbraw/zinc/01/32/86/860013286.db2.gz MWJMAACWHMFCGT-CYBMUJFWSA-N 2 2 309.385 1.174 20 10 DDCDLP C[NH+](C)CC(=O)N[C@@H]1CCC[N@@H+](Cc2cccc(F)c2O)C1 ZINC001138130989 860013303 /nfs/dbraw/zinc/01/33/03/860013303.db2.gz MWJMAACWHMFCGT-CYBMUJFWSA-N 2 2 309.385 1.174 20 10 DDCDLP CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1C[C@H]2C[NH2+]C[C@H]2[NH2+]1 ZINC001161134869 866397439 /nfs/dbraw/zinc/39/74/39/866397439.db2.gz QSRBBFMVBPKABL-BHYGNILZSA-N 2 2 316.449 1.051 20 10 DDCDLP Cc1cc(O)c(C[N@@H+]2C[C@H](O)[C@@H](C[NH3+])C2)cc1Br ZINC001206535885 872422902 /nfs/dbraw/zinc/42/29/02/872422902.db2.gz TWIIETWRCJVATF-GWCFXTLKSA-N 2 2 315.211 1.215 20 10 DDCDLP Cc1cc(O)c(C[N@H+]2C[C@H](O)[C@@H](C[NH3+])C2)cc1Br ZINC001206535885 872422921 /nfs/dbraw/zinc/42/29/21/872422921.db2.gz TWIIETWRCJVATF-GWCFXTLKSA-N 2 2 315.211 1.215 20 10 DDCDLP C[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)[C@H]1C[N@H+](C)CCN1C ZINC001207622146 873421020 /nfs/dbraw/zinc/42/10/20/873421020.db2.gz LEVWHIHKQYCZIK-CIHFUWIRSA-N 2 2 316.493 1.990 20 10 DDCDLP C[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)[C@H]1C[N@@H+](C)CCN1C ZINC001207622146 873421025 /nfs/dbraw/zinc/42/10/25/873421025.db2.gz LEVWHIHKQYCZIK-CIHFUWIRSA-N 2 2 316.493 1.990 20 10 DDCDLP CC[C@H]([NH3+])C[N@H+](C)Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001236869959 889388172 /nfs/dbraw/zinc/38/81/72/889388172.db2.gz ZYRRYFOPMFSAOB-KRWDZBQOSA-N 3 2 304.482 1.998 20 10 DDCDLP CC[C@H]([NH3+])C[N@@H+](C)Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001236869959 889388185 /nfs/dbraw/zinc/38/81/85/889388185.db2.gz ZYRRYFOPMFSAOB-KRWDZBQOSA-N 3 2 304.482 1.998 20 10 DDCDLP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000278880517 409106607 /nfs/dbraw/zinc/10/66/07/409106607.db2.gz OCGCKQZOWJYHOG-NSHDSACASA-N 2 2 309.366 1.740 20 10 DDCDLP CC[N@H+]1CC[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 ZINC000278880517 409106608 /nfs/dbraw/zinc/10/66/08/409106608.db2.gz OCGCKQZOWJYHOG-NSHDSACASA-N 2 2 309.366 1.740 20 10 DDCDLP CC[C@@H]([NH2+]CCC[N@@H+]1CCC[C@@H]1C(N)=O)c1ccc(F)cc1O ZINC000286161826 535803757 /nfs/dbraw/zinc/80/37/57/535803757.db2.gz PWWTVMGTPFZLIP-HUUCEWRRSA-N 2 2 323.412 1.912 20 10 DDCDLP CC[C@@H]([NH2+]CCC[N@H+]1CCC[C@@H]1C(N)=O)c1ccc(F)cc1O ZINC000286161826 535803758 /nfs/dbraw/zinc/80/37/58/535803758.db2.gz PWWTVMGTPFZLIP-HUUCEWRRSA-N 2 2 323.412 1.912 20 10 DDCDLP C[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1cc(F)cc(F)c1O ZINC000756544603 700626683 /nfs/dbraw/zinc/62/66/83/700626683.db2.gz KLGDSIJNERTZTF-NWDGAFQWSA-N 2 2 313.392 1.957 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCC[NH2+]C3)cc2)CC1 ZINC000841091339 702342373 /nfs/dbraw/zinc/34/23/73/702342373.db2.gz VQOSNOMWVMIDLU-QGZVFWFLSA-N 3 2 302.466 1.670 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[N@@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC000841105896 702349210 /nfs/dbraw/zinc/34/92/10/702349210.db2.gz BOFAZBCWOPGONW-GOSISDBHSA-N 2 2 301.434 1.851 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[N@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC000841105896 702349218 /nfs/dbraw/zinc/34/92/18/702349218.db2.gz BOFAZBCWOPGONW-GOSISDBHSA-N 2 2 301.434 1.851 20 10 DDCDLP C[NH2+]C[C@H]1CCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000843056228 702809608 /nfs/dbraw/zinc/80/96/08/702809608.db2.gz WVHJBTFWJIOHHQ-GOSISDBHSA-N 3 2 302.466 1.622 20 10 DDCDLP C[NH2+]C[C@H]1CCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000843056228 702809611 /nfs/dbraw/zinc/80/96/11/702809611.db2.gz WVHJBTFWJIOHHQ-GOSISDBHSA-N 3 2 302.466 1.622 20 10 DDCDLP CCN(CC)c1ccc(CN2CC[N@H+](C)C[C@H]2C[NH3+])cc1F ZINC000843120769 702823444 /nfs/dbraw/zinc/82/34/44/702823444.db2.gz UHKGQCWCSOMZFA-OAHLLOKOSA-N 2 2 308.445 1.747 20 10 DDCDLP CCN(CC)c1ccc(CN2CC[N@@H+](C)C[C@H]2C[NH3+])cc1F ZINC000843120769 702823446 /nfs/dbraw/zinc/82/34/46/702823446.db2.gz UHKGQCWCSOMZFA-OAHLLOKOSA-N 2 2 308.445 1.747 20 10 DDCDLP C[NH2+]C[C@H](C)[NH2+]Cc1cc(Br)cc(OC)c1O ZINC000853248515 704224347 /nfs/dbraw/zinc/22/43/47/704224347.db2.gz HDVOMDLDLPWJSF-QMMMGPOBSA-N 2 2 303.200 1.861 20 10 DDCDLP COc1ccc(N2CC[C@H]([NH2+][C@H](C)C[C@@H]3COCC[NH2+]3)C2)cc1 ZINC000854216719 704367411 /nfs/dbraw/zinc/36/74/11/704367411.db2.gz DHRYTJMZQQWIRA-OWCLPIDISA-N 2 2 319.449 1.631 20 10 DDCDLP OC1CCN(c2ccc(C[N@@H+]3C[C@@H]4CCC[NH2+][C@@H]4C3)cc2)CC1 ZINC000876743319 705853008 /nfs/dbraw/zinc/85/30/08/705853008.db2.gz BORGQFLFIYEFCV-QFBILLFUSA-N 2 2 315.461 1.832 20 10 DDCDLP OC1CCN(c2ccc(C[N@H+]3C[C@@H]4CCC[NH2+][C@@H]4C3)cc2)CC1 ZINC000876743319 705853011 /nfs/dbraw/zinc/85/30/11/705853011.db2.gz BORGQFLFIYEFCV-QFBILLFUSA-N 2 2 315.461 1.832 20 10 DDCDLP C[C@H]1CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C[NH2+]1 ZINC000863484585 705938910 /nfs/dbraw/zinc/93/89/10/705938910.db2.gz JWGULEOVNNNWQH-DOTOQJQBSA-N 3 2 302.466 1.669 20 10 DDCDLP CC[NH+]1CCN([C@H](C)C[NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC000882890321 707839683 /nfs/dbraw/zinc/83/96/83/707839683.db2.gz VIUIKTBGNBURTL-GFCCVEGCSA-N 2 2 313.392 1.786 20 10 DDCDLP C[C@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1cc(F)cc(F)c1O ZINC000883091721 707923831 /nfs/dbraw/zinc/92/38/31/707923831.db2.gz VFEMOBWEWKDRIK-GFCCVEGCSA-N 2 2 313.392 1.786 20 10 DDCDLP C[N@@H+]1CCN(CC[NH2+]Cc2cc(F)cc(F)c2O)CC1(C)C ZINC000883112007 707930451 /nfs/dbraw/zinc/93/04/51/707930451.db2.gz VZVLKAXUKGPCME-UHFFFAOYSA-N 2 2 313.392 1.786 20 10 DDCDLP C[N@H+]1CCN(CC[NH2+]Cc2cc(F)cc(F)c2O)CC1(C)C ZINC000883112007 707930452 /nfs/dbraw/zinc/93/04/52/707930452.db2.gz VZVLKAXUKGPCME-UHFFFAOYSA-N 2 2 313.392 1.786 20 10 DDCDLP COc1ccc(C[NH2+]CCNC(=O)CCc2[nH]cc[nH+]2)cc1C ZINC001126442840 740121354 /nfs/dbraw/zinc/12/13/54/740121354.db2.gz VFXOADXGOZBUPS-UHFFFAOYSA-N 2 2 316.405 1.565 20 10 DDCDLP Oc1cc(O)c(C[NH+]2CC3(C2)CC[N@H+](CC2CC2)C3)c(O)c1 ZINC001144509592 772557272 /nfs/dbraw/zinc/55/72/72/772557272.db2.gz FMWPVJWIJQPSOS-UHFFFAOYSA-N 2 2 304.390 1.721 20 10 DDCDLP Oc1cc(O)c(C[NH+]2CC3(C2)CC[N@@H+](CC2CC2)C3)c(O)c1 ZINC001144509592 772557274 /nfs/dbraw/zinc/55/72/74/772557274.db2.gz FMWPVJWIJQPSOS-UHFFFAOYSA-N 2 2 304.390 1.721 20 10 DDCDLP CCNC(=O)C[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001323304787 866514803 /nfs/dbraw/zinc/51/48/03/866514803.db2.gz WVBHTAGGZRXSSQ-UHFFFAOYSA-N 2 2 322.428 1.145 20 10 DDCDLP CCNC(=O)C[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001323304787 866514819 /nfs/dbraw/zinc/51/48/19/866514819.db2.gz WVBHTAGGZRXSSQ-UHFFFAOYSA-N 2 2 322.428 1.145 20 10 DDCDLP C[C@@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001349673331 875296264 /nfs/dbraw/zinc/29/62/64/875296264.db2.gz DROLQUULOOIVDT-GDBMZVCRSA-N 3 2 320.456 1.889 20 10 DDCDLP C[C@@H]1C[C@H]([NH3+])CC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001349673331 875296277 /nfs/dbraw/zinc/29/62/77/875296277.db2.gz DROLQUULOOIVDT-GDBMZVCRSA-N 3 2 320.456 1.889 20 10 DDCDLP [NH3+][C@@]12CC[C@@H]1C[N@H+](Cc1ccc(N3CCC(O)CC3)cc1)C2 ZINC001235998386 889052098 /nfs/dbraw/zinc/05/20/98/889052098.db2.gz YINJRXBEWCRYMS-CRAIPNDOSA-N 2 2 301.434 1.571 20 10 DDCDLP [NH3+][C@@]12CC[C@@H]1C[N@@H+](Cc1ccc(N3CCC(O)CC3)cc1)C2 ZINC001235998386 889052112 /nfs/dbraw/zinc/05/21/12/889052112.db2.gz YINJRXBEWCRYMS-CRAIPNDOSA-N 2 2 301.434 1.571 20 10 DDCDLP CC[N@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)[C@H]1CCC[NH2+]C1 ZINC001236007433 889058727 /nfs/dbraw/zinc/05/87/27/889058727.db2.gz MKSCCRFEMIXQMG-SFHVURJKSA-N 3 2 302.466 1.670 20 10 DDCDLP CC[N@@H+](Cc1ccc(N2CC[NH2+]CC2)cc1)[C@H]1CCC[NH2+]C1 ZINC001236007433 889058742 /nfs/dbraw/zinc/05/87/42/889058742.db2.gz MKSCCRFEMIXQMG-SFHVURJKSA-N 3 2 302.466 1.670 20 10 DDCDLP COc1cc(Cl)cc(C[NH2+]C[C@H]2C[N@H+](C)CCN2C)c1O ZINC000228674158 407649526 /nfs/dbraw/zinc/64/95/26/407649526.db2.gz XKQHFMZKALCGIF-ZDUSSCGKSA-N 2 2 313.829 1.390 20 10 DDCDLP COc1cc(Cl)cc(C[NH2+]C[C@H]2C[N@@H+](C)CCN2C)c1O ZINC000228674158 407649534 /nfs/dbraw/zinc/64/95/34/407649534.db2.gz XKQHFMZKALCGIF-ZDUSSCGKSA-N 2 2 313.829 1.390 20 10 DDCDLP CCN1CC[NH+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000775639255 698017954 /nfs/dbraw/zinc/01/79/54/698017954.db2.gz ROJKKUOITKGFJG-UHFFFAOYSA-N 2 2 302.466 1.576 20 10 DDCDLP CC[C@@H]([NH2+]CC(=O)N1CC[NH+](C)CC1)c1ccc(N(C)C)cc1 ZINC000765416386 701010886 /nfs/dbraw/zinc/01/08/86/701010886.db2.gz HPGIEOWAZKGBMR-QGZVFWFLSA-N 2 2 318.465 1.567 20 10 DDCDLP CN(C)c1ccc(CN(C)C(=O)C[N@H+](C)CC(C)(C)C[NH3+])cc1 ZINC000844220501 702995418 /nfs/dbraw/zinc/99/54/18/702995418.db2.gz GASXYDSUGGXPTI-UHFFFAOYSA-N 2 2 320.481 1.628 20 10 DDCDLP CN(C)c1ccc(CN(C)C(=O)C[N@@H+](C)CC(C)(C)C[NH3+])cc1 ZINC000844220501 702995420 /nfs/dbraw/zinc/99/54/20/702995420.db2.gz GASXYDSUGGXPTI-UHFFFAOYSA-N 2 2 320.481 1.628 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000863483293 705938463 /nfs/dbraw/zinc/93/84/63/705938463.db2.gz UUHVBHMWYZZVOP-KRWDZBQOSA-N 2 2 301.434 1.897 20 10 DDCDLP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CCOCC3)c(F)c2)C[NH2+]1 ZINC000863485150 705938858 /nfs/dbraw/zinc/93/88/58/705938858.db2.gz VMEQCBHVTKRZCU-HIFRSBDPSA-N 2 2 307.413 1.892 20 10 DDCDLP Cn1cc[nH+]c1N1CC[NH+](Cc2cc3c(cc2O)OCO3)CC1 ZINC000827891150 706082957 /nfs/dbraw/zinc/08/29/57/706082957.db2.gz BIRNGFSKKXRRQF-UHFFFAOYSA-N 2 2 316.361 1.177 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCO[C@H](CO)C3)cc2)CC1 ZINC001140302010 860614612 /nfs/dbraw/zinc/61/46/12/860614612.db2.gz HFJHBGKTZCDZPL-SFHVURJKSA-N 2 2 319.449 1.022 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CCO[C@H](CO)C3)cc2)CC1 ZINC001140302010 860614615 /nfs/dbraw/zinc/61/46/15/860614615.db2.gz HFJHBGKTZCDZPL-SFHVURJKSA-N 2 2 319.449 1.022 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCO[C@@H]4C[C@@H]43)cc2)CC1 ZINC001140309306 860616588 /nfs/dbraw/zinc/61/65/88/860616588.db2.gz APOYIIHMOGMWJH-ZWKOTPCHSA-N 2 2 301.434 1.802 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CCO[C@@H]4C[C@@H]43)cc2)CC1 ZINC001140309306 860616592 /nfs/dbraw/zinc/61/65/92/860616592.db2.gz APOYIIHMOGMWJH-ZWKOTPCHSA-N 2 2 301.434 1.802 20 10 DDCDLP C[NH+]1CCN(c2cccc(NCc3ccc(O)c(O)c3)[nH+]2)CC1 ZINC001158995531 865024187 /nfs/dbraw/zinc/02/41/87/865024187.db2.gz IXQVXHWYWCUVNL-UHFFFAOYSA-N 2 2 314.389 1.857 20 10 DDCDLP Cc1cc(C)c([C@@H](C)[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)c(O)c1 ZINC000284098284 131048839 /nfs/dbraw/zinc/04/88/39/131048839.db2.gz MRBBVRXYDWICCC-CABCVRRESA-N 2 2 319.449 1.999 20 10 DDCDLP Cc1cc(C)c([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c(O)c1 ZINC000284098284 131048842 /nfs/dbraw/zinc/04/88/42/131048842.db2.gz MRBBVRXYDWICCC-CABCVRRESA-N 2 2 319.449 1.999 20 10 DDCDLP C[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc(F)c(F)c1O ZINC000187707769 287048821 /nfs/dbraw/zinc/04/88/21/287048821.db2.gz NDLGPYHCWWSQPM-NWDGAFQWSA-N 2 2 313.392 1.957 20 10 DDCDLP COc1ccc(N2CC[NH+](CCC[NH2+]C3CSC3)CC2)cc1 ZINC000780875534 698567170 /nfs/dbraw/zinc/56/71/70/698567170.db2.gz RWPJXOOQEACRKK-UHFFFAOYSA-N 2 2 321.490 1.912 20 10 DDCDLP Oc1cc2c(cc1C[NH+]1CCC(n3cc[nH+]c3)CC1)[C@H](O)CO2 ZINC000768446533 701177219 /nfs/dbraw/zinc/17/72/19/701177219.db2.gz KUAWXOVHQLQQTN-MRXNPFEDSA-N 2 2 315.373 1.852 20 10 DDCDLP COC(=O)C(C)(C)CC[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841042128 702320183 /nfs/dbraw/zinc/32/01/83/702320183.db2.gz KOIDSBIXUROMOG-OAHLLOKOSA-N 2 2 307.438 1.931 20 10 DDCDLP C[C@@H]1CC[NH2+]C[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000841059301 702329576 /nfs/dbraw/zinc/32/95/76/702329576.db2.gz PRMNLCJRZSAGCM-QAPCUYQASA-N 3 2 302.466 1.526 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](F)[C@H](N)C3)cc2)CC1 ZINC000853247787 704224341 /nfs/dbraw/zinc/22/43/41/704224341.db2.gz BCLXMIBHZABSKS-IAGOWNOFSA-N 2 2 306.429 1.310 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](F)[C@H](N)C3)cc2)CC1 ZINC000853247787 704224343 /nfs/dbraw/zinc/22/43/43/704224343.db2.gz BCLXMIBHZABSKS-IAGOWNOFSA-N 2 2 306.429 1.310 20 10 DDCDLP CCc1cccc(C[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)c1O ZINC000862464651 705719482 /nfs/dbraw/zinc/71/94/82/705719482.db2.gz FKSYMTGOOYUXQJ-HNNXBMFYSA-N 2 2 305.422 1.384 20 10 DDCDLP CCc1cccc(C[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c1O ZINC000862464651 705719485 /nfs/dbraw/zinc/71/94/85/705719485.db2.gz FKSYMTGOOYUXQJ-HNNXBMFYSA-N 2 2 305.422 1.384 20 10 DDCDLP C[N@@H+]1CCC[C@@H]1C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876985873 705949818 /nfs/dbraw/zinc/94/98/18/705949818.db2.gz SHVBCFGCYXPHDE-QGZVFWFLSA-N 2 2 303.450 1.832 20 10 DDCDLP C[N@H+]1CCC[C@@H]1C[NH2+]Cc1ccc(N2CCC(O)CC2)cc1 ZINC000876985873 705949820 /nfs/dbraw/zinc/94/98/20/705949820.db2.gz SHVBCFGCYXPHDE-QGZVFWFLSA-N 2 2 303.450 1.832 20 10 DDCDLP COC(=O)c1ccc(O)c([C@@H](C)[NH2+]CC2([NH3+])CCOCC2)c1 ZINC000863541521 705952568 /nfs/dbraw/zinc/95/25/68/705952568.db2.gz NUHOAAITKSZMHG-LLVKDONJSA-N 2 2 308.378 1.337 20 10 DDCDLP CCCOc1ccc(C[NH2+]CC(=O)N2CC[NH+](C)CC2)cc1C ZINC000873024887 707699237 /nfs/dbraw/zinc/69/92/37/707699237.db2.gz DLYNSAWRLOPIQH-UHFFFAOYSA-N 2 2 319.449 1.647 20 10 DDCDLP COc1cc(O)c(C[N@@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)c(OC)c1 ZINC001141030728 860767189 /nfs/dbraw/zinc/76/71/89/860767189.db2.gz IVFWTLDGMFDHGE-SJKOYZFVSA-N 2 2 306.406 1.793 20 10 DDCDLP COc1cc(O)c(C[N@H+]2C[C@H]3C[C@@]3(C[NH+](C)C)C2)c(OC)c1 ZINC001141030728 860767195 /nfs/dbraw/zinc/76/71/95/860767195.db2.gz IVFWTLDGMFDHGE-SJKOYZFVSA-N 2 2 306.406 1.793 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCC[C@@H]3C(N)=O)cc2F)CC1 ZINC001330532580 864433752 /nfs/dbraw/zinc/43/37/52/864433752.db2.gz HSCHJJKORLQJBI-MRXNPFEDSA-N 2 2 320.412 1.027 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCC[C@@H]3C(N)=O)cc2F)CC1 ZINC001330532580 864433768 /nfs/dbraw/zinc/43/37/68/864433768.db2.gz HSCHJJKORLQJBI-MRXNPFEDSA-N 2 2 320.412 1.027 20 10 DDCDLP CC[C@@H]([NH2+]CC(=O)N1CC[NH+](C)CC1)c1ccc(C)cc1O ZINC000794803778 699831572 /nfs/dbraw/zinc/83/15/72/699831572.db2.gz KGBGKVAJUXNCAR-OAHLLOKOSA-N 2 2 305.422 1.515 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[NH3+])cc2F)CC1 ZINC000817902686 702514616 /nfs/dbraw/zinc/51/46/16/702514616.db2.gz XCLZUULZTNDWBT-DLBZAZTESA-N 3 2 320.456 1.937 20 10 DDCDLP CC[NH+]1CCN(c2ccc(CN[C@@H]3CCC[C@@H]3[NH3+])cc2F)CC1 ZINC000817902686 702514618 /nfs/dbraw/zinc/51/46/18/702514618.db2.gz XCLZUULZTNDWBT-DLBZAZTESA-N 2 2 320.456 1.937 20 10 DDCDLP COc1ccc(N2CC[NH+](C[C@]3(C)CC[NH2+]C3)CC2)c(OC)c1 ZINC000873220545 707774389 /nfs/dbraw/zinc/77/43/89/707774389.db2.gz UNHUSKVGMSHRMA-GOSISDBHSA-N 2 2 319.449 1.825 20 10 DDCDLP CN(C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc(O)ccc1O ZINC001275419420 853094099 /nfs/dbraw/zinc/09/40/99/853094099.db2.gz YDSYUCXBYYOCMF-MQVJKMGUSA-N 2 2 319.449 1.744 20 10 DDCDLP CN(C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1cc(O)ccc1O ZINC001275419420 853094104 /nfs/dbraw/zinc/09/41/04/853094104.db2.gz YDSYUCXBYYOCMF-MQVJKMGUSA-N 2 2 319.449 1.744 20 10 DDCDLP COc1cc(C[N@@H+]2C[C@@H](F)C[C@H]2CO)cc(C[NH+](C)C)c1O ZINC001139253187 860336968 /nfs/dbraw/zinc/33/69/68/860336968.db2.gz PEKGZHQNSDGJMZ-KBPBESRZSA-N 2 2 312.385 1.367 20 10 DDCDLP COc1cc(C[N@H+]2C[C@@H](F)C[C@H]2CO)cc(C[NH+](C)C)c1O ZINC001139253187 860336972 /nfs/dbraw/zinc/33/69/72/860336972.db2.gz PEKGZHQNSDGJMZ-KBPBESRZSA-N 2 2 312.385 1.367 20 10 DDCDLP COc1cc(C[N@@H+]2CCCC[C@H]2C(N)=O)cc(C[NH+](C)C)c1O ZINC001139257082 860339403 /nfs/dbraw/zinc/33/94/03/860339403.db2.gz QUBKUPBNUDHAKI-AWEZNQCLSA-N 2 2 321.421 1.302 20 10 DDCDLP COc1cc(C[N@H+]2CCCC[C@H]2C(N)=O)cc(C[NH+](C)C)c1O ZINC001139257082 860339406 /nfs/dbraw/zinc/33/94/06/860339406.db2.gz QUBKUPBNUDHAKI-AWEZNQCLSA-N 2 2 321.421 1.302 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCC34COC4)cc2)CC1 ZINC001140303916 860615514 /nfs/dbraw/zinc/61/55/14/860615514.db2.gz DVPXBQITIXQZLG-UHFFFAOYSA-N 2 2 301.434 1.803 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CCC34COC4)cc2)CC1 ZINC001140303916 860615515 /nfs/dbraw/zinc/61/55/15/860615515.db2.gz DVPXBQITIXQZLG-UHFFFAOYSA-N 2 2 301.434 1.803 20 10 DDCDLP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2NC(=O)[C@@H]1C[C@H]([NH3+])C[NH2+]1 ZINC001157434627 863819630 /nfs/dbraw/zinc/81/96/30/863819630.db2.gz PKARBNZEEVJDJI-DETPVDSQSA-N 2 2 317.433 1.438 20 10 DDCDLP COc1cc(C)c(C[NH+]2CC(N3CC[NH+](C)CC3)C2)c(O)c1 ZINC001236815051 889369188 /nfs/dbraw/zinc/36/91/88/889369188.db2.gz HIIOVDOACRZKSV-UHFFFAOYSA-N 2 2 305.422 1.141 20 10 DDCDLP C[C@@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1ccc(F)c(F)c1O ZINC000276851260 296119294 /nfs/dbraw/zinc/11/92/94/296119294.db2.gz AZXQQEOLFUXHTF-SNVBAGLBSA-N 2 2 300.349 1.778 20 10 DDCDLP Cc1ccc([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c(O)c1 ZINC000273361788 130110979 /nfs/dbraw/zinc/11/09/79/130110979.db2.gz ANHPEEPJKHMFJR-HIFRSBDPSA-N 2 2 305.422 1.691 20 10 DDCDLP Cc1nc(N2CC[NH+](Cc3cc(F)ccc3O)CC2)cc[nH+]1 ZINC000184766710 408686416 /nfs/dbraw/zinc/68/64/16/408686416.db2.gz NCIYDVKQKAFLTO-UHFFFAOYSA-N 2 2 302.353 1.952 20 10 DDCDLP CC[C@@H]1C(=O)NCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775676290 698021719 /nfs/dbraw/zinc/02/17/19/698021719.db2.gz PECPPASUDUYXKH-QGZVFWFLSA-N 2 2 316.449 1.149 20 10 DDCDLP C[C@@H]([NH2+]CC(=O)N1CC[NH+](C)CC1)c1cc(Cl)ccc1O ZINC000756491297 700623907 /nfs/dbraw/zinc/62/39/07/700623907.db2.gz UUYZESFXYIDDFD-LLVKDONJSA-N 2 2 311.813 1.470 20 10 DDCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2ccc3c(c2)nnn3C)cc1 ZINC000841044125 702321220 /nfs/dbraw/zinc/32/12/20/702321220.db2.gz TWQKCLUTRBCZPS-MRXNPFEDSA-N 2 2 324.432 1.824 20 10 DDCDLP COc1c(O)c(C[NH2+][C@H](C[NH3+])C2CCCC2)ccc1[N+](=O)[O-] ZINC000841087223 702341522 /nfs/dbraw/zinc/34/15/22/702341522.db2.gz QJXPXXSFFABFDS-GFCCVEGCSA-N 2 2 309.366 1.916 20 10 DDCDLP COc1ccc(N2CCC([NH2+]C[C@H]3C[NH2+]CCO3)CC2)cc1 ZINC000841101354 702347240 /nfs/dbraw/zinc/34/72/40/702347240.db2.gz UNRQEVJMIGWZII-QGZVFWFLSA-N 2 2 305.422 1.242 20 10 DDCDLP Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C1CC1)[C@@H]1C[NH2+]CCO1 ZINC000817895266 702511636 /nfs/dbraw/zinc/51/16/36/702511636.db2.gz WMDQKXCFVNGJRE-ROUUACIJSA-N 2 2 303.450 1.918 20 10 DDCDLP C[C@@H]1CCC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H]1C[NH3+] ZINC000843052259 702808971 /nfs/dbraw/zinc/80/89/71/702808971.db2.gz QZPDJJPGAQALFB-VQIMIIECSA-N 3 2 316.493 1.998 20 10 DDCDLP C[C@@H]1CCC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)[C@@H]1C[NH3+] ZINC000843052259 702808974 /nfs/dbraw/zinc/80/89/74/702808974.db2.gz QZPDJJPGAQALFB-VQIMIIECSA-N 3 2 316.493 1.998 20 10 DDCDLP Cc1cc(O)c(C[N@@H+]2CCC[C@H](N3CC[NH2+]CC3=O)C2)cc1C ZINC000843065604 702812327 /nfs/dbraw/zinc/81/23/27/702812327.db2.gz OCMZAVKMRPHBIS-INIZCTEOSA-N 2 2 317.433 1.405 20 10 DDCDLP Cc1cc(O)c(C[N@H+]2CCC[C@H](N3CC[NH2+]CC3=O)C2)cc1C ZINC000843065604 702812328 /nfs/dbraw/zinc/81/23/28/702812328.db2.gz OCMZAVKMRPHBIS-INIZCTEOSA-N 2 2 317.433 1.405 20 10 DDCDLP COc1ccc(N2CC[NH+](C[C@H]3CCC[NH2+]C3)CC2)c(OC)c1 ZINC000866697239 706767574 /nfs/dbraw/zinc/76/75/74/706767574.db2.gz KDJZNIXOGRRJSP-HNNXBMFYSA-N 2 2 319.449 1.825 20 10 DDCDLP Cn1c[nH+]cc1CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000857782978 704625156 /nfs/dbraw/zinc/62/51/56/704625156.db2.gz NAFQBOPAIYHWKA-UHFFFAOYSA-N 3 2 313.449 1.504 20 10 DDCDLP Cc1cc(O)c(C[NH2+]CC(=O)N2CC[NH+](C)CC2)cc1Cl ZINC000825159489 705612464 /nfs/dbraw/zinc/61/24/64/705612464.db2.gz DAIMAIQUFPQYKJ-UHFFFAOYSA-N 2 2 311.813 1.218 20 10 DDCDLP Oc1ccccc1C[NH2+][C@@H]1CCCN(CC[NH+]2CCOCC2)C1 ZINC000883371926 707986238 /nfs/dbraw/zinc/98/62/38/707986238.db2.gz FLNRDIKRNPPNSE-QGZVFWFLSA-N 2 2 319.449 1.278 20 10 DDCDLP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC[NH2+]1 ZINC001117953663 780960808 /nfs/dbraw/zinc/96/08/08/780960808.db2.gz KVLZFDVEZKIOOU-ZBFHGGJFSA-N 3 2 320.456 1.808 20 10 DDCDLP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N3CCN(C)CC3)c(F)c2)CC[NH2+]1 ZINC001117953663 780960814 /nfs/dbraw/zinc/96/08/14/780960814.db2.gz KVLZFDVEZKIOOU-ZBFHGGJFSA-N 2 2 320.456 1.808 20 10 DDCDLP C[C@@H](C(=O)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1)n1cc[nH+]c1 ZINC001327182074 861948416 /nfs/dbraw/zinc/94/84/16/861948416.db2.gz VXOIHQAUDHABHP-SWLSCSKDSA-N 2 2 301.394 1.326 20 10 DDCDLP Cc1ccc(C[NH+]2CC3(CCN3CCn3cc[nH+]c3)C2)c(O)c1 ZINC001276168241 854872010 /nfs/dbraw/zinc/87/20/10/854872010.db2.gz DCPAJTZNVAGHMW-UHFFFAOYSA-N 2 2 312.417 1.857 20 10 DDCDLP CCOc1cccc(C[N@@H+]2C[C@@H]3C[NH+](CC)CCO[C@@H]3C2)c1O ZINC001203609762 870669355 /nfs/dbraw/zinc/66/93/55/870669355.db2.gz JLMFBNUQRIZRIF-DOTOQJQBSA-N 2 2 320.433 1.943 20 10 DDCDLP CCOc1cccc(C[N@H+]2C[C@@H]3C[NH+](CC)CCO[C@@H]3C2)c1O ZINC001203609762 870669360 /nfs/dbraw/zinc/66/93/60/870669360.db2.gz JLMFBNUQRIZRIF-DOTOQJQBSA-N 2 2 320.433 1.943 20 10 DDCDLP CCOc1cccc(C[NH+]2C[C@@H]3C[N@H+](CC)CCO[C@@H]3C2)c1O ZINC001203609762 870669368 /nfs/dbraw/zinc/66/93/68/870669368.db2.gz JLMFBNUQRIZRIF-DOTOQJQBSA-N 2 2 320.433 1.943 20 10 DDCDLP CCOc1cccc(C[NH+]2C[C@@H]3C[N@@H+](CC)CCO[C@@H]3C2)c1O ZINC001203609762 870669375 /nfs/dbraw/zinc/66/93/75/870669375.db2.gz JLMFBNUQRIZRIF-DOTOQJQBSA-N 2 2 320.433 1.943 20 10 DDCDLP Oc1cc(O)c(C[NH+]2CCN(CC[NH+]3CCCC3)CC2)cc1O ZINC001233486383 887019516 /nfs/dbraw/zinc/01/95/16/887019516.db2.gz LGHHJKAPSXNTQP-UHFFFAOYSA-N 2 2 321.421 1.017 20 10 DDCDLP COc1c(O)c(C[NH2+]CCn2cc[nH+]c2C)ccc1[N+](=O)[O-] ZINC000278949065 409119800 /nfs/dbraw/zinc/11/98/00/409119800.db2.gz ZCFPXLPXPYUFOR-UHFFFAOYSA-N 2 2 306.322 1.604 20 10 DDCDLP C[C@H]1C[N@H+](Cc2cc(F)ccc2O)CC[C@H]1N1CC[NH+](C)CC1 ZINC000368605838 418722666 /nfs/dbraw/zinc/72/26/66/418722666.db2.gz ZFKJRVBKCRHHDP-WMLDXEAASA-N 2 2 321.440 1.989 20 10 DDCDLP C[C@H]1C[N@@H+](Cc2cc(F)ccc2O)CC[C@H]1N1CC[NH+](C)CC1 ZINC000368605838 418722668 /nfs/dbraw/zinc/72/26/68/418722668.db2.gz ZFKJRVBKCRHHDP-WMLDXEAASA-N 2 2 321.440 1.989 20 10 DDCDLP CC[NH+]1CCN([C@@H]2CC[N@H+](Cc3cccc(F)c3O)C2)CC1 ZINC000272297510 535735993 /nfs/dbraw/zinc/73/59/93/535735993.db2.gz PCSXCOZIUBTMIL-OAHLLOKOSA-N 2 2 307.413 1.743 20 10 DDCDLP CC[NH+]1CCN([C@@H]2CC[N@@H+](Cc3cccc(F)c3O)C2)CC1 ZINC000272297510 535736003 /nfs/dbraw/zinc/73/60/03/535736003.db2.gz PCSXCOZIUBTMIL-OAHLLOKOSA-N 2 2 307.413 1.743 20 10 DDCDLP C[C@@H]([NH2+]C[C@H](O)C[NH+](C)C)c1cc(Br)ccc1O ZINC000756558264 700628283 /nfs/dbraw/zinc/62/82/83/700628283.db2.gz ZDGTVNLZZPQGCQ-KOLCDFICSA-N 2 2 317.227 1.728 20 10 DDCDLP Cc1cc(Br)cc(C[NH2+]C[C@@H]2C[NH2+]CCO2)c1O ZINC000841099428 702345518 /nfs/dbraw/zinc/34/55/18/702345518.db2.gz PVSIDXVGQYSCTR-LBPRGKRZSA-N 2 2 315.211 1.541 20 10 DDCDLP Cc1cccc(C[N@@H+]2CCC[C@H](N3CC[NH2+]CC3=O)C2)c1O ZINC000843063440 702811767 /nfs/dbraw/zinc/81/17/67/702811767.db2.gz AYCOSHWRPSNENE-HNNXBMFYSA-N 2 2 303.406 1.097 20 10 DDCDLP Cc1cccc(C[N@H+]2CCC[C@H](N3CC[NH2+]CC3=O)C2)c1O ZINC000843063440 702811768 /nfs/dbraw/zinc/81/17/68/702811768.db2.gz AYCOSHWRPSNENE-HNNXBMFYSA-N 2 2 303.406 1.097 20 10 DDCDLP Cc1cc(O)c(C[N@@H+]2CCC[C@@H](N3CC[NH2+]CC3=O)C2)cc1C ZINC000843065613 702812245 /nfs/dbraw/zinc/81/22/45/702812245.db2.gz OCMZAVKMRPHBIS-MRXNPFEDSA-N 2 2 317.433 1.405 20 10 DDCDLP Cc1cc(O)c(C[N@H+]2CCC[C@@H](N3CC[NH2+]CC3=O)C2)cc1C ZINC000843065613 702812248 /nfs/dbraw/zinc/81/22/48/702812248.db2.gz OCMZAVKMRPHBIS-MRXNPFEDSA-N 2 2 317.433 1.405 20 10 DDCDLP CC(C)[C@@](C)(C[NH3+])[NH2+]CC(=O)NCc1ccc(N(C)C)cc1 ZINC000844220695 702995385 /nfs/dbraw/zinc/99/53/85/702995385.db2.gz JYPVXNPEWRHKSX-QGZVFWFLSA-N 2 2 306.454 1.332 20 10 DDCDLP CN(C)c1ccc(CN(C)C(=O)C[NH2+][C@@](C)(C[NH3+])C2CC2)cc1 ZINC000844221056 702995848 /nfs/dbraw/zinc/99/58/48/702995848.db2.gz ROFZPKZIMOHALB-SFHVURJKSA-N 2 2 318.465 1.428 20 10 DDCDLP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCOCC3)c(F)c2)C[NH2+]1 ZINC000863485151 705938872 /nfs/dbraw/zinc/93/88/72/705938872.db2.gz VMEQCBHVTKRZCU-UKRRQHHQSA-N 2 2 307.413 1.892 20 10 DDCDLP CC[N@H+](CC[NH3+])Cc1cc(Br)cc(OC)c1O ZINC000863645232 705975422 /nfs/dbraw/zinc/97/54/22/705975422.db2.gz SKBSPVYMHIDOME-UHFFFAOYSA-N 2 2 303.200 1.944 20 10 DDCDLP CC[N@@H+](CC[NH3+])Cc1cc(Br)cc(OC)c1O ZINC000863645232 705975425 /nfs/dbraw/zinc/97/54/25/705975425.db2.gz SKBSPVYMHIDOME-UHFFFAOYSA-N 2 2 303.200 1.944 20 10 DDCDLP CN(C)c1ccc(C[NH+]2CCN(c3[nH+]ccn3C)CC2)cc1F ZINC000827891345 706082817 /nfs/dbraw/zinc/08/28/17/706082817.db2.gz IKGUJYIHZCRGHQ-UHFFFAOYSA-N 2 2 317.412 1.947 20 10 DDCDLP CCOCc1cc(C[NH2+]C[C@@H](O)C[NH+]2CCCC2)ccc1OC ZINC001177474392 778602831 /nfs/dbraw/zinc/60/28/31/778602831.db2.gz BKUICMKABMJFRM-QGZVFWFLSA-N 2 2 322.449 1.778 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](C[NH3+])C3)cc2F)CC1 ZINC001326202038 861187370 /nfs/dbraw/zinc/18/73/70/861187370.db2.gz ZLSXINGMTMOAQD-HNNXBMFYSA-N 3 2 306.429 1.358 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H](C[NH3+])C3)cc2F)CC1 ZINC001326202038 861187378 /nfs/dbraw/zinc/18/73/78/861187378.db2.gz ZLSXINGMTMOAQD-HNNXBMFYSA-N 3 2 306.429 1.358 20 10 DDCDLP CN1CCN(c2ccc(C[N@@H+]3CC[C@@H](C[NH3+])C3)cc2F)CC1 ZINC001326202038 861187386 /nfs/dbraw/zinc/18/73/86/861187386.db2.gz ZLSXINGMTMOAQD-HNNXBMFYSA-N 2 2 306.429 1.358 20 10 DDCDLP CN1CCN(c2ccc(C[N@H+]3CC[C@@H](C[NH3+])C3)cc2F)CC1 ZINC001326202038 861187395 /nfs/dbraw/zinc/18/73/95/861187395.db2.gz ZLSXINGMTMOAQD-HNNXBMFYSA-N 2 2 306.429 1.358 20 10 DDCDLP CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]([NH3+])Cc1c[nH+]c[nH]1 ZINC001161130378 866394011 /nfs/dbraw/zinc/39/40/11/866394011.db2.gz HOBKVTXEBAOMRF-MRXNPFEDSA-N 2 2 315.421 1.394 20 10 DDCDLP C[C@@H]1CC[C@@H](C[NH3+])[N@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)C1 ZINC001205844693 871858760 /nfs/dbraw/zinc/85/87/60/871858760.db2.gz XUKXKJYOMQDHLB-DOMZBBRYSA-N 3 2 305.422 1.433 20 10 DDCDLP C[C@@H]1CC[C@@H](C[NH3+])[N@@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)C1 ZINC001205844693 871858773 /nfs/dbraw/zinc/85/87/73/871858773.db2.gz XUKXKJYOMQDHLB-DOMZBBRYSA-N 3 2 305.422 1.433 20 10 DDCDLP COc1cc(N(C)C)ccc1C[NH+]1CC(N2CC[NH+](C)CC2)C1 ZINC001231858402 885911409 /nfs/dbraw/zinc/91/14/09/885911409.db2.gz VVLHVMUYIWNMGR-UHFFFAOYSA-N 2 2 318.465 1.193 20 10 DDCDLP Cc1ccc([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@@H]2C(N)=O)c(O)c1 ZINC000273361791 130111575 /nfs/dbraw/zinc/11/15/75/130111575.db2.gz ANHPEEPJKHMFJR-UKRRQHHQSA-N 2 2 305.422 1.691 20 10 DDCDLP CCN1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1=O ZINC000758015968 700680960 /nfs/dbraw/zinc/68/09/60/700680960.db2.gz ROYBBPLRLYODIO-UHFFFAOYSA-N 2 2 316.449 1.103 20 10 DDCDLP CCN1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1=O ZINC000758015968 700680961 /nfs/dbraw/zinc/68/09/61/700680961.db2.gz ROYBBPLRLYODIO-UHFFFAOYSA-N 2 2 316.449 1.103 20 10 DDCDLP CC[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)CC[C@H]1[NH3+] ZINC000843051039 702808540 /nfs/dbraw/zinc/80/85/40/702808540.db2.gz UFLQLAXAAAPHMU-CMPLNLGQSA-N 2 2 309.366 1.868 20 10 DDCDLP CC[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2O)CC[C@H]1[NH3+] ZINC000843051039 702808543 /nfs/dbraw/zinc/80/85/43/702808543.db2.gz UFLQLAXAAAPHMU-CMPLNLGQSA-N 2 2 309.366 1.868 20 10 DDCDLP COc1cc(Br)cc(C[NH2+]CC2([NH3+])CC2)c1O ZINC000904451690 711860202 /nfs/dbraw/zinc/86/02/02/711860202.db2.gz ZUWLSNDHQYKJBW-UHFFFAOYSA-N 2 2 301.184 1.744 20 10 DDCDLP C[C@H]1CC(=O)CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139408463 860390460 /nfs/dbraw/zinc/39/04/60/860390460.db2.gz MTPRBROZKIEFFB-HNNXBMFYSA-N 2 2 301.434 1.992 20 10 DDCDLP C[C@H]1CC(=O)CC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139408463 860390466 /nfs/dbraw/zinc/39/04/66/860390466.db2.gz MTPRBROZKIEFFB-HNNXBMFYSA-N 2 2 301.434 1.992 20 10 DDCDLP c1cc(N2CCCC2)ccc1CN1CC[NH2+][C@H]2CC[NH2+]CC[C@@H]21 ZINC001222492346 880507474 /nfs/dbraw/zinc/50/74/74/880507474.db2.gz TXBWWXFLLFMACA-OALUTQOASA-N 2 2 314.477 1.813 20 10 DDCDLP CC[N@@H+]1CCO[C@@H]2C[NH+](Cc3ccc(N(C)C)cc3O)C[C@@H]2C1 ZINC001232837533 886624229 /nfs/dbraw/zinc/62/42/29/886624229.db2.gz KLZLZXQLDFEPIT-MAUKXSAKSA-N 2 2 319.449 1.611 20 10 DDCDLP CC[N@H+]1CCO[C@@H]2C[NH+](Cc3ccc(N(C)C)cc3O)C[C@@H]2C1 ZINC001232837533 886624239 /nfs/dbraw/zinc/62/42/39/886624239.db2.gz KLZLZXQLDFEPIT-MAUKXSAKSA-N 2 2 319.449 1.611 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@H+](Cc3ccc(N(C)C)cc3O)C[C@@H]2C1 ZINC001232837533 886624244 /nfs/dbraw/zinc/62/42/44/886624244.db2.gz KLZLZXQLDFEPIT-MAUKXSAKSA-N 2 2 319.449 1.611 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@@H+](Cc3ccc(N(C)C)cc3O)C[C@@H]2C1 ZINC001232837533 886624248 /nfs/dbraw/zinc/62/42/48/886624248.db2.gz KLZLZXQLDFEPIT-MAUKXSAKSA-N 2 2 319.449 1.611 20 10 DDCDLP Cc1ccc(O)c([C@H](C)[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)c1 ZINC000273622732 130146933 /nfs/dbraw/zinc/14/69/33/130146933.db2.gz ZMVIIFMFWKXQEJ-ZFWWWQNUSA-N 2 2 305.422 1.691 20 10 DDCDLP Cc1ccc(O)c([C@H](C)[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c1 ZINC000273622732 130146935 /nfs/dbraw/zinc/14/69/35/130146935.db2.gz ZMVIIFMFWKXQEJ-ZFWWWQNUSA-N 2 2 305.422 1.691 20 10 DDCDLP C[C@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000185341343 408798059 /nfs/dbraw/zinc/79/80/59/408798059.db2.gz AGQMCOPRDUOMDM-LBPRGKRZSA-N 2 2 309.385 1.346 20 10 DDCDLP Cc1nn(C)c(C)c1C[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841042889 702320781 /nfs/dbraw/zinc/32/07/81/702320781.db2.gz MLWNAIPVYWDKKF-QGZVFWFLSA-N 2 2 301.438 1.893 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CC[NH2+]C3(C)C)cc2)CC1 ZINC000841086869 702340698 /nfs/dbraw/zinc/34/06/98/702340698.db2.gz PXQXCXRXFUPHEU-QGZVFWFLSA-N 3 2 302.466 1.669 20 10 DDCDLP C[C@@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)C(C)(C)n1cncn1 ZINC000817941205 702531161 /nfs/dbraw/zinc/53/11/61/702531161.db2.gz JKCVLKAOVRWYRS-CJNGLKHVSA-N 2 2 316.453 1.757 20 10 DDCDLP COC[C@]1(C[NH2+][C@H](C)c2cc(C(=O)OC)ccc2O)CCC[NH2+]1 ZINC000817974204 702540869 /nfs/dbraw/zinc/54/08/69/702540869.db2.gz JIPHSEKISFQNIG-SJKOYZFVSA-N 2 2 322.405 1.598 20 10 DDCDLP C[NH+](C)CCC[N@H+](C)CCNC(=O)/C=C/c1ccc(O)c(O)c1 ZINC000855414781 704484274 /nfs/dbraw/zinc/48/42/74/704484274.db2.gz MASRNQDVSBEQTD-SOFGYWHQSA-N 2 2 321.421 1.111 20 10 DDCDLP C[NH+](C)CCC[N@@H+](C)CCNC(=O)/C=C/c1ccc(O)c(O)c1 ZINC000855414781 704484275 /nfs/dbraw/zinc/48/42/75/704484275.db2.gz MASRNQDVSBEQTD-SOFGYWHQSA-N 2 2 321.421 1.111 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000863483294 705938411 /nfs/dbraw/zinc/93/84/11/705938411.db2.gz UUHVBHMWYZZVOP-QGZVFWFLSA-N 2 2 301.434 1.897 20 10 DDCDLP C[C@H](C[NH2+]Cc1cc(F)cc(F)c1O)CN1CC[NH+](C)CC1 ZINC000882979760 707882740 /nfs/dbraw/zinc/88/27/40/707882740.db2.gz LVTHZIRDUBGKEB-GFCCVEGCSA-N 2 2 313.392 1.644 20 10 DDCDLP CN(C)c1ccc([C@H](CNC(=O)Cc2[nH]cc[nH+]2)[NH+](C)C)cc1 ZINC000891246691 710140340 /nfs/dbraw/zinc/14/03/40/710140340.db2.gz FCJNJLKBVYDXEG-HNNXBMFYSA-N 2 2 315.421 1.437 20 10 DDCDLP Cc1cc(C[N@H+]2C[C@@H](c3cnn(C)c3)[C@H]([NH3+])C2)ccc1N(C)C ZINC000923382551 714335685 /nfs/dbraw/zinc/33/56/85/714335685.db2.gz CVWCQZKQRUPVSP-DLBZAZTESA-N 2 2 313.449 1.721 20 10 DDCDLP Cc1cc(C[N@@H+]2C[C@@H](c3cnn(C)c3)[C@H]([NH3+])C2)ccc1N(C)C ZINC000923382551 714335687 /nfs/dbraw/zinc/33/56/87/714335687.db2.gz CVWCQZKQRUPVSP-DLBZAZTESA-N 2 2 313.449 1.721 20 10 DDCDLP COc1ccc(N2CC[C@H](C[NH2+][C@H]3C[NH2+]CCOC3)C2)cc1 ZINC000925706326 714918237 /nfs/dbraw/zinc/91/82/37/714918237.db2.gz NKHVHWZKABGIGE-CABCVRRESA-N 2 2 305.422 1.100 20 10 DDCDLP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@H+]2Cc1c(O)cccc1Cl ZINC001275216666 852901881 /nfs/dbraw/zinc/90/18/81/852901881.db2.gz ALUHBGTWXCWDPY-BETUJISGSA-N 2 2 309.841 1.866 20 10 DDCDLP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@@H+]2Cc1c(O)cccc1Cl ZINC001275216666 852901885 /nfs/dbraw/zinc/90/18/85/852901885.db2.gz ALUHBGTWXCWDPY-BETUJISGSA-N 2 2 309.841 1.866 20 10 DDCDLP Cc1cc(N2CC[NH+](Cc3cc(O)ccc3O)CC2)nc(C)[nH+]1 ZINC001141158493 860798032 /nfs/dbraw/zinc/79/80/32/860798032.db2.gz BFPLAJQCCHAARC-UHFFFAOYSA-N 2 2 314.389 1.827 20 10 DDCDLP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001349673344 875295690 /nfs/dbraw/zinc/29/56/90/875295690.db2.gz DROLQUULOOIVDT-ZBFHGGJFSA-N 3 2 320.456 1.889 20 10 DDCDLP C[C@@H]1C[C@@H]([NH3+])CC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001349673344 875295704 /nfs/dbraw/zinc/29/57/04/875295704.db2.gz DROLQUULOOIVDT-ZBFHGGJFSA-N 3 2 320.456 1.889 20 10 DDCDLP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCC[C@@]2(CC[NH2+]2)C1 ZINC001222287402 880380969 /nfs/dbraw/zinc/38/09/69/880380969.db2.gz IWPSWEJNPNGPES-GOSISDBHSA-N 3 2 316.449 1.130 20 10 DDCDLP Oc1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCC[C@@]2(CC[NH2+]2)C1 ZINC001222287402 880380981 /nfs/dbraw/zinc/38/09/81/880380981.db2.gz IWPSWEJNPNGPES-GOSISDBHSA-N 3 2 316.449 1.130 20 10 DDCDLP COc1ccc(C[N@H+]2C[C@H]3COC[C@@H](C2)C3[NH3+])c(O)c1Cl ZINC001235999382 889056180 /nfs/dbraw/zinc/05/61/80/889056180.db2.gz CMUQUCULBPIECR-BVUQATHDSA-N 2 2 312.797 1.460 20 10 DDCDLP COc1ccc(C[N@@H+]2C[C@H]3COC[C@@H](C2)C3[NH3+])c(O)c1Cl ZINC001235999382 889056189 /nfs/dbraw/zinc/05/61/89/889056189.db2.gz CMUQUCULBPIECR-BVUQATHDSA-N 2 2 312.797 1.460 20 10 DDCDLP CC[N@H+](CCn1cc[nH+]c1)Cc1ccc(CC(=O)OC)cc1O ZINC001249214955 893871390 /nfs/dbraw/zinc/87/13/90/893871390.db2.gz SYCZRQGKAXOPFF-UHFFFAOYSA-N 2 2 317.389 1.826 20 10 DDCDLP CC[N@@H+](CCn1cc[nH+]c1)Cc1ccc(CC(=O)OC)cc1O ZINC001249214955 893871405 /nfs/dbraw/zinc/87/14/05/893871405.db2.gz SYCZRQGKAXOPFF-UHFFFAOYSA-N 2 2 317.389 1.826 20 10 DDCDLP Cc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)c(O)c1C ZINC000273553387 408243698 /nfs/dbraw/zinc/24/36/98/408243698.db2.gz GJIUTIYIBNNAOR-ZBFHGGJFSA-N 2 2 319.449 1.999 20 10 DDCDLP Cc1ccc([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c(O)c1C ZINC000273553387 408243703 /nfs/dbraw/zinc/24/37/03/408243703.db2.gz GJIUTIYIBNNAOR-ZBFHGGJFSA-N 2 2 319.449 1.999 20 10 DDCDLP C[N@@H+]1CCC[C@@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000107797435 696631775 /nfs/dbraw/zinc/63/17/75/696631775.db2.gz VUOFEXLAEJKJHG-GOSISDBHSA-N 3 2 302.466 1.622 20 10 DDCDLP C[N@H+]1CCC[C@@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000107797435 696631777 /nfs/dbraw/zinc/63/17/77/696631777.db2.gz VUOFEXLAEJKJHG-GOSISDBHSA-N 3 2 302.466 1.622 20 10 DDCDLP COc1cc(O)c(C[NH2+][C@@H]2CCn3cc[nH+]c3C2)cc1OC ZINC000779192069 698400912 /nfs/dbraw/zinc/40/09/12/698400912.db2.gz JBXWZBQZPWLWBC-GFCCVEGCSA-N 2 2 303.362 1.711 20 10 DDCDLP C[C@@H]1C[C@@H]([NH2+]CC(=O)N2CC[NH+](C)CC2)c2c1c(F)ccc2O ZINC000756491635 700623829 /nfs/dbraw/zinc/62/38/29/700623829.db2.gz WUSXHKXHBRFAAJ-DGCLKSJQSA-N 2 2 321.396 1.443 20 10 DDCDLP Cc1nonc1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000809745522 701685454 /nfs/dbraw/zinc/68/54/54/701685454.db2.gz WLUHZSXRTDWQGY-UHFFFAOYSA-N 2 2 301.394 1.420 20 10 DDCDLP COC[C@@]1(C[NH2+]Cc2cc(OC)c(OC)cc2O)CCC[NH2+]1 ZINC000841067574 702334729 /nfs/dbraw/zinc/33/47/29/702334729.db2.gz NEBCUCLHYLTJOK-INIZCTEOSA-N 2 2 310.394 1.268 20 10 DDCDLP C[C@H]1C[N@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@H]1[NH3+] ZINC000844218948 702994621 /nfs/dbraw/zinc/99/46/21/702994621.db2.gz GEBPNDCNFNADIB-WMLDXEAASA-N 2 2 318.465 1.380 20 10 DDCDLP C[C@H]1C[N@@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)CC[C@H]1[NH3+] ZINC000844218948 702994624 /nfs/dbraw/zinc/99/46/24/702994624.db2.gz GEBPNDCNFNADIB-WMLDXEAASA-N 2 2 318.465 1.380 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[NH+]2CCC(C)([NH3+])CC2)cc1 ZINC000844223267 702996478 /nfs/dbraw/zinc/99/64/78/702996478.db2.gz UMRPZZUQTPNYMQ-UHFFFAOYSA-N 2 2 304.438 1.182 20 10 DDCDLP CN(C)c1ccc([C@H]([NH3+])CNC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)cc1 ZINC000876506180 705738068 /nfs/dbraw/zinc/73/80/68/705738068.db2.gz GTPRYOUUUMNHAQ-RBSFLKMASA-N 2 2 313.405 1.395 20 10 DDCDLP CN(C)c1ccc([C@H]([NH3+])CNC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)cc1 ZINC000876506180 705738070 /nfs/dbraw/zinc/73/80/70/705738070.db2.gz GTPRYOUUUMNHAQ-RBSFLKMASA-N 2 2 313.405 1.395 20 10 DDCDLP Cc1ccc(C[NH+]2C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C2)c(O)c1 ZINC000877670807 706176377 /nfs/dbraw/zinc/17/63/77/706176377.db2.gz PYCUGASSJAEFSF-IAGOWNOFSA-N 3 2 305.466 1.872 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[N@@H+]1CCC[C@@]12CC[NH2+]C2 ZINC000903870602 711310108 /nfs/dbraw/zinc/31/01/08/711310108.db2.gz NYSWZSPJBZBYSI-SFHVURJKSA-N 2 2 301.434 1.851 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[N@H+]1CCC[C@@]12CC[NH2+]C2 ZINC000903870602 711310111 /nfs/dbraw/zinc/31/01/11/711310111.db2.gz NYSWZSPJBZBYSI-SFHVURJKSA-N 2 2 301.434 1.851 20 10 DDCDLP COc1cccc(C[NH2+][C@@H]2C[NH2+]CC3(CCOCC3)C2)c1O ZINC000903974093 711353584 /nfs/dbraw/zinc/35/35/84/711353584.db2.gz LKBMCQYOXUQKAI-AWEZNQCLSA-N 2 2 306.406 1.649 20 10 DDCDLP COc1ccc(C[NH2+]CCCNC(=O)Cc2[nH]cc[nH+]2)cc1C ZINC001169212088 762284251 /nfs/dbraw/zinc/28/42/51/762284251.db2.gz OSXZEHKYGDSETM-UHFFFAOYSA-N 2 2 316.405 1.565 20 10 DDCDLP CN(C)C1=[NH+]OC2(C1)CC[NH+](Cc1c(O)cc(O)cc1O)CC2 ZINC001144508559 772554976 /nfs/dbraw/zinc/55/49/76/772554976.db2.gz QBDGKALYBWPDHY-UHFFFAOYSA-N 2 2 321.377 1.433 20 10 DDCDLP CC(C)c1ccc(C[NH+]2CC(N3CC[NH+](C)CC3)C2)c(O)c1 ZINC001237054966 889483620 /nfs/dbraw/zinc/48/36/20/889483620.db2.gz JYGCVLRUXLIBGZ-UHFFFAOYSA-N 2 2 303.450 1.947 20 10 DDCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@@H]3CCOC3)CC2)cc1 ZINC000176478323 408377014 /nfs/dbraw/zinc/37/70/14/408377014.db2.gz VHAPTENHASUSET-MRXNPFEDSA-N 2 2 319.449 1.586 20 10 DDCDLP CCOC(=O)C[N@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775648389 698018926 /nfs/dbraw/zinc/01/89/26/698018926.db2.gz GWSSFBXRXFDCLV-UHFFFAOYSA-N 2 2 305.422 1.433 20 10 DDCDLP CCOC(=O)C[N@@H+](C)Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000775648389 698018930 /nfs/dbraw/zinc/01/89/30/698018930.db2.gz GWSSFBXRXFDCLV-UHFFFAOYSA-N 2 2 305.422 1.433 20 10 DDCDLP COc1cc(Cl)cc(C[N@@H+]2CCCO[C@@H](C[NH3+])C2)c1O ZINC000313395063 698682312 /nfs/dbraw/zinc/68/23/12/698682312.db2.gz XBTJAUHAGQEYNC-LBPRGKRZSA-N 2 2 300.786 1.604 20 10 DDCDLP COc1cc(Cl)cc(C[N@H+]2CCCO[C@@H](C[NH3+])C2)c1O ZINC000313395063 698682313 /nfs/dbraw/zinc/68/23/13/698682313.db2.gz XBTJAUHAGQEYNC-LBPRGKRZSA-N 2 2 300.786 1.604 20 10 DDCDLP CN1CCCc2cc(C[NH2+][C@@H](C3CC3)[C@@H]3C[NH2+]CCO3)ccc21 ZINC000817900912 702513787 /nfs/dbraw/zinc/51/37/87/702513787.db2.gz QVJAJKXPLJOYCT-OALUTQOASA-N 2 2 315.461 1.926 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[NH2+][C@@H](C[NH3+])C(C)(C)C)cc1 ZINC000844225702 702997061 /nfs/dbraw/zinc/99/70/61/702997061.db2.gz GKOIKWLUWYDTIE-HNNXBMFYSA-N 2 2 306.454 1.332 20 10 DDCDLP Cc1cc(O)c(C[NH2+]Cc2nc(C[NH3+])cc(=O)[nH]2)c(Cl)c1 ZINC000863648468 705976211 /nfs/dbraw/zinc/97/62/11/705976211.db2.gz WTOAPZJIJHTNKN-UHFFFAOYSA-N 2 2 308.769 1.598 20 10 DDCDLP CN(C)c1ccc(/C=C\C[NH+]2CCC([NH2+]CCO)CC2)cc1 ZINC000873216225 707772183 /nfs/dbraw/zinc/77/21/83/707772183.db2.gz JRAGFUFLMZLQDF-ARJAWSKDSA-N 2 2 303.450 1.812 20 10 DDCDLP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)[C@H]1CCC[NH2+]1 ZINC000925762655 714930350 /nfs/dbraw/zinc/93/03/50/714930350.db2.gz MXQZAUQNJFRFSK-CRAIPNDOSA-N 3 2 302.466 1.669 20 10 DDCDLP CCN(Cc1ccc(N(C)C)cc1)C(=O)C1([NH3+])CC[NH2+]CC1 ZINC001161134764 773556377 /nfs/dbraw/zinc/55/63/77/773556377.db2.gz MSXACBQCEWIPCM-UHFFFAOYSA-N 2 2 304.438 1.182 20 10 DDCDLP C[N@@H+]1CCC[C@@H]1C(=O)N1CC[NH+](Cc2ccc(N)cc2)CC1 ZINC001120371078 781901596 /nfs/dbraw/zinc/90/15/96/781901596.db2.gz OWVJHSPRRXNLSU-MRXNPFEDSA-N 2 2 302.422 1.007 20 10 DDCDLP C[N@H+]1CCC[C@@H]1C(=O)N1CC[NH+](Cc2ccc(N)cc2)CC1 ZINC001120371078 781901601 /nfs/dbraw/zinc/90/16/01/781901601.db2.gz OWVJHSPRRXNLSU-MRXNPFEDSA-N 2 2 302.422 1.007 20 10 DDCDLP CC[N@@H+]1CCO[C@@H]2C[NH+](Cc3ccc(O)c(C)c3O)C[C@@H]2C1 ZINC001140748546 860691874 /nfs/dbraw/zinc/69/18/74/860691874.db2.gz MZSBMEFXBREYCY-GOEBONIOSA-N 2 2 306.406 1.559 20 10 DDCDLP CC[N@H+]1CCO[C@@H]2C[NH+](Cc3ccc(O)c(C)c3O)C[C@@H]2C1 ZINC001140748546 860691876 /nfs/dbraw/zinc/69/18/76/860691876.db2.gz MZSBMEFXBREYCY-GOEBONIOSA-N 2 2 306.406 1.559 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@H+](Cc3ccc(O)c(C)c3O)C[C@@H]2C1 ZINC001140748546 860691879 /nfs/dbraw/zinc/69/18/79/860691879.db2.gz MZSBMEFXBREYCY-GOEBONIOSA-N 2 2 306.406 1.559 20 10 DDCDLP CC[NH+]1CCO[C@@H]2C[N@@H+](Cc3ccc(O)c(C)c3O)C[C@@H]2C1 ZINC001140748546 860691881 /nfs/dbraw/zinc/69/18/81/860691881.db2.gz MZSBMEFXBREYCY-GOEBONIOSA-N 2 2 306.406 1.559 20 10 DDCDLP C[NH2+]C[C@H]1CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001332340730 865774905 /nfs/dbraw/zinc/77/49/05/865774905.db2.gz ZHCAQIJMMLJKBF-MRXNPFEDSA-N 3 2 320.456 1.619 20 10 DDCDLP C[NH2+]C[C@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001332340730 865774917 /nfs/dbraw/zinc/77/49/17/865774917.db2.gz ZHCAQIJMMLJKBF-MRXNPFEDSA-N 3 2 320.456 1.619 20 10 DDCDLP Cc1cc(O)c(C[N@@H+]2C[C@@H](O)[C@@H](C[NH3+])C2)cc1Br ZINC001206492294 872379703 /nfs/dbraw/zinc/37/97/03/872379703.db2.gz TWIIETWRCJVATF-GXFFZTMASA-N 2 2 315.211 1.215 20 10 DDCDLP Cc1cc(O)c(C[N@H+]2C[C@@H](O)[C@@H](C[NH3+])C2)cc1Br ZINC001206492294 872379717 /nfs/dbraw/zinc/37/97/17/872379717.db2.gz TWIIETWRCJVATF-GXFFZTMASA-N 2 2 315.211 1.215 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+](C1CC1)[C@H]1CCC[NH2+]C1 ZINC001236238406 889153370 /nfs/dbraw/zinc/15/33/70/889153370.db2.gz DTRFTODYMDBMFW-IBGZPJMESA-N 3 2 314.477 1.813 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+](C1CC1)[C@H]1CCC[NH2+]C1 ZINC001236238406 889153376 /nfs/dbraw/zinc/15/33/76/889153376.db2.gz DTRFTODYMDBMFW-IBGZPJMESA-N 3 2 314.477 1.813 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH+]3CC4(CC(O)C4)C3)c(F)c2)CC1 ZINC001236929188 889425724 /nfs/dbraw/zinc/42/57/24/889425724.db2.gz ASNBUPSEKVQLLH-UHFFFAOYSA-N 2 2 319.424 1.534 20 10 DDCDLP C[N@@H+]1CCC[C@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000107797433 696631939 /nfs/dbraw/zinc/63/19/39/696631939.db2.gz VUOFEXLAEJKJHG-SFHVURJKSA-N 3 2 302.466 1.622 20 10 DDCDLP C[N@H+]1CCC[C@H]1C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000107797433 696631940 /nfs/dbraw/zinc/63/19/40/696631940.db2.gz VUOFEXLAEJKJHG-SFHVURJKSA-N 3 2 302.466 1.622 20 10 DDCDLP C[N@H+](CCCn1cc[nH+]c1)Cc1cc2c(cc1O)OC[C@H]2O ZINC000768464138 701179614 /nfs/dbraw/zinc/17/96/14/701179614.db2.gz ZZDCLQAIBQXJRP-OAHLLOKOSA-N 2 2 303.362 1.537 20 10 DDCDLP C[N@@H+](CCCn1cc[nH+]c1)Cc1cc2c(cc1O)OC[C@H]2O ZINC000768464138 701179617 /nfs/dbraw/zinc/17/96/17/701179617.db2.gz ZZDCLQAIBQXJRP-OAHLLOKOSA-N 2 2 303.362 1.537 20 10 DDCDLP CC[C@H]([NH2+]CC(=O)N1CC[NH2+]CC1)c1cccc(Cl)c1O ZINC000817945518 702532127 /nfs/dbraw/zinc/53/21/27/702532127.db2.gz FKIWSYIHXFTKMV-ZDUSSCGKSA-N 2 2 311.813 1.518 20 10 DDCDLP C[C@H]([NH2+]CC(=O)N1CC[NH+](C)CC1)c1ccc(Cl)cc1O ZINC000841748365 702556298 /nfs/dbraw/zinc/55/62/98/702556298.db2.gz XBIHHRHTKQKPBR-NSHDSACASA-N 2 2 311.813 1.470 20 10 DDCDLP COc1cccc(O)c1C[NH+]1CCC([N@@H+]2CC[C@H](O)C2)CC1 ZINC000827699667 706052148 /nfs/dbraw/zinc/05/21/48/706052148.db2.gz LDICHPSNZNBHMD-AWEZNQCLSA-N 2 2 306.406 1.432 20 10 DDCDLP COc1cccc(O)c1C[NH+]1CCC([N@H+]2CC[C@H](O)C2)CC1 ZINC000827699667 706052150 /nfs/dbraw/zinc/05/21/50/706052150.db2.gz LDICHPSNZNBHMD-AWEZNQCLSA-N 2 2 306.406 1.432 20 10 DDCDLP C[NH+]1CCN(Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC1 ZINC001324166763 867117529 /nfs/dbraw/zinc/11/75/29/867117529.db2.gz IGJULMOKWDJMGF-UHFFFAOYSA-N 2 2 306.429 1.325 20 10 DDCDLP COc1cc(O)c(C[NH2+][C@@H](C)[C@@H]2C[N@H+](C)CCN2C)cc1OC ZINC001308948998 871538072 /nfs/dbraw/zinc/53/80/72/871538072.db2.gz VVHMVNTVYAHOEX-JSGCOSHPSA-N 2 2 323.437 1.133 20 10 DDCDLP COc1cc(O)c(C[NH2+][C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)cc1OC ZINC001308948998 871538091 /nfs/dbraw/zinc/53/80/91/871538091.db2.gz VVHMVNTVYAHOEX-JSGCOSHPSA-N 2 2 323.437 1.133 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001235118597 888417579 /nfs/dbraw/zinc/41/75/79/888417579.db2.gz FYKYBRYJVDKFKQ-IBGZPJMESA-N 3 2 314.477 1.814 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CCCC[C@@]12CC[NH2+]C2 ZINC001235118597 888417588 /nfs/dbraw/zinc/41/75/88/888417588.db2.gz FYKYBRYJVDKFKQ-IBGZPJMESA-N 3 2 314.477 1.814 20 10 DDCDLP CC[NH2+]C1CC[NH+](Cc2cc3c(cc2O)OCC[NH2+]C3)CC1 ZINC001235725521 888915331 /nfs/dbraw/zinc/91/53/31/888915331.db2.gz JACRGTKZZTWYDJ-UHFFFAOYSA-N 3 2 305.422 1.448 20 10 DDCDLP C[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1cc(F)cc(F)c1O ZINC000756357073 700617212 /nfs/dbraw/zinc/61/72/12/700617212.db2.gz BIYYVLPTSNPGPA-LBPRGKRZSA-N 2 2 313.392 1.959 20 10 DDCDLP C[C@H]([NH2+]CCC[N@@H+]1CCC[C@H](C(N)=O)C1)c1ccc(F)cc1O ZINC000756547789 700627048 /nfs/dbraw/zinc/62/70/48/700627048.db2.gz HKPLXWXFRVPZRS-STQMWFEESA-N 2 2 323.412 1.769 20 10 DDCDLP C[C@H]([NH2+]CCC[N@H+]1CCC[C@H](C(N)=O)C1)c1ccc(F)cc1O ZINC000756547789 700627050 /nfs/dbraw/zinc/62/70/50/700627050.db2.gz HKPLXWXFRVPZRS-STQMWFEESA-N 2 2 323.412 1.769 20 10 DDCDLP C[C@H]([NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1)c1ccc(F)cc1O ZINC000756547788 700627209 /nfs/dbraw/zinc/62/72/09/700627209.db2.gz HKPLXWXFRVPZRS-QWHCGFSZSA-N 2 2 323.412 1.769 20 10 DDCDLP C[C@H]([NH2+]CCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1ccc(F)cc1O ZINC000756547788 700627210 /nfs/dbraw/zinc/62/72/10/700627210.db2.gz HKPLXWXFRVPZRS-QWHCGFSZSA-N 2 2 323.412 1.769 20 10 DDCDLP C[C@@H]1[NH2+]CCC[C@H]1[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000841066271 702333778 /nfs/dbraw/zinc/33/37/78/702333778.db2.gz YZBKBARRPDEBGC-XJKSGUPXSA-N 2 2 307.413 1.892 20 10 DDCDLP CN(C)c1ccc(CN(C)C(=O)C[NH2+][C@H](C[NH3+])C(C)(C)C)cc1 ZINC000844227549 702997399 /nfs/dbraw/zinc/99/73/99/702997399.db2.gz YRTAAYHCJJFYRU-MRXNPFEDSA-N 2 2 320.481 1.674 20 10 DDCDLP CO[C@@H]1C[N@H+](Cc2ccc(N3CCOCC3)cc2)[C@](C)(C[NH3+])C1 ZINC000923413623 714348023 /nfs/dbraw/zinc/34/80/23/714348023.db2.gz WLDCZWPJMPVQKG-ROUUACIJSA-N 2 2 319.449 1.461 20 10 DDCDLP CO[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2)[C@](C)(C[NH3+])C1 ZINC000923413623 714348024 /nfs/dbraw/zinc/34/80/24/714348024.db2.gz WLDCZWPJMPVQKG-ROUUACIJSA-N 2 2 319.449 1.461 20 10 DDCDLP CN(C)c1ccc(C[NH2+]C[C@@H]2C[N@@H+]3CCC[C@H]3CO2)cc1F ZINC001200269517 748183150 /nfs/dbraw/zinc/18/31/50/748183150.db2.gz XHNVAXLKNOQTFN-LSDHHAIUSA-N 2 2 307.413 1.845 20 10 DDCDLP CN(C)c1ccc(C[NH2+]C[C@@H]2C[N@H+]3CCC[C@H]3CO2)cc1F ZINC001200269517 748183152 /nfs/dbraw/zinc/18/31/52/748183152.db2.gz XHNVAXLKNOQTFN-LSDHHAIUSA-N 2 2 307.413 1.845 20 10 DDCDLP COc1ccc(C[NH2+]CCNC(=O)CCc2c[nH]c[nH+]2)cc1C ZINC001128967674 750543864 /nfs/dbraw/zinc/54/38/64/750543864.db2.gz WYZGHDYGIUVKOQ-UHFFFAOYSA-N 2 2 316.405 1.565 20 10 DDCDLP COc1ccc(C[NH2+]CCNC(=O)CCc2c[nH+]c[nH]2)cc1C ZINC001128967674 750543868 /nfs/dbraw/zinc/54/38/68/750543868.db2.gz WYZGHDYGIUVKOQ-UHFFFAOYSA-N 2 2 316.405 1.565 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC001222471159 880490911 /nfs/dbraw/zinc/49/09/11/880490911.db2.gz MGRFNPFRRLCXTD-GOSISDBHSA-N 3 2 300.450 1.424 20 10 DDCDLP c1cc(N2CC[NH2+]CC2)ccc1C[N@H+]1CC[C@]2(CCC[NH2+]2)C1 ZINC001222471159 880490921 /nfs/dbraw/zinc/49/09/21/880490921.db2.gz MGRFNPFRRLCXTD-GOSISDBHSA-N 3 2 300.450 1.424 20 10 DDCDLP CC[NH+]1CCN(c2ccc(OC[C@@H]3C[N@H+](C)CCO3)cc2)CC1 ZINC001234660462 888172456 /nfs/dbraw/zinc/17/24/56/888172456.db2.gz INOGDIXJPQRBPZ-SFHVURJKSA-N 2 2 319.449 1.538 20 10 DDCDLP CC[NH+]1CCN(c2ccc(OC[C@@H]3C[N@@H+](C)CCO3)cc2)CC1 ZINC001234660462 888172470 /nfs/dbraw/zinc/17/24/70/888172470.db2.gz INOGDIXJPQRBPZ-SFHVURJKSA-N 2 2 319.449 1.538 20 10 DDCDLP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(F)c(F)c1O ZINC000187707750 407879652 /nfs/dbraw/zinc/87/96/52/407879652.db2.gz NDLGPYHCWWSQPM-NEPJUHHUSA-N 2 2 313.392 1.957 20 10 DDCDLP CN1CCc2cc(C[NH2+]C[C@@H]3C[N@@H+]4CCC[C@@H]4CO3)ccc21 ZINC000317793929 409868355 /nfs/dbraw/zinc/86/83/55/409868355.db2.gz ZKYPOOJQGPSMTP-IAGOWNOFSA-N 2 2 301.434 1.632 20 10 DDCDLP CN1CCc2cc(C[NH2+]C[C@@H]3C[N@H+]4CCC[C@@H]4CO3)ccc21 ZINC000317793929 409868360 /nfs/dbraw/zinc/86/83/60/409868360.db2.gz ZKYPOOJQGPSMTP-IAGOWNOFSA-N 2 2 301.434 1.632 20 10 DDCDLP COc1ccc([NH+]2CCC(N(C)C(=O)[C@@H]3CC[NH2+]C3)CC2)cc1 ZINC000378211731 418719743 /nfs/dbraw/zinc/71/97/43/418719743.db2.gz RUJOCBCNMUVKPL-CQSZACIVSA-N 2 2 317.433 1.732 20 10 DDCDLP C[NH+]1CCN(C[C@H]2CCC[N@H+](Cc3cccc(F)c3O)C2)CC1 ZINC000377633315 290047168 /nfs/dbraw/zinc/04/71/68/290047168.db2.gz XBPYBVUYFRJDTO-OAHLLOKOSA-N 2 2 321.440 1.991 20 10 DDCDLP C[NH+]1CCN(C[C@H]2CCC[N@@H+](Cc3cccc(F)c3O)C2)CC1 ZINC000377633315 290047170 /nfs/dbraw/zinc/04/71/70/290047170.db2.gz XBPYBVUYFRJDTO-OAHLLOKOSA-N 2 2 321.440 1.991 20 10 DDCDLP C[N@@H+]1CCC[C@@H]1C(=O)N1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000180240407 523819096 /nfs/dbraw/zinc/81/90/96/523819096.db2.gz RBSRMRIOGIQOJM-OAHLLOKOSA-N 2 2 321.396 1.270 20 10 DDCDLP C[N@H+]1CCC[C@@H]1C(=O)N1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000180240407 523819101 /nfs/dbraw/zinc/81/91/01/523819101.db2.gz RBSRMRIOGIQOJM-OAHLLOKOSA-N 2 2 321.396 1.270 20 10 DDCDLP [NH3+]C[C@@H]1C[N@H+](Cc2ccc(N3CCOCC3)c(F)c2)CCCO1 ZINC000841101537 702347254 /nfs/dbraw/zinc/34/72/54/702347254.db2.gz XKIMMDOIINXISM-OAHLLOKOSA-N 2 2 323.412 1.212 20 10 DDCDLP [NH3+]C[C@@H]1C[N@@H+](Cc2ccc(N3CCOCC3)c(F)c2)CCCO1 ZINC000841101537 702347264 /nfs/dbraw/zinc/34/72/64/702347264.db2.gz XKIMMDOIINXISM-OAHLLOKOSA-N 2 2 323.412 1.212 20 10 DDCDLP CN1CCCc2cc(C[NH2+][C@@H](C3CC3)[C@H]3C[NH2+]CCO3)ccc21 ZINC000817900911 702513255 /nfs/dbraw/zinc/51/32/55/702513255.db2.gz QVJAJKXPLJOYCT-MOPGFXCFSA-N 2 2 315.461 1.926 20 10 DDCDLP C[NH+](C)CCN1CC[N@H+](Cc2cc3c(cc2O)CCC3)CC1=O ZINC000844714521 703061352 /nfs/dbraw/zinc/06/13/52/703061352.db2.gz PEZUQHGNEJUQJU-UHFFFAOYSA-N 2 2 317.433 1.087 20 10 DDCDLP C[NH+](C)CCN1CC[N@@H+](Cc2cc3c(cc2O)CCC3)CC1=O ZINC000844714521 703061355 /nfs/dbraw/zinc/06/13/55/703061355.db2.gz PEZUQHGNEJUQJU-UHFFFAOYSA-N 2 2 317.433 1.087 20 10 DDCDLP C[C@@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1cc(F)c(F)cc1O ZINC001205488925 871581251 /nfs/dbraw/zinc/58/12/51/871581251.db2.gz FHTRRICNJMENSO-LBPRGKRZSA-N 2 2 313.392 1.786 20 10 DDCDLP [NH3+]C[C@@]1(O)CCCC[N@H+](Cc2c(O)ccc(F)c2Cl)C1 ZINC001205724924 871754281 /nfs/dbraw/zinc/75/42/81/871754281.db2.gz AREMXRUEWZXGFU-AWEZNQCLSA-N 2 2 302.777 1.860 20 10 DDCDLP [NH3+]C[C@@]1(O)CCCC[N@@H+](Cc2c(O)ccc(F)c2Cl)C1 ZINC001205724924 871754286 /nfs/dbraw/zinc/75/42/86/871754286.db2.gz AREMXRUEWZXGFU-AWEZNQCLSA-N 2 2 302.777 1.860 20 10 DDCDLP [NH3+][C@]12CC[C@H]1C[N@H+](Cc1ccc(N3CCC(O)CC3)cc1)C2 ZINC001235998393 889051653 /nfs/dbraw/zinc/05/16/53/889051653.db2.gz YINJRXBEWCRYMS-YJBOKZPZSA-N 2 2 301.434 1.571 20 10 DDCDLP [NH3+][C@]12CC[C@H]1C[N@@H+](Cc1ccc(N3CCC(O)CC3)cc1)C2 ZINC001235998393 889051663 /nfs/dbraw/zinc/05/16/63/889051663.db2.gz YINJRXBEWCRYMS-YJBOKZPZSA-N 2 2 301.434 1.571 20 10 DDCDLP CC(C)[N@H+](CC(N)=O)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001253969040 896190389 /nfs/dbraw/zinc/19/03/89/896190389.db2.gz YUMXMERETKICBL-UHFFFAOYSA-N 2 2 322.428 1.273 20 10 DDCDLP CC(C)[N@@H+](CC(N)=O)Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001253969040 896190394 /nfs/dbraw/zinc/19/03/94/896190394.db2.gz YUMXMERETKICBL-UHFFFAOYSA-N 2 2 322.428 1.273 20 10 DDCDLP C[C@H]([NH2+]CCC[N@@H+]1CCC[C@H]1C(N)=O)c1ccc(N(C)C)cc1 ZINC000268884747 299293774 /nfs/dbraw/zinc/29/37/74/299293774.db2.gz IJJQKNCHKPSWNN-YOEHRIQHSA-N 2 2 318.465 1.743 20 10 DDCDLP C[C@H]([NH2+]CCC[N@H+]1CCC[C@H]1C(N)=O)c1ccc(N(C)C)cc1 ZINC000268884747 299293775 /nfs/dbraw/zinc/29/37/75/299293775.db2.gz IJJQKNCHKPSWNN-YOEHRIQHSA-N 2 2 318.465 1.743 20 10 DDCDLP C[C@H]([NH2+]CCC[N@@H+]1CCC[C@@H]1C(N)=O)c1cc(F)ccc1O ZINC000273556282 130137207 /nfs/dbraw/zinc/13/72/07/130137207.db2.gz GXEXSSXGELUVKY-SMDDNHRTSA-N 2 2 309.385 1.522 20 10 DDCDLP C[C@H]([NH2+]CCC[N@H+]1CCC[C@@H]1C(N)=O)c1cc(F)ccc1O ZINC000273556282 130137209 /nfs/dbraw/zinc/13/72/09/130137209.db2.gz GXEXSSXGELUVKY-SMDDNHRTSA-N 2 2 309.385 1.522 20 10 DDCDLP CCOc1ccc(O)c(C[N@@H+]2CC[C@H](C[NH+]3CCOCC3)C2)c1 ZINC000093665212 407201397 /nfs/dbraw/zinc/20/13/97/407201397.db2.gz BRMFHINWGIUDOS-OAHLLOKOSA-N 2 2 320.433 1.945 20 10 DDCDLP CCOc1ccc(O)c(C[N@H+]2CC[C@H](C[NH+]3CCOCC3)C2)c1 ZINC000093665212 407201400 /nfs/dbraw/zinc/20/14/00/407201400.db2.gz BRMFHINWGIUDOS-OAHLLOKOSA-N 2 2 320.433 1.945 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@@H+]2CC[C@@H](C[NH+](C)C)C2)cc1 ZINC000114477686 407578931 /nfs/dbraw/zinc/57/89/31/407578931.db2.gz ZVDYGJIVKBCUAW-INIZCTEOSA-N 2 2 318.465 1.252 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@H+]2CC[C@@H](C[NH+](C)C)C2)cc1 ZINC000114477686 407578937 /nfs/dbraw/zinc/57/89/37/407578937.db2.gz ZVDYGJIVKBCUAW-INIZCTEOSA-N 2 2 318.465 1.252 20 10 DDCDLP COc1ccc([NH+]2CCC(N(C)C(=O)[C@@H]3CCC[NH2+]3)CC2)cc1 ZINC000370767304 418747877 /nfs/dbraw/zinc/74/78/77/418747877.db2.gz SRKFVZBCMWOEFX-KRWDZBQOSA-N 2 2 317.433 1.874 20 10 DDCDLP COc1ccc(O)c([C@H](C)[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)c1 ZINC000273595870 295168490 /nfs/dbraw/zinc/16/84/90/295168490.db2.gz QMQCBQWYDVPPNF-WFASDCNBSA-N 2 2 321.421 1.391 20 10 DDCDLP COc1ccc(O)c([C@H](C)[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c1 ZINC000273595870 295168491 /nfs/dbraw/zinc/16/84/91/295168491.db2.gz QMQCBQWYDVPPNF-WFASDCNBSA-N 2 2 321.421 1.391 20 10 DDCDLP Oc1ccccc1C[NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1 ZINC000237949219 526374001 /nfs/dbraw/zinc/37/40/01/526374001.db2.gz ALONCNDBZKXMKF-GOSISDBHSA-N 2 2 312.413 1.901 20 10 DDCDLP Oc1ccccc1C[NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000237949219 526374008 /nfs/dbraw/zinc/37/40/08/526374008.db2.gz ALONCNDBZKXMKF-GOSISDBHSA-N 2 2 312.413 1.901 20 10 DDCDLP COC(=O)N1CCC([NH2+]C[C@@H]([NH3+])c2ccc(N(C)C)cc2)CC1 ZINC000841041307 702320411 /nfs/dbraw/zinc/32/04/11/702320411.db2.gz DYUSGYAINKHEDA-MRXNPFEDSA-N 2 2 320.437 1.573 20 10 DDCDLP C[C@H]1[NH2+]CCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000841063866 702332567 /nfs/dbraw/zinc/33/25/67/702332567.db2.gz RKOQQKLGFUXLNR-QAPCUYQASA-N 3 2 302.466 1.669 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@@]34CCC[C@H]3[NH2+]CC4)cc2)CC1 ZINC000873229817 707778530 /nfs/dbraw/zinc/77/85/30/707778530.db2.gz GKYJJLMDUDFTKF-RTBURBONSA-N 3 2 314.477 1.813 20 10 DDCDLP C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000911667244 710917069 /nfs/dbraw/zinc/91/70/69/710917069.db2.gz PARXFBNWGNJZCJ-BLLLJJGKSA-N 2 2 315.421 1.471 20 10 DDCDLP C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000911667244 710917073 /nfs/dbraw/zinc/91/70/73/710917073.db2.gz PARXFBNWGNJZCJ-BLLLJJGKSA-N 2 2 315.421 1.471 20 10 DDCDLP C[C@H]([NH3+])[C@@H]1CC[N@@H+](Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)C1 ZINC001326232932 861218159 /nfs/dbraw/zinc/21/81/59/861218159.db2.gz UGHATQCCATWMTH-GOEBONIOSA-N 3 2 320.456 1.747 20 10 DDCDLP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@H+]2Cc1cc(Cl)ccc1O ZINC001275277020 852950414 /nfs/dbraw/zinc/95/04/14/852950414.db2.gz RHRFITBGJSQWDR-GASCZTMLSA-N 2 2 309.841 1.866 20 10 DDCDLP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@@H+]2Cc1cc(Cl)ccc1O ZINC001275277020 852950417 /nfs/dbraw/zinc/95/04/17/852950417.db2.gz RHRFITBGJSQWDR-GASCZTMLSA-N 2 2 309.841 1.866 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@@H+]2CC[C@H](C[NH+](C)C)C2)cc1 ZINC000114477688 407578688 /nfs/dbraw/zinc/57/86/88/407578688.db2.gz ZVDYGJIVKBCUAW-MRXNPFEDSA-N 2 2 318.465 1.252 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@H+]2CC[C@H](C[NH+](C)C)C2)cc1 ZINC000114477688 407578693 /nfs/dbraw/zinc/57/86/93/407578693.db2.gz ZVDYGJIVKBCUAW-MRXNPFEDSA-N 2 2 318.465 1.252 20 10 DDCDLP Oc1cc2c(cc1C[NH2+]Cc1c[nH+]c3n1CCCC3)OCO2 ZINC000376759991 418700880 /nfs/dbraw/zinc/70/08/80/418700880.db2.gz YIVJHXUJQYUECQ-UHFFFAOYSA-N 2 2 301.346 1.944 20 10 DDCDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CCC[N@@H+]1CCCO ZINC000840949970 702290451 /nfs/dbraw/zinc/29/04/51/702290451.db2.gz DKRLFVDAEIJGIZ-GOSISDBHSA-N 2 2 305.466 1.997 20 10 DDCDLP Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CCC[N@H+]1CCCO ZINC000840949970 702290454 /nfs/dbraw/zinc/29/04/54/702290454.db2.gz DKRLFVDAEIJGIZ-GOSISDBHSA-N 2 2 305.466 1.997 20 10 DDCDLP C[C@H]1CC[NH2+]C[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000841059303 702329381 /nfs/dbraw/zinc/32/93/81/702329381.db2.gz PRMNLCJRZSAGCM-YJBOKZPZSA-N 3 2 302.466 1.526 20 10 DDCDLP C[C@@H]([NH2+]Cc1nc(C[NH3+])cc(=O)[nH]1)c1cc(F)cc(F)c1O ZINC000854231197 704369446 /nfs/dbraw/zinc/36/94/46/704369446.db2.gz BVKYITFRGVRDFI-SSDOTTSWSA-N 2 2 310.304 1.476 20 10 DDCDLP NC(=O)[C@@H]1CCC[N@@H+]1CCC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000858469300 704715464 /nfs/dbraw/zinc/71/54/64/704715464.db2.gz SXDKRFUDTRDXSS-KBPBESRZSA-N 2 2 303.406 1.309 20 10 DDCDLP NC(=O)[C@@H]1CCC[N@H+]1CCC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000858469300 704715466 /nfs/dbraw/zinc/71/54/66/704715466.db2.gz SXDKRFUDTRDXSS-KBPBESRZSA-N 2 2 303.406 1.309 20 10 DDCDLP C[NH+](C)CCN1CCC2(C[NH+](Cc3c(O)cccc3F)C2)C1 ZINC001276359545 855715159 /nfs/dbraw/zinc/71/51/59/855715159.db2.gz JGDZPBYXVVLBJY-UHFFFAOYSA-N 2 2 307.413 1.601 20 10 DDCDLP Oc1c(Cl)cc(F)cc1C[N@@H+]1CCNC2(CC[NH2+]CC2)C1 ZINC001222105204 880259726 /nfs/dbraw/zinc/25/97/26/880259726.db2.gz VXJSDSUFVRVNSM-UHFFFAOYSA-N 2 2 313.804 1.712 20 10 DDCDLP Oc1c(Cl)cc(F)cc1C[N@H+]1CCNC2(CC[NH2+]CC2)C1 ZINC001222105204 880259737 /nfs/dbraw/zinc/25/97/37/880259737.db2.gz VXJSDSUFVRVNSM-UHFFFAOYSA-N 2 2 313.804 1.712 20 10 DDCDLP CN(C)c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCOCC3)C2)cc1 ZINC000093663787 407200794 /nfs/dbraw/zinc/20/07/94/407200794.db2.gz OQLIYRCITYDUPK-KRWDZBQOSA-N 2 2 303.450 1.907 20 10 DDCDLP CN(C)c1ccc(C[N@H+]2CC[C@@H](C[NH+]3CCOCC3)C2)cc1 ZINC000093663787 407200798 /nfs/dbraw/zinc/20/07/98/407200798.db2.gz OQLIYRCITYDUPK-KRWDZBQOSA-N 2 2 303.450 1.907 20 10 DDCDLP COc1ccc(O)c(C[NH+]2CCN(c3cc[nH+]c(C)n3)CC2)c1 ZINC000184765831 408684758 /nfs/dbraw/zinc/68/47/58/408684758.db2.gz DQTLDKRCFWRWGC-UHFFFAOYSA-N 2 2 314.389 1.821 20 10 DDCDLP CC(C)[C@@](C)(C[NH3+])[NH2+]CC(=O)N(C)Cc1ccc(N(C)C)cc1 ZINC000844220896 702995780 /nfs/dbraw/zinc/99/57/80/702995780.db2.gz ODWRYVQMYNQNSS-GOSISDBHSA-N 2 2 320.481 1.674 20 10 DDCDLP COc1ccc(N2CC[NH+](CCC[NH2+]C[C@@H](C)O)CC2)cc1 ZINC000818942891 704031471 /nfs/dbraw/zinc/03/14/71/704031471.db2.gz LTQXLQOKWCYGKD-OAHLLOKOSA-N 2 2 307.438 1.178 20 10 DDCDLP C[C@H]([NH2+]CCC[N@@H+]1CCC[C@@H](C(N)=O)C1)c1c(O)cccc1F ZINC000886524907 708773195 /nfs/dbraw/zinc/77/31/95/708773195.db2.gz TXYYIIWEINGXMN-QWHCGFSZSA-N 2 2 323.412 1.769 20 10 DDCDLP C[C@H]([NH2+]CCC[N@H+]1CCC[C@@H](C(N)=O)C1)c1c(O)cccc1F ZINC000886524907 708773196 /nfs/dbraw/zinc/77/31/96/708773196.db2.gz TXYYIIWEINGXMN-QWHCGFSZSA-N 2 2 323.412 1.769 20 10 DDCDLP C[NH+]1CCN(c2ccc(CN3CC[NH2+]CC(F)(F)C3)cc2)CC1 ZINC001211340885 875760349 /nfs/dbraw/zinc/76/03/49/875760349.db2.gz DFJPAJINJBVJSG-UHFFFAOYSA-N 2 2 324.419 1.479 20 10 DDCDLP C[NH+]1CCN(C2C[NH+](Cc3ccc4ccccc4c3O)C2)CC1 ZINC001231883917 885920250 /nfs/dbraw/zinc/92/02/50/885920250.db2.gz UZXBNTXRDPKYNW-UHFFFAOYSA-N 2 2 311.429 1.977 20 10 DDCDLP CC(C)(C)c1ccc(C[N@@H+]2CCN3CC[NH2+]C[C@@H]3C2)c(O)c1 ZINC001234978388 888287149 /nfs/dbraw/zinc/28/71/49/888287149.db2.gz KIXULHNYOWQZHF-MRXNPFEDSA-N 2 2 303.450 1.779 20 10 DDCDLP CC(C)(C)c1ccc(C[N@H+]2CCN3CC[NH2+]C[C@@H]3C2)c(O)c1 ZINC001234978388 888287161 /nfs/dbraw/zinc/28/71/61/888287161.db2.gz KIXULHNYOWQZHF-MRXNPFEDSA-N 2 2 303.450 1.779 20 10 DDCDLP COc1cccc(C[N@@H+]2CC[C@@H](C[NH+]3CCOCC3)C2)c1O ZINC000093664962 407199998 /nfs/dbraw/zinc/19/99/98/407199998.db2.gz ZLDGTVMMLROKNQ-AWEZNQCLSA-N 2 2 306.406 1.555 20 10 DDCDLP COc1cccc(C[N@H+]2CC[C@@H](C[NH+]3CCOCC3)C2)c1O ZINC000093664962 407200000 /nfs/dbraw/zinc/20/00/00/407200000.db2.gz ZLDGTVMMLROKNQ-AWEZNQCLSA-N 2 2 306.406 1.555 20 10 DDCDLP Cc1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCC[C@@H]2C(N)=O)c(O)c1C ZINC000273553374 408244593 /nfs/dbraw/zinc/24/45/93/408244593.db2.gz GJIUTIYIBNNAOR-GDBMZVCRSA-N 2 2 319.449 1.999 20 10 DDCDLP Cc1ccc([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@@H]2C(N)=O)c(O)c1C ZINC000273553374 408244595 /nfs/dbraw/zinc/24/45/95/408244595.db2.gz GJIUTIYIBNNAOR-GDBMZVCRSA-N 2 2 319.449 1.999 20 10 DDCDLP CN(C)c1ccc(C[NH2+][C@H](C2CC2)[C@@H]2C[NH2+]CCO2)cc1F ZINC000817900592 702513344 /nfs/dbraw/zinc/51/33/44/702513344.db2.gz ODAPINLCNHCBEQ-DLBZAZTESA-N 2 2 307.413 1.748 20 10 DDCDLP C[N@H+](Cc1ccc(N2CCOCC2)c(F)c1)C1(C[NH3+])CCC1 ZINC000843125006 702825023 /nfs/dbraw/zinc/82/50/23/702825023.db2.gz KYALGSMQOAGGJK-UHFFFAOYSA-N 2 2 307.413 1.976 20 10 DDCDLP C[N@@H+](Cc1ccc(N2CCOCC2)c(F)c1)C1(C[NH3+])CCC1 ZINC000843125006 702825025 /nfs/dbraw/zinc/82/50/25/702825025.db2.gz KYALGSMQOAGGJK-UHFFFAOYSA-N 2 2 307.413 1.976 20 10 DDCDLP C[NH2+]C[C@@H]1CC[N@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 ZINC000844218473 702994815 /nfs/dbraw/zinc/99/48/15/702994815.db2.gz AUZWSPJAEIOEIS-INIZCTEOSA-N 2 2 318.465 1.252 20 10 DDCDLP C[NH2+]C[C@@H]1CC[N@@H+](CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 ZINC000844218473 702994816 /nfs/dbraw/zinc/99/48/16/702994816.db2.gz AUZWSPJAEIOEIS-INIZCTEOSA-N 2 2 318.465 1.252 20 10 DDCDLP C[N@@H+]1CCCN(CCC[NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC000882985216 707885211 /nfs/dbraw/zinc/88/52/11/707885211.db2.gz NIKGZXGOYXCVGD-UHFFFAOYSA-N 2 2 313.392 1.788 20 10 DDCDLP C[N@H+]1CCCN(CCC[NH2+]Cc2cc(F)cc(F)c2O)CC1 ZINC000882985216 707885215 /nfs/dbraw/zinc/88/52/15/707885215.db2.gz NIKGZXGOYXCVGD-UHFFFAOYSA-N 2 2 313.392 1.788 20 10 DDCDLP Oc1c(F)cccc1CN1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC[NH2+]CC1 ZINC000903980059 711356706 /nfs/dbraw/zinc/35/67/06/711356706.db2.gz FMNBTHPIDDYMNG-IYBDPMFKSA-N 2 2 319.424 1.932 20 10 DDCDLP Oc1c(F)cccc1CN1C[C@H]2CC[C@@H](C1)[N@@H+]2C1CC[NH2+]CC1 ZINC000903980059 711356707 /nfs/dbraw/zinc/35/67/07/711356707.db2.gz FMNBTHPIDDYMNG-IYBDPMFKSA-N 2 2 319.424 1.932 20 10 DDCDLP Oc1c(F)cccc1C[N@H+]1C[C@H]2CC[C@@H](C1)N2C1CC[NH2+]CC1 ZINC000903980059 711356711 /nfs/dbraw/zinc/35/67/11/711356711.db2.gz FMNBTHPIDDYMNG-IYBDPMFKSA-N 2 2 319.424 1.932 20 10 DDCDLP Oc1c(F)cccc1C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C1CC[NH2+]CC1 ZINC000903980059 711356715 /nfs/dbraw/zinc/35/67/15/711356715.db2.gz FMNBTHPIDDYMNG-IYBDPMFKSA-N 2 2 319.424 1.932 20 10 DDCDLP CO[C@H]1C[N@H+](Cc2ccc(N3CCOCC3)cc2)[C@@](C)(C[NH3+])C1 ZINC000923413622 714348336 /nfs/dbraw/zinc/34/83/36/714348336.db2.gz WLDCZWPJMPVQKG-QZTJIDSGSA-N 2 2 319.449 1.461 20 10 DDCDLP CO[C@H]1C[N@@H+](Cc2ccc(N3CCOCC3)cc2)[C@@](C)(C[NH3+])C1 ZINC000923413622 714348339 /nfs/dbraw/zinc/34/83/39/714348339.db2.gz WLDCZWPJMPVQKG-QZTJIDSGSA-N 2 2 319.449 1.461 20 10 DDCDLP COc1ccc(C[NH2+]CCNC(=O)CCn2cc[nH+]c2)cc1C ZINC001132081970 768610740 /nfs/dbraw/zinc/61/07/40/768610740.db2.gz HDUZGGOZFPEQDX-UHFFFAOYSA-N 2 2 316.405 1.496 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CC(=O)N[C@@H](C)C3)cc2)CC1 ZINC001140302624 860615207 /nfs/dbraw/zinc/61/52/07/860615207.db2.gz VYEBWQVPDLVMGC-HNNXBMFYSA-N 2 2 316.449 1.149 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC(=O)N[C@@H](C)C3)cc2)CC1 ZINC001140302624 860615211 /nfs/dbraw/zinc/61/52/11/860615211.db2.gz VYEBWQVPDLVMGC-HNNXBMFYSA-N 2 2 316.449 1.149 20 10 DDCDLP C[N@@H+](Cc1ccc(N2CCOCC2)cc1)C[C@@H]1C[NH2+]C(C)(C)O1 ZINC001235691051 888884982 /nfs/dbraw/zinc/88/49/82/888884982.db2.gz GTWKOHNZYUZDRL-KRWDZBQOSA-N 2 2 319.449 1.680 20 10 DDCDLP C[N@H+](Cc1ccc(N2CCOCC2)cc1)C[C@@H]1C[NH2+]C(C)(C)O1 ZINC001235691051 888884999 /nfs/dbraw/zinc/88/49/99/888884999.db2.gz GTWKOHNZYUZDRL-KRWDZBQOSA-N 2 2 319.449 1.680 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@H]3CC[NH+](C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000278530542 484296932 /nfs/dbraw/zinc/29/69/32/484296932.db2.gz VCHVJWYCCXOSFO-BXUZGUMPSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@H]3CC[NH+](C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000278530542 484296937 /nfs/dbraw/zinc/29/69/37/484296937.db2.gz VCHVJWYCCXOSFO-BXUZGUMPSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@H]3CC[N@H+](C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000278530542 484296943 /nfs/dbraw/zinc/29/69/43/484296943.db2.gz VCHVJWYCCXOSFO-BXUZGUMPSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@H]3CC[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000278530542 484296945 /nfs/dbraw/zinc/29/69/45/484296945.db2.gz VCHVJWYCCXOSFO-BXUZGUMPSA-N 2 2 321.377 1.835 20 10 DDCDLP Cc1cc(C)c([C@@H](C)[NH2+]CC(=O)N2CC[NH+](C)CC2)c(O)c1 ZINC000815570181 701898356 /nfs/dbraw/zinc/89/83/56/701898356.db2.gz VBVVYKLCIJFELE-CQSZACIVSA-N 2 2 305.422 1.434 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CCO[C@H](CF)C3)cc2)CC1 ZINC000840954621 702292719 /nfs/dbraw/zinc/29/27/19/702292719.db2.gz LJNYIYGPIMJKKL-QGZVFWFLSA-N 2 2 307.413 1.609 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CCO[C@H](CF)C3)cc2)CC1 ZINC000840954621 702292723 /nfs/dbraw/zinc/29/27/23/702292723.db2.gz LJNYIYGPIMJKKL-QGZVFWFLSA-N 2 2 307.413 1.609 20 10 DDCDLP Fc1cc(C[N@@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)ccc1N1CCOCC1 ZINC000843126996 702825462 /nfs/dbraw/zinc/82/54/62/702825462.db2.gz NTEWNNYEOOCMQT-DOTOQJQBSA-N 2 2 319.424 1.846 20 10 DDCDLP Fc1cc(C[N@H+]2CC[C@H]3[NH2+]CC[C@H]3C2)ccc1N1CCOCC1 ZINC000843126996 702825464 /nfs/dbraw/zinc/82/54/64/702825464.db2.gz NTEWNNYEOOCMQT-DOTOQJQBSA-N 2 2 319.424 1.846 20 10 DDCDLP CC[C@H]1C[N@H+](CC(=O)NCc2ccc(N(C)C)cc2)CC[C@H]1[NH3+] ZINC000844222859 702996098 /nfs/dbraw/zinc/99/60/98/702996098.db2.gz MWLABAUAUQJNKH-DOTOQJQBSA-N 2 2 318.465 1.428 20 10 DDCDLP CC[C@H]1C[N@@H+](CC(=O)NCc2ccc(N(C)C)cc2)CC[C@H]1[NH3+] ZINC000844222859 702996100 /nfs/dbraw/zinc/99/61/00/702996100.db2.gz MWLABAUAUQJNKH-DOTOQJQBSA-N 2 2 318.465 1.428 20 10 DDCDLP C[C@H]([NH2+]Cc1nc(C[NH3+])cc(=O)[nH]1)c1cc(Cl)ccc1O ZINC000854232736 704369873 /nfs/dbraw/zinc/36/98/73/704369873.db2.gz SXXXHZZONGCBFR-QMMMGPOBSA-N 2 2 308.769 1.851 20 10 DDCDLP COc1ccc(C[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)cc1C ZINC000858224312 704681425 /nfs/dbraw/zinc/68/14/25/704681425.db2.gz BKMWVRKYHRXJRD-HNNXBMFYSA-N 2 2 305.422 1.433 20 10 DDCDLP COc1ccc(C[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)cc1C ZINC000858224312 704681427 /nfs/dbraw/zinc/68/14/27/704681427.db2.gz BKMWVRKYHRXJRD-HNNXBMFYSA-N 2 2 305.422 1.433 20 10 DDCDLP COc1c(O)c(C[N@@H+]2C[C@@]3(C)C[NH2+]C[C@@]3(C)C2)ccc1[N+](=O)[O-] ZINC000863649593 705976821 /nfs/dbraw/zinc/97/68/21/705976821.db2.gz AWVCHSXUGDQAGD-IYBDPMFKSA-N 2 2 321.377 1.740 20 10 DDCDLP COc1c(O)c(C[N@H+]2C[C@@]3(C)C[NH2+]C[C@@]3(C)C2)ccc1[N+](=O)[O-] ZINC000863649593 705976822 /nfs/dbraw/zinc/97/68/22/705976822.db2.gz AWVCHSXUGDQAGD-IYBDPMFKSA-N 2 2 321.377 1.740 20 10 DDCDLP NC(=O)C1([NH+]2CCCCC2)CC[NH+](Cc2ccccc2O)CC1 ZINC000895554298 711540350 /nfs/dbraw/zinc/54/03/50/711540350.db2.gz VKICBOACUIKBFE-UHFFFAOYSA-N 2 2 317.433 1.698 20 10 DDCDLP C[C@@H]1CC[NH2+][C@H](C)[C@H]1[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000923369878 714330589 /nfs/dbraw/zinc/33/05/89/714330589.db2.gz MZPDMLNBKQARNG-RKVPGOIHSA-N 2 2 303.450 1.999 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCCC[C@H]3[NH3+])cc2F)CC1 ZINC001329096566 863473509 /nfs/dbraw/zinc/47/35/09/863473509.db2.gz YRFXDWREJYXIJR-IAGOWNOFSA-N 3 2 320.456 1.937 20 10 DDCDLP C[C@@H]1CC[C@H](C[NH3+])[N@H+](Cc2ccc(N3CC[NH2+]CC3)cc2O)C1 ZINC001205844831 871857943 /nfs/dbraw/zinc/85/79/43/871857943.db2.gz YMORCAPIGVAPLJ-RHSMWYFYSA-N 3 2 318.465 1.361 20 10 DDCDLP C[C@@H]1CC[C@H](C[NH3+])[N@@H+](Cc2ccc(N3CC[NH2+]CC3)cc2O)C1 ZINC001205844831 871857964 /nfs/dbraw/zinc/85/79/64/871857964.db2.gz YMORCAPIGVAPLJ-RHSMWYFYSA-N 2 2 318.465 1.361 20 10 DDCDLP Nc1ccc(N(Cc2ccccc2)C(=O)C2([NH3+])CC[NH2+]CC2)cc1 ZINC001218955699 877830136 /nfs/dbraw/zinc/83/01/36/877830136.db2.gz OSMCHZWOXPIDEZ-UHFFFAOYSA-N 2 2 324.428 1.883 20 10 DDCDLP CN(C)c1ccc(C[N@@H+]2CCN3CC[NH2+]C[C@H]3C2)c2ccccc21 ZINC001234975268 888285350 /nfs/dbraw/zinc/28/53/50/888285350.db2.gz QECOLTFGUGSELW-KRWDZBQOSA-N 2 2 324.472 1.995 20 10 DDCDLP CN(C)c1ccc(C[N@H+]2CCN3CC[NH2+]C[C@H]3C2)c2ccccc21 ZINC001234975268 888285365 /nfs/dbraw/zinc/28/53/65/888285365.db2.gz QECOLTFGUGSELW-KRWDZBQOSA-N 2 2 324.472 1.995 20 10 DDCDLP Oc1cc(Cl)c(Cl)cc1CN1CC[NH2+]C[C@]12CC[NH2+]C2 ZINC001234988191 888303810 /nfs/dbraw/zinc/30/38/10/888303810.db2.gz JCZLDTBDPIYMMI-CQSZACIVSA-N 2 2 316.232 1.836 20 10 DDCDLP COc1cc(N2CC[NH2+]CC2)ccc1-c1cc[nH+]c2c1CCN2 ZINC001244289092 891827273 /nfs/dbraw/zinc/82/72/73/891827273.db2.gz UFFQUJMNEHBISO-UHFFFAOYSA-N 2 2 310.401 1.778 20 10 DDCDLP Cc1cc(O)c(C[NH2+]CC(=O)N2CC[NH+](C)CC2)c(Cl)c1 ZINC000840887108 702271945 /nfs/dbraw/zinc/27/19/45/702271945.db2.gz DMSSNQMPBVACRC-UHFFFAOYSA-N 2 2 311.813 1.218 20 10 DDCDLP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CCO1)c1ccc(N2CCOCC2)c(F)c1 ZINC000817983295 702543442 /nfs/dbraw/zinc/54/34/42/702543442.db2.gz MCZHQXXCILJZIM-HIFRSBDPSA-N 2 2 323.412 1.301 20 10 DDCDLP C[C@@H]1C[N@H+](CC(=O)NCc2ccc(N(C)C)cc2)CC[C@@H]1[NH3+] ZINC000844219907 702995098 /nfs/dbraw/zinc/99/50/98/702995098.db2.gz OKVOJBQRRRVLFH-CJNGLKHVSA-N 2 2 304.438 1.038 20 10 DDCDLP C[C@@H]1C[N@@H+](CC(=O)NCc2ccc(N(C)C)cc2)CC[C@@H]1[NH3+] ZINC000844219907 702995100 /nfs/dbraw/zinc/99/51/00/702995100.db2.gz OKVOJBQRRRVLFH-CJNGLKHVSA-N 2 2 304.438 1.038 20 10 DDCDLP COCC[N@H+](C)C[C@@H](O)C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000846861097 703343497 /nfs/dbraw/zinc/34/34/97/703343497.db2.gz NWLABWKWAGKTIC-PBHICJAKSA-N 2 2 309.454 1.342 20 10 DDCDLP COCC[N@@H+](C)C[C@@H](O)C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000846861097 703343498 /nfs/dbraw/zinc/34/34/98/703343498.db2.gz NWLABWKWAGKTIC-PBHICJAKSA-N 2 2 309.454 1.342 20 10 DDCDLP COc1ccc(N2CC[NH+](C[C@@H]3CC[NH2+]C3)CC2)c(OC)c1 ZINC000866697283 706767563 /nfs/dbraw/zinc/76/75/63/706767563.db2.gz LZJLOFFAFTWGIF-CQSZACIVSA-N 2 2 305.422 1.435 20 10 DDCDLP COc1ccc(N2CC[C@H]([NH2+][C@@H](C)C[C@@H]3COCC[NH2+]3)C2)cc1 ZINC000854216717 704367341 /nfs/dbraw/zinc/36/73/41/704367341.db2.gz DHRYTJMZQQWIRA-HRCADAONSA-N 2 2 319.449 1.631 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@H]4CCC[C@@]4([NH3+])C3)cc2)CC1 ZINC000857226249 704565960 /nfs/dbraw/zinc/56/59/60/704565960.db2.gz JAYUETDJVOHKSC-IEBWSBKVSA-N 3 2 314.477 1.752 20 10 DDCDLP COc1cccc([C@@H](C)[NH2+]CCC[N@@H+]2CCC[C@H]2C(N)=O)c1O ZINC000858468352 704715103 /nfs/dbraw/zinc/71/51/03/704715103.db2.gz FBJJEECREUFAPW-OCCSQVGLSA-N 2 2 321.421 1.391 20 10 DDCDLP COc1cccc([C@@H](C)[NH2+]CCC[N@H+]2CCC[C@H]2C(N)=O)c1O ZINC000858468352 704715105 /nfs/dbraw/zinc/71/51/05/704715105.db2.gz FBJJEECREUFAPW-OCCSQVGLSA-N 2 2 321.421 1.391 20 10 DDCDLP C[NH2+]C[C@H](C)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001325267246 867900485 /nfs/dbraw/zinc/90/04/85/867900485.db2.gz KSXDNVGVGGJVGG-AWEZNQCLSA-N 3 2 308.445 1.523 20 10 DDCDLP Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CC(=O)N1CC[NH+](C)CC1 ZINC001325338998 867954173 /nfs/dbraw/zinc/95/41/73/867954173.db2.gz FTTCXDNHKZKKSP-ZIAGYGMSSA-N 2 2 317.433 1.613 20 10 DDCDLP C[NH+]1CCN(C2C[NH+](Cc3ccc(N4CCCC4)cc3)C2)CC1 ZINC001204328571 871059300 /nfs/dbraw/zinc/05/93/00/871059300.db2.gz JQRVDQFELPBKBI-UHFFFAOYSA-N 2 2 314.477 1.718 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H]([NH3+])[C@H]3C)cc2)CC1 ZINC001205182839 871415731 /nfs/dbraw/zinc/41/57/31/871415731.db2.gz NJRDBXYIBUFQTJ-CRAIPNDOSA-N 3 2 302.466 1.750 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CC[C@@H]([NH3+])[C@H]3C)cc2)CC1 ZINC001205182839 871415739 /nfs/dbraw/zinc/41/57/39/871415739.db2.gz NJRDBXYIBUFQTJ-CRAIPNDOSA-N 3 2 302.466 1.750 20 10 DDCDLP COc1cccc(C[N@@H+]2CCC[C@H](C[NH+]3CCOCC3)C2)c1O ZINC000093017853 193194194 /nfs/dbraw/zinc/19/41/94/193194194.db2.gz KANTXIGDKFHXDG-OAHLLOKOSA-N 2 2 320.433 1.945 20 10 DDCDLP COc1cccc(C[N@H+]2CCC[C@H](C[NH+]3CCOCC3)C2)c1O ZINC000093017853 193194196 /nfs/dbraw/zinc/19/41/96/193194196.db2.gz KANTXIGDKFHXDG-OAHLLOKOSA-N 2 2 320.433 1.945 20 10 DDCDLP COc1c(O)c(C[NH2+][C@@H](C)Cn2cc[nH+]c2)ccc1[N+](=O)[O-] ZINC000278866121 130723808 /nfs/dbraw/zinc/72/38/08/130723808.db2.gz MKPXFZSAPDEXOO-JTQLQIEISA-N 2 2 306.322 1.684 20 10 DDCDLP C[NH+]1CCN(CCC[NH2+]Cc2cc(Cl)c(F)cc2O)CC1 ZINC000293554281 409137926 /nfs/dbraw/zinc/13/79/26/409137926.db2.gz HIDZTTPPCTUJMF-UHFFFAOYSA-N 2 2 315.820 1.912 20 10 DDCDLP NC(=O)[C@H]1CCC[N@@H+]1CCC[NH2+]Cc1c(O)cccc1Cl ZINC000264937110 527004489 /nfs/dbraw/zinc/00/44/89/527004489.db2.gz DPAARQAJKYUFMP-CYBMUJFWSA-N 2 2 311.813 1.475 20 10 DDCDLP NC(=O)[C@H]1CCC[N@H+]1CCC[NH2+]Cc1c(O)cccc1Cl ZINC000264937110 527004496 /nfs/dbraw/zinc/00/44/96/527004496.db2.gz DPAARQAJKYUFMP-CYBMUJFWSA-N 2 2 311.813 1.475 20 10 DDCDLP c1cn2c([nH+]1)C[C@@H]([NH2+]Cc1ccc(N3CCOCC3)cc1)CC2 ZINC000778189177 698248023 /nfs/dbraw/zinc/24/80/23/698248023.db2.gz ONHWUMNONGTKHB-INIZCTEOSA-N 2 2 312.417 1.824 20 10 DDCDLP C[C@H]([NH2+]C[C@H](O)C[NH+](C)C)c1ccc(Br)cc1O ZINC000756556353 700627875 /nfs/dbraw/zinc/62/78/75/700627875.db2.gz NVIBKCLJSBITET-ONGXEEELSA-N 2 2 317.227 1.728 20 10 DDCDLP C[C@H]1CC[N@H+](CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000771843443 701333927 /nfs/dbraw/zinc/33/39/27/701333927.db2.gz PXWGDYVWCQZHKD-KRWDZBQOSA-N 3 2 316.493 1.870 20 10 DDCDLP C[C@H]1CC[N@@H+](CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000771843443 701333928 /nfs/dbraw/zinc/33/39/28/701333928.db2.gz PXWGDYVWCQZHKD-KRWDZBQOSA-N 3 2 316.493 1.870 20 10 DDCDLP CN(C)c1ccc([C@@H]([NH3+])C[NH2+][C@H]2CCC(=O)NC2(C)C)cc1 ZINC000817942526 702531719 /nfs/dbraw/zinc/53/17/19/702531719.db2.gz PKAKFNIKVVHFLN-GJZGRUSLSA-N 2 2 304.438 1.399 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000843127309 702825324 /nfs/dbraw/zinc/82/53/24/702825324.db2.gz PSLMRQIYKGWGGY-PWSUYJOCSA-N 2 2 307.350 1.493 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@@H]3[NH2+]CC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000843127309 702825325 /nfs/dbraw/zinc/82/53/25/702825325.db2.gz PSLMRQIYKGWGGY-PWSUYJOCSA-N 2 2 307.350 1.493 20 10 DDCDLP COc1cccc(O)c1C[NH+]1CCN(c2[nH+]ccn2C)CC1 ZINC000827891381 706082917 /nfs/dbraw/zinc/08/29/17/706082917.db2.gz JFFWSCWITXYDOC-UHFFFAOYSA-N 2 2 302.378 1.457 20 10 DDCDLP C[NH+](C)CCN(CC[NH+](C)C)Cc1ccc(F)c(F)c1O ZINC000877525571 706132049 /nfs/dbraw/zinc/13/20/49/706132049.db2.gz HVSDHIQJFAEMCH-UHFFFAOYSA-N 2 2 301.381 1.596 20 10 DDCDLP COc1ccc(C[NH2+][C@H]2CCn3cc[nH+]c3C2)c(O)c1OC ZINC000893706945 710787501 /nfs/dbraw/zinc/78/75/01/710787501.db2.gz MXCQCJKLPIAAJI-LBPRGKRZSA-N 2 2 303.362 1.711 20 10 DDCDLP CC[NH+](CC)CCN1CC[NH+](Cc2c(O)cccc2F)CC1 ZINC001137831641 750254819 /nfs/dbraw/zinc/25/48/19/750254819.db2.gz IGQJHRMHSAWVEF-UHFFFAOYSA-N 2 2 309.429 1.991 20 10 DDCDLP COc1ccc(C[NH2+]CCNC(=O)Cc2c[nH+]cn2C)cc1C ZINC001147878078 773283772 /nfs/dbraw/zinc/28/37/72/773283772.db2.gz RFCCEJFITUUFEA-UHFFFAOYSA-N 2 2 316.405 1.186 20 10 DDCDLP C[C@H](C(=O)NC[C@H]([NH3+])c1ccc(N(C)C)cc1)n1cc[nH+]c1 ZINC001327182069 861948685 /nfs/dbraw/zinc/94/86/85/861948685.db2.gz VXOIHQAUDHABHP-DOMZBBRYSA-N 2 2 301.394 1.326 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[NH+]3CC4(CCN4C)C3)cc2)CC1 ZINC001275194965 852881497 /nfs/dbraw/zinc/88/14/97/852881497.db2.gz VRCAFZDVHYESNT-UHFFFAOYSA-N 2 2 314.477 1.718 20 10 DDCDLP CC[NH+](CC)CCN1CC[NH+](Cc2ccc(O)c(O)c2)CC1 ZINC001203874145 870809681 /nfs/dbraw/zinc/80/96/81/870809681.db2.gz QBQSSUILLJOHSB-UHFFFAOYSA-N 2 2 307.438 1.557 20 10 DDCDLP COc1ccc(N2CC[NH+](CCC[NH2+][C@@H](C)[C@@H](C)O)CC2)cc1 ZINC001345604845 873452530 /nfs/dbraw/zinc/45/25/30/873452530.db2.gz GHAPCYHXXLYPCF-JKSUJKDBSA-N 2 2 321.465 1.566 20 10 DDCDLP C[C@H]1C[C@H]([NH3+])CC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001349673341 875295867 /nfs/dbraw/zinc/29/58/67/875295867.db2.gz DROLQUULOOIVDT-GOEBONIOSA-N 3 2 320.456 1.889 20 10 DDCDLP C[C@H]1C[C@H]([NH3+])CC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001349673341 875295881 /nfs/dbraw/zinc/29/58/81/875295881.db2.gz DROLQUULOOIVDT-GOEBONIOSA-N 3 2 320.456 1.889 20 10 DDCDLP CN1CC[NH+](CC2CC[NH+](Cc3cccc(F)c3O)CC2)CC1 ZINC000289381580 131381016 /nfs/dbraw/zinc/38/10/16/131381016.db2.gz COXSTXAGYGLYAD-UHFFFAOYSA-N 2 2 321.440 1.991 20 10 DDCDLP CN(C)c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCOCC3)C2)cc1 ZINC000093663786 407201119 /nfs/dbraw/zinc/20/11/19/407201119.db2.gz OQLIYRCITYDUPK-QGZVFWFLSA-N 2 2 303.450 1.907 20 10 DDCDLP CN(C)c1ccc(C[N@H+]2CC[C@H](C[NH+]3CCOCC3)C2)cc1 ZINC000093663786 407201120 /nfs/dbraw/zinc/20/11/20/407201120.db2.gz OQLIYRCITYDUPK-QGZVFWFLSA-N 2 2 303.450 1.907 20 10 DDCDLP C[C@H]([NH2+]C[C@H](O)C[NH+]1CCCC1)c1ccc(F)c(F)c1O ZINC000276904186 408901864 /nfs/dbraw/zinc/90/18/64/408901864.db2.gz JNCXISHTAUQGDX-QWRGUYRKSA-N 2 2 300.349 1.778 20 10 DDCDLP c1[nH]c2c([nH+]1)CC[C@H]([NH2+]Cc1ccc(N3CCOCC3)cc1)C2 ZINC000368092017 418688686 /nfs/dbraw/zinc/68/86/86/418688686.db2.gz ZFQHVBNWCZCVDQ-HNNXBMFYSA-N 2 2 312.417 1.893 20 10 DDCDLP c1[nH]c2c([nH+]1)C[C@@H]([NH2+]Cc1ccc(N3CCOCC3)cc1)CC2 ZINC000368092017 418688688 /nfs/dbraw/zinc/68/86/88/418688688.db2.gz ZFQHVBNWCZCVDQ-HNNXBMFYSA-N 2 2 312.417 1.893 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@@H]3CC[NH+](C)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000278530544 484296176 /nfs/dbraw/zinc/29/61/76/484296176.db2.gz VCHVJWYCCXOSFO-FZMZJTMJSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@@H]3CC[NH+](C)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000278530544 484296182 /nfs/dbraw/zinc/29/61/82/484296182.db2.gz VCHVJWYCCXOSFO-FZMZJTMJSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@@H]3CC[N@H+](C)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000278530544 484296190 /nfs/dbraw/zinc/29/61/90/484296190.db2.gz VCHVJWYCCXOSFO-FZMZJTMJSA-N 2 2 321.377 1.835 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000278530544 484296195 /nfs/dbraw/zinc/29/61/95/484296195.db2.gz VCHVJWYCCXOSFO-FZMZJTMJSA-N 2 2 321.377 1.835 20 10 DDCDLP C[C@@H]1CC[N@H+](CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000771843446 701333920 /nfs/dbraw/zinc/33/39/20/701333920.db2.gz PXWGDYVWCQZHKD-QGZVFWFLSA-N 3 2 316.493 1.870 20 10 DDCDLP C[C@@H]1CC[N@@H+](CC[NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1 ZINC000771843446 701333921 /nfs/dbraw/zinc/33/39/21/701333921.db2.gz PXWGDYVWCQZHKD-QGZVFWFLSA-N 3 2 316.493 1.870 20 10 DDCDLP Oc1c(Br)cccc1C[NH2+]C[C@H]1C[NH2+]CCCO1 ZINC000841085639 702340174 /nfs/dbraw/zinc/34/01/74/702340174.db2.gz JDNNEKFVTHLZGL-LLVKDONJSA-N 2 2 315.211 1.623 20 10 DDCDLP CC[N@H+](C)C[C@@H](O)C[NH+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000846765947 703328349 /nfs/dbraw/zinc/32/83/49/703328349.db2.gz GGFJXCXCJOVURW-GOSISDBHSA-N 2 2 321.465 1.268 20 10 DDCDLP CC[N@@H+](C)C[C@@H](O)C[NH+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000846765947 703328351 /nfs/dbraw/zinc/32/83/51/703328351.db2.gz GGFJXCXCJOVURW-GOSISDBHSA-N 2 2 321.465 1.268 20 10 DDCDLP CC[NH+](C)C[C@@H](O)C[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000846765947 703328353 /nfs/dbraw/zinc/32/83/53/703328353.db2.gz GGFJXCXCJOVURW-GOSISDBHSA-N 2 2 321.465 1.268 20 10 DDCDLP CC[NH+](C)C[C@@H](O)C[N@@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000846765947 703328355 /nfs/dbraw/zinc/32/83/55/703328355.db2.gz GGFJXCXCJOVURW-GOSISDBHSA-N 2 2 321.465 1.268 20 10 DDCDLP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)[C@@H]2C[C@H]2c2c[nH]c[nH+]2)cc1 ZINC000876506179 705738077 /nfs/dbraw/zinc/73/80/77/705738077.db2.gz GTPRYOUUUMNHAQ-KFWWJZLASA-N 2 2 313.405 1.395 20 10 DDCDLP CN(C)c1ccc([C@@H]([NH3+])CNC(=O)[C@@H]2C[C@H]2c2c[nH+]c[nH]2)cc1 ZINC000876506179 705738080 /nfs/dbraw/zinc/73/80/80/705738080.db2.gz GTPRYOUUUMNHAQ-KFWWJZLASA-N 2 2 313.405 1.395 20 10 DDCDLP C[NH+](C)CCN1CCC2(C[NH+](Cc3ccc(O)c(O)c3)C2)C1 ZINC001275821239 853817788 /nfs/dbraw/zinc/81/77/88/853817788.db2.gz LDGUPBCSQVSDRO-UHFFFAOYSA-N 2 2 305.422 1.167 20 10 DDCDLP CN(C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(O)cc1O ZINC001275953274 854011754 /nfs/dbraw/zinc/01/17/54/854011754.db2.gz VQZLHCCBFRPHFK-MQVJKMGUSA-N 2 2 319.449 1.744 20 10 DDCDLP CN(C)CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(O)cc1O ZINC001275953274 854011759 /nfs/dbraw/zinc/01/17/59/854011759.db2.gz VQZLHCCBFRPHFK-MQVJKMGUSA-N 2 2 319.449 1.744 20 10 DDCDLP C[NH+]1CCN(c2ccc(CNCC(F)(F)C[NH3+])cc2F)CC1 ZINC001325317700 867939768 /nfs/dbraw/zinc/93/97/68/867939768.db2.gz CHIALZZFAGGZFM-UHFFFAOYSA-N 2 2 316.371 1.261 20 10 DDCDLP Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CC(=O)N1CC[NH+](C)CC1 ZINC001325338992 867954492 /nfs/dbraw/zinc/95/44/92/867954492.db2.gz FTTCXDNHKZKKSP-KBPBESRZSA-N 2 2 317.433 1.613 20 10 DDCDLP C[NH+](C)CCC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)c(F)c1 ZINC001308178942 871477219 /nfs/dbraw/zinc/47/72/19/871477219.db2.gz CFABPFWWOVXBGB-UHFFFAOYSA-N 3 2 308.445 1.619 20 10 DDCDLP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(F)c(F)c1O ZINC000187707732 407879907 /nfs/dbraw/zinc/87/99/07/407879907.db2.gz NDLGPYHCWWSQPM-RYUDHWBXSA-N 2 2 313.392 1.957 20 10 DDCDLP Cc1cccc(C[NH+]2CCC(N3CC[N@@H+](C)CC3=O)CC2)c1O ZINC000374728477 418558182 /nfs/dbraw/zinc/55/81/82/418558182.db2.gz DLYFSLXTUXCPNJ-UHFFFAOYSA-N 2 2 317.433 1.439 20 10 DDCDLP Cc1cccc(C[NH+]2CCC(N3CC[N@H+](C)CC3=O)CC2)c1O ZINC000374728477 418558186 /nfs/dbraw/zinc/55/81/86/418558186.db2.gz DLYFSLXTUXCPNJ-UHFFFAOYSA-N 2 2 317.433 1.439 20 10 DDCDLP COc1ccc(O)c(C[NH+]2CCC([N@H+](C)CCCO)CC2)c1 ZINC000180248326 524737091 /nfs/dbraw/zinc/73/70/91/524737091.db2.gz XCCIJCXOVJQBCA-UHFFFAOYSA-N 2 2 308.422 1.679 20 10 DDCDLP COc1ccc(O)c(C[NH+]2CCC([N@@H+](C)CCCO)CC2)c1 ZINC000180248326 524737099 /nfs/dbraw/zinc/73/70/99/524737099.db2.gz XCCIJCXOVJQBCA-UHFFFAOYSA-N 2 2 308.422 1.679 20 10 DDCDLP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756555979 700627899 /nfs/dbraw/zinc/62/78/99/700627899.db2.gz YJSDXGFDTZMFHC-NEPJUHHUSA-N 2 2 313.392 1.957 20 10 DDCDLP Oc1ccccc1C[NH+]1CCC(c2nnc3n2CC[NH2+]C3)CC1 ZINC000843118538 702822888 /nfs/dbraw/zinc/82/28/88/702822888.db2.gz KHJXHZJFJNDGDD-UHFFFAOYSA-N 2 2 313.405 1.467 20 10 DDCDLP CC[C@H]([NH2+]CCC[N@@H+]1CCC[C@@H]1C(N)=O)c1ccc(F)cc1O ZINC000286161828 131223107 /nfs/dbraw/zinc/22/31/07/131223107.db2.gz PWWTVMGTPFZLIP-LSDHHAIUSA-N 2 2 323.412 1.912 20 10 DDCDLP CC[C@H]([NH2+]CCC[N@H+]1CCC[C@@H]1C(N)=O)c1ccc(F)cc1O ZINC000286161828 131223108 /nfs/dbraw/zinc/22/31/08/131223108.db2.gz PWWTVMGTPFZLIP-LSDHHAIUSA-N 2 2 323.412 1.912 20 10 DDCDLP COc1cc(O)c(C[N@@H+]2CC[C@H]3CC[NH+](C)C[C@@H]32)cc1OC ZINC000272352014 407882000 /nfs/dbraw/zinc/88/20/00/407882000.db2.gz YGHRAFLEJFFERA-OCCSQVGLSA-N 2 2 306.406 1.935 20 10 DDCDLP COc1cc(O)c(C[N@H+]2CC[C@H]3CC[NH+](C)C[C@@H]32)cc1OC ZINC000272352014 407882006 /nfs/dbraw/zinc/88/20/06/407882006.db2.gz YGHRAFLEJFFERA-OCCSQVGLSA-N 2 2 306.406 1.935 20 10 DDCDLP COc1cc(O)c(C[NH+]2CC[C@H]3CC[N@H+](C)C[C@@H]32)cc1OC ZINC000272352014 407882011 /nfs/dbraw/zinc/88/20/11/407882011.db2.gz YGHRAFLEJFFERA-OCCSQVGLSA-N 2 2 306.406 1.935 20 10 DDCDLP COc1cc(O)c(C[NH+]2CC[C@H]3CC[N@@H+](C)C[C@@H]32)cc1OC ZINC000272352014 407882020 /nfs/dbraw/zinc/88/20/20/407882020.db2.gz YGHRAFLEJFFERA-OCCSQVGLSA-N 2 2 306.406 1.935 20 10 DDCDLP COC(=O)CCC[NH+]1CCC([NH2+]Cc2ccccc2O)CC1 ZINC000291305257 408863283 /nfs/dbraw/zinc/86/32/83/408863283.db2.gz XBSXVDUMFPZAGE-UHFFFAOYSA-N 2 2 306.406 1.899 20 10 DDCDLP C[N@@H+]1CCC[C@H]1C(=O)N1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000180240425 523844862 /nfs/dbraw/zinc/84/48/62/523844862.db2.gz RBSRMRIOGIQOJM-HNNXBMFYSA-N 2 2 321.396 1.270 20 10 DDCDLP C[N@H+]1CCC[C@H]1C(=O)N1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000180240425 523844869 /nfs/dbraw/zinc/84/48/69/523844869.db2.gz RBSRMRIOGIQOJM-HNNXBMFYSA-N 2 2 321.396 1.270 20 10 DDCDLP C[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(F)c(F)c1O ZINC000191188540 525437326 /nfs/dbraw/zinc/43/73/26/525437326.db2.gz LQNJUJARZBTLRJ-GFCCVEGCSA-N 2 2 313.392 1.959 20 10 DDCDLP CCOc1cccc(C[N@H+]2C[C@@H](c3cnn(C)c3)[C@H]([NH3+])C2)c1O ZINC000818431699 702647618 /nfs/dbraw/zinc/64/76/18/702647618.db2.gz RCJQVIVUNQEGKI-LSDHHAIUSA-N 2 2 316.405 1.451 20 10 DDCDLP CCOc1cccc(C[N@@H+]2C[C@@H](c3cnn(C)c3)[C@H]([NH3+])C2)c1O ZINC000818431699 702647620 /nfs/dbraw/zinc/64/76/20/702647620.db2.gz RCJQVIVUNQEGKI-LSDHHAIUSA-N 2 2 316.405 1.451 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[N@@H+]1CCC[C@]12CC[NH2+]C2 ZINC000903870601 711310256 /nfs/dbraw/zinc/31/02/56/711310256.db2.gz NYSWZSPJBZBYSI-GOSISDBHSA-N 2 2 301.434 1.851 20 10 DDCDLP c1cc(N2CCOCC2)ccc1C[N@H+]1CCC[C@]12CC[NH2+]C2 ZINC000903870601 711310257 /nfs/dbraw/zinc/31/02/57/711310257.db2.gz NYSWZSPJBZBYSI-GOSISDBHSA-N 2 2 301.434 1.851 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H]([NH3+])C(C)(C)C3)cc2)CC1 ZINC000903987194 711360015 /nfs/dbraw/zinc/36/00/15/711360015.db2.gz YEPVGOOCQHPXRN-QGZVFWFLSA-N 3 2 302.466 1.608 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H]([NH3+])C(C)(C)C3)cc2)CC1 ZINC000903987194 711360020 /nfs/dbraw/zinc/36/00/20/711360020.db2.gz YEPVGOOCQHPXRN-QGZVFWFLSA-N 3 2 302.466 1.608 20 10 DDCDLP COCC[N@H+](Cc1c(O)cc(O)cc1O)C1CC[NH+](C)CC1 ZINC001144509575 772557082 /nfs/dbraw/zinc/55/70/82/772557082.db2.gz ZZVCMTGHJXVJPA-UHFFFAOYSA-N 2 2 310.394 1.346 20 10 DDCDLP COCC[N@@H+](Cc1c(O)cc(O)cc1O)C1CC[NH+](C)CC1 ZINC001144509575 772557086 /nfs/dbraw/zinc/55/70/86/772557086.db2.gz ZZVCMTGHJXVJPA-UHFFFAOYSA-N 2 2 310.394 1.346 20 10 DDCDLP COC[C@H]1COCC[N@@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139411183 860391184 /nfs/dbraw/zinc/39/11/84/860391184.db2.gz YFXHIDCXAFAZTR-SFHVURJKSA-N 2 2 319.449 1.286 20 10 DDCDLP COC[C@H]1COCC[N@H+]1Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001139411183 860391190 /nfs/dbraw/zinc/39/11/90/860391190.db2.gz YFXHIDCXAFAZTR-SFHVURJKSA-N 2 2 319.449 1.286 20 10 DDCDLP FC1(F)C[NH2+]CCN(Cc2ccc(N3CC[NH2+]CC3)cc2)C1 ZINC001211340862 875759168 /nfs/dbraw/zinc/75/91/68/875759168.db2.gz CTPMKNVMVADCCR-UHFFFAOYSA-N 2 2 310.392 1.137 20 10 DDCDLP CC[N@H+](CCO)CC[NH2+]Cc1cc(Br)ccc1O ZINC000184550541 408639910 /nfs/dbraw/zinc/63/99/10/408639910.db2.gz RJYZMJRMIVTRLG-UHFFFAOYSA-N 2 2 317.227 1.559 20 10 DDCDLP CC[N@@H+](CCO)CC[NH2+]Cc1cc(Br)ccc1O ZINC000184550541 408639915 /nfs/dbraw/zinc/63/99/15/408639915.db2.gz RJYZMJRMIVTRLG-UHFFFAOYSA-N 2 2 317.227 1.559 20 10 DDCDLP c1cn2c([nH+]1)C[C@H]([NH2+]Cc1ccc(N3CCOCC3)cc1)CC2 ZINC000778189180 698248260 /nfs/dbraw/zinc/24/82/60/698248260.db2.gz ONHWUMNONGTKHB-MRXNPFEDSA-N 2 2 312.417 1.824 20 10 DDCDLP CCCC[N@H+](CC(=O)N1CC[NH+](C)CC1)Cc1ccccc1O ZINC000801597107 700325390 /nfs/dbraw/zinc/32/53/90/700325390.db2.gz BEMVQIYADXIROA-UHFFFAOYSA-N 2 2 319.449 1.768 20 10 DDCDLP CCCC[N@@H+](CC(=O)N1CC[NH+](C)CC1)Cc1ccccc1O ZINC000801597107 700325393 /nfs/dbraw/zinc/32/53/93/700325393.db2.gz BEMVQIYADXIROA-UHFFFAOYSA-N 2 2 319.449 1.768 20 10 DDCDLP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1cc(F)cc(F)c1O ZINC000756555984 700627918 /nfs/dbraw/zinc/62/79/18/700627918.db2.gz YJSDXGFDTZMFHC-RYUDHWBXSA-N 2 2 313.392 1.957 20 10 DDCDLP COC[C@@]1(C[NH2+]Cc2ccc(N3CCOCC3)cc2)CCC[NH2+]1 ZINC000841065849 702333606 /nfs/dbraw/zinc/33/36/06/702333606.db2.gz IBHODESFLHZHEI-SFHVURJKSA-N 2 2 319.449 1.381 20 10 DDCDLP CC[C@H](Cn1cncn1)[NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817942896 702531487 /nfs/dbraw/zinc/53/14/87/702531487.db2.gz RGGWYQHATCKYDO-ZBFHGGJFSA-N 2 2 302.426 1.412 20 10 DDCDLP Oc1c(F)cc(Cl)cc1C[N@@H+]1CC[C@@H](N2CC[NH2+]CC2)C1 ZINC000843123614 702824315 /nfs/dbraw/zinc/82/43/15/702824315.db2.gz SVUCYXJHCSCJRM-CYBMUJFWSA-N 2 2 313.804 1.664 20 10 DDCDLP Oc1c(F)cc(Cl)cc1C[N@H+]1CC[C@@H](N2CC[NH2+]CC2)C1 ZINC000843123614 702824317 /nfs/dbraw/zinc/82/43/17/702824317.db2.gz SVUCYXJHCSCJRM-CYBMUJFWSA-N 2 2 313.804 1.664 20 10 DDCDLP COc1cccc(O)c1C[NH2+]C1CC[NH+]([C@H]2CCOC2)CC1 ZINC000850396586 703729556 /nfs/dbraw/zinc/72/95/56/703729556.db2.gz LPVIYPZBFDUOHD-AWEZNQCLSA-N 2 2 306.406 1.744 20 10 DDCDLP Cc1ccc(C[NH+]2CCN(CC[NH+]3CCOCC3)CC2)c(O)c1 ZINC001140949693 860744573 /nfs/dbraw/zinc/74/45/73/860744573.db2.gz IITAYLWKMSYYAH-UHFFFAOYSA-N 2 2 319.449 1.150 20 10 DDCDLP CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@]12CC[C@@H]([NH2+]1)[C@H]([NH3+])C2 ZINC001161134767 866396475 /nfs/dbraw/zinc/39/64/75/866396475.db2.gz MZARITLKOWAMLY-NUJGCVRESA-N 2 2 316.449 1.323 20 10 DDCDLP CC[NH+]1CCN(c2ccc(O[C@H]3C[NH2+]CC3(F)F)cc2)CC1 ZINC001218236152 877434182 /nfs/dbraw/zinc/43/41/82/877434182.db2.gz HBTGHMCGSZUWTE-HNNXBMFYSA-N 2 2 311.376 1.814 20 10 DDCDLP Cc1cc(O)c(C[NH+]2CC(N3CC[NH+](C)CC3)C2)cc1Cl ZINC001231872143 885917470 /nfs/dbraw/zinc/91/74/70/885917470.db2.gz WLUJIZLYXYENDT-UHFFFAOYSA-N 2 2 309.841 1.786 20 10 DDCDLP Oc1cc(Cl)c(Cl)cc1CN1CC[NH2+]C[C@@]12CC[NH2+]C2 ZINC001234988187 888306183 /nfs/dbraw/zinc/30/61/83/888306183.db2.gz JCZLDTBDPIYMMI-AWEZNQCLSA-N 2 2 316.232 1.836 20 10 DDCDLP COc1cccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCOCC3)C2)c1O ZINC000093017855 193195280 /nfs/dbraw/zinc/19/52/80/193195280.db2.gz KANTXIGDKFHXDG-HNNXBMFYSA-N 2 2 320.433 1.945 20 10 DDCDLP COc1cccc(C[N@H+]2CCC[C@@H](C[NH+]3CCOCC3)C2)c1O ZINC000093017855 193195281 /nfs/dbraw/zinc/19/52/81/193195281.db2.gz KANTXIGDKFHXDG-HNNXBMFYSA-N 2 2 320.433 1.945 20 10 DDCDLP COc1ccc([NH+]2CCC(N(C)C(=O)C3C[NH2+]C3)CC2)cc1 ZINC000364880050 524401264 /nfs/dbraw/zinc/40/12/64/524401264.db2.gz KFESZSCVWCJZOK-UHFFFAOYSA-N 2 2 303.406 1.342 20 10 DDCDLP C[C@H]1CC[NH2+]C[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1 ZINC000841059299 702329916 /nfs/dbraw/zinc/32/99/16/702329916.db2.gz PRMNLCJRZSAGCM-MAUKXSAKSA-N 3 2 302.466 1.526 20 10 DDCDLP COC(=O)c1ccc(O)c([C@H](C)[NH2+]C[C@H]2C[NH2+]CCCO2)c1 ZINC000817981565 702543052 /nfs/dbraw/zinc/54/30/52/702543052.db2.gz LFYKRYYJTVOVDH-WCQYABFASA-N 2 2 308.378 1.208 20 10 DDCDLP CN(C)c1ccc(C[N@@H+]2CCC[C@@H](N3CC[NH2+]CC3=O)C2)cc1 ZINC000843065213 702811946 /nfs/dbraw/zinc/81/19/46/702811946.db2.gz KIILLRMKHYMQMX-QGZVFWFLSA-N 2 2 316.449 1.149 20 10 DDCDLP CN(C)c1ccc(C[N@H+]2CCC[C@@H](N3CC[NH2+]CC3=O)C2)cc1 ZINC000843065213 702811949 /nfs/dbraw/zinc/81/19/49/702811949.db2.gz KIILLRMKHYMQMX-QGZVFWFLSA-N 2 2 316.449 1.149 20 10 DDCDLP C[C@@H]1C[C@@H]([NH3+])CC[N@@H+]1CC(=O)NCc1ccc(N(C)C)cc1 ZINC000846708173 703321928 /nfs/dbraw/zinc/32/19/28/703321928.db2.gz MRKFRXBANOUAJL-HIFRSBDPSA-N 2 2 304.438 1.180 20 10 DDCDLP C[C@@H]1C[C@@H]([NH3+])CC[N@H+]1CC(=O)NCc1ccc(N(C)C)cc1 ZINC000846708173 703321930 /nfs/dbraw/zinc/32/19/30/703321930.db2.gz MRKFRXBANOUAJL-HIFRSBDPSA-N 2 2 304.438 1.180 20 10 DDCDLP C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)[C@@H]1C[N@H+](C)CCN1C ZINC001183930413 743929251 /nfs/dbraw/zinc/92/92/51/743929251.db2.gz RLHRDQIUACSZAA-YOEHRIQHSA-N 2 2 303.450 1.736 20 10 DDCDLP C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)[C@@H]1C[N@@H+](C)CCN1C ZINC001183930413 743929254 /nfs/dbraw/zinc/92/92/54/743929254.db2.gz RLHRDQIUACSZAA-YOEHRIQHSA-N 2 2 303.450 1.736 20 10 DDCDLP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)c(F)c2)CC[NH2+]1 ZINC001117953661 780961310 /nfs/dbraw/zinc/96/13/10/780961310.db2.gz KVLZFDVEZKIOOU-GOEBONIOSA-N 3 2 320.456 1.808 20 10 DDCDLP C[C@H]1C[C@H]([NH2+]Cc2ccc(N3CCN(C)CC3)c(F)c2)CC[NH2+]1 ZINC001117953661 780961315 /nfs/dbraw/zinc/96/13/15/780961315.db2.gz KVLZFDVEZKIOOU-GOEBONIOSA-N 2 2 320.456 1.808 20 10 DDCDLP COc1cc(C[NH+]2CC3(CC(O)C3)C2)cc(C[NH+](C)C)c1O ZINC001139253125 860337077 /nfs/dbraw/zinc/33/70/77/860337077.db2.gz MURBODZWEYMNFN-UHFFFAOYSA-N 2 2 306.406 1.419 20 10 DDCDLP CNC(=O)C[N@@H+]1CCCC12CC[NH+](Cc1ccccc1O)CC2 ZINC001203551564 870636941 /nfs/dbraw/zinc/63/69/41/870636941.db2.gz IVVHPKDXJODSFD-UHFFFAOYSA-N 2 2 317.433 1.569 20 10 DDCDLP CNC(=O)C[N@H+]1CCCC12CC[NH+](Cc1ccccc1O)CC2 ZINC001203551564 870636945 /nfs/dbraw/zinc/63/69/45/870636945.db2.gz IVVHPKDXJODSFD-UHFFFAOYSA-N 2 2 317.433 1.569 20 10 DDCDLP C[C@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1cc(F)c(F)cc1O ZINC001205488924 871579812 /nfs/dbraw/zinc/57/98/12/871579812.db2.gz FHTRRICNJMENSO-GFCCVEGCSA-N 2 2 313.392 1.786 20 10 DDCDLP C[C@@H]1CC[C@H](C[NH3+])[N@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)C1 ZINC001205844694 871859247 /nfs/dbraw/zinc/85/92/47/871859247.db2.gz XUKXKJYOMQDHLB-IUODEOHRSA-N 3 2 305.422 1.433 20 10 DDCDLP C[C@@H]1CC[C@H](C[NH3+])[N@@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)C1 ZINC001205844694 871859263 /nfs/dbraw/zinc/85/92/63/871859263.db2.gz XUKXKJYOMQDHLB-IUODEOHRSA-N 3 2 305.422 1.433 20 10 DDCDLP Nc1ccc(N(Cc2ccccc2)C(=O)[C@@H]2C[C@@H]([NH3+])C[NH2+]2)cc1 ZINC001218956544 877833158 /nfs/dbraw/zinc/83/31/58/877833158.db2.gz ZVBKPLZRMJGDKH-WBVHZDCISA-N 2 2 310.401 1.491 20 10 DDCDLP CC[C@H]([NH3+])C(=O)N(C)C1CC[NH+](c2ccc(OC)cc2)CC1 ZINC000378208039 418719989 /nfs/dbraw/zinc/71/99/89/418719989.db2.gz FERXQWQNUQWPMK-INIZCTEOSA-N 2 2 305.422 1.860 20 10 DDCDLP O=S1(=O)CC[C@H]([NH2+]C2CC[NH+](Cc3ccccc3O)CC2)C1 ZINC000372811507 418904401 /nfs/dbraw/zinc/90/44/01/418904401.db2.gz GJORYQASYNKZJB-HNNXBMFYSA-N 2 2 324.446 1.133 20 10 DDCDLP C[C@H]1C[C@H]([NH2+]CC(=O)N2CC[NH+](C)CC2)c2c1c(F)ccc2O ZINC000756491627 700623945 /nfs/dbraw/zinc/62/39/45/700623945.db2.gz WUSXHKXHBRFAAJ-AAEUAGOBSA-N 2 2 321.396 1.443 20 10 DDCDLP C[C@H]([NH2+]CC1(O)CC[NH+](C)CC1)c1cc(F)cc(F)c1O ZINC000756605180 700631256 /nfs/dbraw/zinc/63/12/56/700631256.db2.gz RDCJHGQPYYLWNU-JTQLQIEISA-N 2 2 300.349 1.778 20 10 DDCDLP C[C@H]1CC[NH2+]C[C@H]1[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000841059874 702329511 /nfs/dbraw/zinc/32/95/11/702329511.db2.gz YFLKHIZQKNHLDD-XJKSGUPXSA-N 2 2 307.413 1.750 20 10 DDCDLP CC[C@H]1C[N@H+](CC(=O)NCc2ccc(N(C)C)cc2)CC[C@@H]1[NH3+] ZINC000844222861 702996072 /nfs/dbraw/zinc/99/60/72/702996072.db2.gz MWLABAUAUQJNKH-RDJZCZTQSA-N 2 2 318.465 1.428 20 10 DDCDLP CC[C@H]1C[N@@H+](CC(=O)NCc2ccc(N(C)C)cc2)CC[C@@H]1[NH3+] ZINC000844222861 702996073 /nfs/dbraw/zinc/99/60/73/702996073.db2.gz MWLABAUAUQJNKH-RDJZCZTQSA-N 2 2 318.465 1.428 20 10 DDCDLP COc1ccc(N(C)CC[N@H+](C)C[C@@H](O)C[NH+]2CCCC2)cc1 ZINC000844399696 703025989 /nfs/dbraw/zinc/02/59/89/703025989.db2.gz MSGOYIZKNMAOJO-QGZVFWFLSA-N 2 2 321.465 1.520 20 10 DDCDLP COc1ccc(N(C)CC[N@@H+](C)C[C@@H](O)C[NH+]2CCCC2)cc1 ZINC000844399696 703025992 /nfs/dbraw/zinc/02/59/92/703025992.db2.gz MSGOYIZKNMAOJO-QGZVFWFLSA-N 2 2 321.465 1.520 20 10 DDCDLP COCC[N@H+](C)C[C@H](O)C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000846861098 703343528 /nfs/dbraw/zinc/34/35/28/703343528.db2.gz NWLABWKWAGKTIC-RHSMWYFYSA-N 2 2 309.454 1.342 20 10 DDCDLP COCC[N@@H+](C)C[C@H](O)C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000846861098 703343529 /nfs/dbraw/zinc/34/35/29/703343529.db2.gz NWLABWKWAGKTIC-RHSMWYFYSA-N 2 2 309.454 1.342 20 10 DDCDLP Cc1cccc(O)c1C[NH+]1C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C1 ZINC000877670111 706175703 /nfs/dbraw/zinc/17/57/03/706175703.db2.gz HMUGXPMXCUGACL-HZPDHXFCSA-N 3 2 305.466 1.872 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@@H+]3CCNC(=O)[C@H]3C)cc2)CC1 ZINC001140304023 860614652 /nfs/dbraw/zinc/61/46/52/860614652.db2.gz DZNOSNCTKMAIRY-OAHLLOKOSA-N 2 2 316.449 1.149 20 10 DDCDLP CC[NH+]1CCN(c2ccc(C[N@H+]3CCNC(=O)[C@H]3C)cc2)CC1 ZINC001140304023 860614655 /nfs/dbraw/zinc/61/46/55/860614655.db2.gz DZNOSNCTKMAIRY-OAHLLOKOSA-N 2 2 316.449 1.149 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@@H+]1CCC[C@H]1C(N)=O)c1ccc(N(C)C)cc1 ZINC000268884741 296123649 /nfs/dbraw/zinc/12/36/49/296123649.db2.gz IJJQKNCHKPSWNN-PBHICJAKSA-N 2 2 318.465 1.743 20 10 DDCDLP C[C@@H]([NH2+]CCC[N@H+]1CCC[C@H]1C(N)=O)c1ccc(N(C)C)cc1 ZINC000268884741 296123650 /nfs/dbraw/zinc/12/36/50/296123650.db2.gz IJJQKNCHKPSWNN-PBHICJAKSA-N 2 2 318.465 1.743 20 10 DDCDLP COc1ccc(N2CC[NH+](C[C@@H](O)C[N@H+](C)C3CC3)CC2)cc1 ZINC000273248953 408125699 /nfs/dbraw/zinc/12/56/99/408125699.db2.gz VVBZFQUJNXKRPG-KRWDZBQOSA-N 2 2 319.449 1.272 20 10 DDCDLP COc1ccc(N2CC[NH+](C[C@@H](O)C[N@@H+](C)C3CC3)CC2)cc1 ZINC000273248953 408125705 /nfs/dbraw/zinc/12/57/05/408125705.db2.gz VVBZFQUJNXKRPG-KRWDZBQOSA-N 2 2 319.449 1.272 20 10 DDCDLP NC(=O)[C@@H]1CCC[N@@H+]1CCC[NH2+]Cc1c(O)cccc1Cl ZINC000264937111 526966862 /nfs/dbraw/zinc/96/68/62/526966862.db2.gz DPAARQAJKYUFMP-ZDUSSCGKSA-N 2 2 311.813 1.475 20 10 DDCDLP NC(=O)[C@@H]1CCC[N@H+]1CCC[NH2+]Cc1c(O)cccc1Cl ZINC000264937111 526966870 /nfs/dbraw/zinc/96/68/70/526966870.db2.gz DPAARQAJKYUFMP-ZDUSSCGKSA-N 2 2 311.813 1.475 20 10 DDCDLP CN(C)c1ccc([C@H]([NH3+])C[NH2+]Cc2cnc3cnccn23)cc1 ZINC000841046315 702321941 /nfs/dbraw/zinc/32/19/41/702321941.db2.gz ZQQIOXHNLGNUKE-MRXNPFEDSA-N 2 2 310.405 1.585 20 10 DDCDLP C[C@H]1CC[NH2+]C[C@H]1[NH2+]Cc1ccc(N2CCC(O)CC2)c(F)c1 ZINC000817894523 702511890 /nfs/dbraw/zinc/51/18/90/702511890.db2.gz LUHYDFVEVRMUHM-SUMWQHHRSA-N 2 2 321.440 1.874 20 10 DDCDLP COc1ccc(C[NH2+][C@@H]2CCn3cc[nH+]c3C2)c(O)c1OC ZINC000893706944 710787302 /nfs/dbraw/zinc/78/73/02/710787302.db2.gz MXCQCJKLPIAAJI-GFCCVEGCSA-N 2 2 303.362 1.711 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[NH2+][C@H]3C[NH2+]CC3(C)C)cc2)CC1 ZINC000904461587 711860719 /nfs/dbraw/zinc/86/07/19/711860719.db2.gz JWEKUJLJTOKVMZ-KRWDZBQOSA-N 3 2 302.466 1.526 20 10 DDCDLP COc1cc(C[N@H+]2C[C@H]3CC[C@@H](C2)O3)cc(C[NH+](C)C)c1O ZINC001139253369 860337446 /nfs/dbraw/zinc/33/74/46/860337446.db2.gz SLGGQNDUVLGULQ-GASCZTMLSA-N 2 2 306.406 1.826 20 10 DDCDLP COc1cc(C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)cc(C[NH+](C)C)c1O ZINC001139253369 860337456 /nfs/dbraw/zinc/33/74/56/860337456.db2.gz SLGGQNDUVLGULQ-GASCZTMLSA-N 2 2 306.406 1.826 20 10 DDCDLP CCOC(=O)C[N@H+](C)Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140302161 860614862 /nfs/dbraw/zinc/61/48/62/860614862.db2.gz LNBSRCXJOJTCIH-UHFFFAOYSA-N 2 2 319.449 1.823 20 10 DDCDLP CCOC(=O)C[N@@H+](C)Cc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001140302161 860614866 /nfs/dbraw/zinc/61/48/66/860614866.db2.gz LNBSRCXJOJTCIH-UHFFFAOYSA-N 2 2 319.449 1.823 20 10 DDCDLP C[C@H]([NH2+]CCC[N@H+]1CCC[C@H]1C(=O)N(C)C)c1ccccc1O ZINC000272898578 130072346 /nfs/dbraw/zinc/07/23/46/130072346.db2.gz UQHNLRQPLWCYDI-HOCLYGCPSA-N 2 2 319.449 1.986 20 10 DDCDLP C[N@@H+]1CCN(C2CC[NH+](Cc3ccccc3O)CC2)C(=O)C1 ZINC000374756266 418560762 /nfs/dbraw/zinc/56/07/62/418560762.db2.gz YIEFUWMCIYXWOD-UHFFFAOYSA-N 2 2 303.406 1.131 20 10 DDCDLP C[N@H+]1CCN(C2CC[NH+](Cc3ccccc3O)CC2)C(=O)C1 ZINC000374756266 418560764 /nfs/dbraw/zinc/56/07/64/418560764.db2.gz YIEFUWMCIYXWOD-UHFFFAOYSA-N 2 2 303.406 1.131 20 10 DDCDLP CC[C@@H]([NH2+]CCC[N@@H+]1CCC[C@@H]1C(N)=O)c1ccccc1O ZINC000274931880 535803714 /nfs/dbraw/zinc/80/37/14/535803714.db2.gz RBGRMQYXEJXTRI-HUUCEWRRSA-N 2 2 305.422 1.773 20 10 DDCDLP CC[C@@H]([NH2+]CCC[N@H+]1CCC[C@@H]1C(N)=O)c1ccccc1O ZINC000274931880 535803715 /nfs/dbraw/zinc/80/37/15/535803715.db2.gz RBGRMQYXEJXTRI-HUUCEWRRSA-N 2 2 305.422 1.773 20 10 DDCDLP CCc1nn(C)cc1C[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000841046281 702321573 /nfs/dbraw/zinc/32/15/73/702321573.db2.gz ZBSUYBLURFQFHU-MRXNPFEDSA-N 2 2 301.438 1.838 20 10 DDCDLP CC1(C)[NH2+]CC[C@H]1[NH2+]Cc1ccc(N2CCOCC2)c(F)c1 ZINC000841085562 702340428 /nfs/dbraw/zinc/34/04/28/702340428.db2.gz HEYSJIQQYASHHJ-MRXNPFEDSA-N 2 2 307.413 1.892 20 10 DDCDLP CCN(CC)C(=O)C[C@H](C)[NH2+]C[C@@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000817938232 702530245 /nfs/dbraw/zinc/53/02/45/702530245.db2.gz HDGVZSOHGTZYAM-WMLDXEAASA-N 2 2 320.481 1.989 20 10 DDCDLP CCN(C)c1ccc(C[N@@H+]2CCN(CC[NH+](C)C)C(=O)C2)cc1 ZINC000844382277 703023453 /nfs/dbraw/zinc/02/34/53/703023453.db2.gz VUOPQHNOFMSZGG-UHFFFAOYSA-N 2 2 318.465 1.349 20 10 DDCDLP CCN(C)c1ccc(C[N@H+]2CCN(CC[NH+](C)C)C(=O)C2)cc1 ZINC000844382277 703023456 /nfs/dbraw/zinc/02/34/56/703023456.db2.gz VUOPQHNOFMSZGG-UHFFFAOYSA-N 2 2 318.465 1.349 20 10 DDCDLP C[NH+]1CCC([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1 ZINC000830138836 706463011 /nfs/dbraw/zinc/46/30/11/706463011.db2.gz AWBFWACYKDZTBH-UHFFFAOYSA-N 3 2 302.466 1.622 20 10 DDCDLP C[C@@H]1C[N@H+](C)C[C@@H]1NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000898451534 708644853 /nfs/dbraw/zinc/64/48/53/708644853.db2.gz ZJXHLIBEBUKSOX-FHLIZLRMSA-N 2 2 304.482 1.895 20 10 DDCDLP C[C@@H]1C[N@@H+](C)C[C@@H]1NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C ZINC000898451534 708644856 /nfs/dbraw/zinc/64/48/56/708644856.db2.gz ZJXHLIBEBUKSOX-FHLIZLRMSA-N 2 2 304.482 1.895 20 10 DDCDLP C[C@@H](Cc1c[nH]c[nH+]1)C(=O)NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000911667246 710916986 /nfs/dbraw/zinc/91/69/86/710916986.db2.gz PARXFBNWGNJZCJ-LRDDRELGSA-N 2 2 315.421 1.471 20 10 DDCDLP C[C@@H](Cc1c[nH+]c[nH]1)C(=O)NC[C@H]([NH3+])c1ccc(N(C)C)cc1 ZINC000911667246 710916988 /nfs/dbraw/zinc/91/69/88/710916988.db2.gz PARXFBNWGNJZCJ-LRDDRELGSA-N 2 2 315.421 1.471 20 10 DDCDLP C[N@@H+](Cc1ccc(N2CCOCC2)cc1)C[C@H]([NH3+])CC(F)F ZINC000903877796 711313728 /nfs/dbraw/zinc/31/37/28/711313728.db2.gz QKEHHAIXQSEEMQ-CQSZACIVSA-N 2 2 313.392 1.938 20 10 DDCDLP C[N@H+](Cc1ccc(N2CCOCC2)cc1)C[C@H]([NH3+])CC(F)F ZINC000903877796 711313732 /nfs/dbraw/zinc/31/37/32/711313732.db2.gz QKEHHAIXQSEEMQ-CQSZACIVSA-N 2 2 313.392 1.938 20 10 DDCDLP C[NH+](C)[C@@H]1[C@H]2C[N@H+](Cc3ccc(N4CCOCC4)cc3)C[C@H]21 ZINC000931277805 714055014 /nfs/dbraw/zinc/05/50/14/714055014.db2.gz SPXGFOHKWKYSRM-PIIMJCKOSA-N 2 2 301.434 1.515 20 10 DDCDLP C[NH+](C)[C@@H]1[C@H]2C[N@@H+](Cc3ccc(N4CCOCC4)cc3)C[C@H]21 ZINC000931277805 714055017 /nfs/dbraw/zinc/05/50/17/714055017.db2.gz SPXGFOHKWKYSRM-PIIMJCKOSA-N 2 2 301.434 1.515 20 10 DDCDLP C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)[C@H]1C[N@H+](C)CCN1C ZINC001183930412 743929050 /nfs/dbraw/zinc/92/90/50/743929050.db2.gz RLHRDQIUACSZAA-WMLDXEAASA-N 2 2 303.450 1.736 20 10 DDCDLP C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)[C@H]1C[N@@H+](C)CCN1C ZINC001183930412 743929051 /nfs/dbraw/zinc/92/90/51/743929051.db2.gz RLHRDQIUACSZAA-WMLDXEAASA-N 2 2 303.450 1.736 20 10 DDCDLP C[NH+](C)CCN1CCC12C[NH+](Cc1c(O)cccc1Cl)C2 ZINC001275216769 852901814 /nfs/dbraw/zinc/90/18/14/852901814.db2.gz CKOCFKOITVVMPA-UHFFFAOYSA-N 2 2 309.841 1.867 20 10 DDCDLP CN1CCOc2cc(C[N@@H+]3C[C@H]4C[C@@]4(C[NH+](C)C)C3)ccc21 ZINC001141145302 860794775 /nfs/dbraw/zinc/79/47/75/860794775.db2.gz SYFKDIFHYGUUDJ-CRAIPNDOSA-N 2 2 301.434 1.899 20 10 DDCDLP CN1CCOc2cc(C[N@H+]3C[C@H]4C[C@@]4(C[NH+](C)C)C3)ccc21 ZINC001141145302 860794786 /nfs/dbraw/zinc/79/47/86/860794786.db2.gz SYFKDIFHYGUUDJ-CRAIPNDOSA-N 2 2 301.434 1.899 20 10 DDCDLP COc1cc[nH+]c(N2CC[NH+](Cc3cc(O)ccc3O)CC2)c1 ZINC001141162918 860799497 /nfs/dbraw/zinc/79/94/97/860799497.db2.gz KQNWAQLLDDWOPS-UHFFFAOYSA-N 2 2 315.373 1.824 20 10 DDCDLP COc1cc(O)c(C[NH2+][C@H](C)[C@@H]2C[N@H+](C)CCN2C)cc1OC ZINC001308948999 871536666 /nfs/dbraw/zinc/53/66/66/871536666.db2.gz VVHMVNTVYAHOEX-OCCSQVGLSA-N 2 2 323.437 1.133 20 10 DDCDLP COc1cc(O)c(C[NH2+][C@H](C)[C@@H]2C[N@@H+](C)CCN2C)cc1OC ZINC001308948999 871536680 /nfs/dbraw/zinc/53/66/80/871536680.db2.gz VVHMVNTVYAHOEX-OCCSQVGLSA-N 2 2 323.437 1.133 20 10 DDCDLP COc1ccc(C[N@@H+]2CCCC[C@](O)(C[NH3+])C2)c(O)c1Cl ZINC001205726568 871751851 /nfs/dbraw/zinc/75/18/51/871751851.db2.gz VAURWQFDFFDDDT-HNNXBMFYSA-N 2 2 314.813 1.730 20 10 DDCDLP COc1ccc(C[N@H+]2CCCC[C@](O)(C[NH3+])C2)c(O)c1Cl ZINC001205726568 871751865 /nfs/dbraw/zinc/75/18/65/871751865.db2.gz VAURWQFDFFDDDT-HNNXBMFYSA-N 2 2 314.813 1.730 20 10 DDCDLP C[C@H]1CC[C@@H](C[NH3+])[N@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)C1 ZINC001205844696 871858937 /nfs/dbraw/zinc/85/89/37/871858937.db2.gz XUKXKJYOMQDHLB-WFASDCNBSA-N 3 2 305.422 1.433 20 10 DDCDLP C[C@H]1CC[C@@H](C[NH3+])[N@@H+](Cc2cc3c(cc2O)OCC[NH2+]C3)C1 ZINC001205844696 871858954 /nfs/dbraw/zinc/85/89/54/871858954.db2.gz XUKXKJYOMQDHLB-WFASDCNBSA-N 3 2 305.422 1.433 20 10 DDCDLP Nc1ccc(N(Cc2ccccc2)C(=O)[C@@H]2C[C@H]([NH3+])C[NH2+]2)cc1 ZINC001218956541 877833761 /nfs/dbraw/zinc/83/37/61/877833761.db2.gz ZVBKPLZRMJGDKH-RDJZCZTQSA-N 2 2 310.401 1.491 20 10 DDCDLP COCC[N@H+](Cc1cc(OC)c(O)cc1O)C1CC[NH+](C)CC1 ZINC001231635980 885772843 /nfs/dbraw/zinc/77/28/43/885772843.db2.gz IQKGFFBOUZCGTM-UHFFFAOYSA-N 2 2 324.421 1.649 20 10 DDCDLP COCC[N@@H+](Cc1cc(OC)c(O)cc1O)C1CC[NH+](C)CC1 ZINC001231635980 885772846 /nfs/dbraw/zinc/77/28/46/885772846.db2.gz IQKGFFBOUZCGTM-UHFFFAOYSA-N 2 2 324.421 1.649 20 10 DDCDLP [NH3+]CCN(CC[NH3+])Cc1cc(Cl)cc(Br)c1O ZINC001235878083 888997342 /nfs/dbraw/zinc/99/73/42/888997342.db2.gz SJTBORBGAOLDLW-UHFFFAOYSA-N 2 2 322.634 1.528 20 10 DDCDLP C[C@@H]([NH2+]CCC(=O)N1CC[NH+](C)CC1)c1ccc(F)cc1O ZINC000185341356 408797935 /nfs/dbraw/zinc/79/79/35/408797935.db2.gz AGQMCOPRDUOMDM-GFCCVEGCSA-N 2 2 309.385 1.346 20 10 DDCDLP Cc1ccc([C@@H](C)[NH2+]CC(=O)N2CC[NH+](C)CC2)c(O)c1C ZINC000756489214 700623928 /nfs/dbraw/zinc/62/39/28/700623928.db2.gz GTQCVAHASZEAKJ-CQSZACIVSA-N 2 2 305.422 1.434 20 10 DDCDLP O=[N+]([O-])c1cc(C[NH2+][C@@H]2[C@H]3C[NH2+]C[C@H]32)ccc1N1CCCCC1 ZINC000841081702 702339717 /nfs/dbraw/zinc/33/97/17/702339717.db2.gz WSDZEUCNSYFADB-HALDLXJZSA-N 2 2 316.405 1.893 20 10 DDCDLP C[N@H+](Cc1ccc(N2CCOCC2)cc1)CC12CC(C1)C[NH2+]2 ZINC000873200284 707764674 /nfs/dbraw/zinc/76/46/74/707764674.db2.gz AHVGKNHTEXUVJW-UHFFFAOYSA-N 2 2 301.434 1.707 20 10 DDCDLP C[N@@H+](Cc1ccc(N2CCOCC2)cc1)CC12CC(C1)C[NH2+]2 ZINC000873200284 707764677 /nfs/dbraw/zinc/76/46/77/707764677.db2.gz AHVGKNHTEXUVJW-UHFFFAOYSA-N 2 2 301.434 1.707 20 10 DDCDLP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@H+]2Cc1ccc(Cl)cc1O ZINC001275271937 852942274 /nfs/dbraw/zinc/94/22/74/852942274.db2.gz OVHUYMVLTBIDCR-GASCZTMLSA-N 2 2 309.841 1.866 20 10 DDCDLP C[NH+](C)CCN1C[C@H]2C[C@@H](C1)[N@@H+]2Cc1ccc(Cl)cc1O ZINC001275271937 852942284 /nfs/dbraw/zinc/94/22/84/852942284.db2.gz OVHUYMVLTBIDCR-GASCZTMLSA-N 2 2 309.841 1.866 20 10 DDCDLP COc1cc(C[N@@H+]2CCC3(C2)OCCO3)cc(C[NH+](C)C)c1O ZINC001139257606 860338822 /nfs/dbraw/zinc/33/88/22/860338822.db2.gz YYKNHDACHUTIRO-UHFFFAOYSA-N 2 2 322.405 1.411 20 10 DDCDLP COc1cc(C[N@H+]2CCC3(C2)OCCO3)cc(C[NH+](C)C)c1O ZINC001139257606 860338826 /nfs/dbraw/zinc/33/88/26/860338826.db2.gz YYKNHDACHUTIRO-UHFFFAOYSA-N 2 2 322.405 1.411 20 10 DDCDLP C[N@H+](Cc1ccc(N2CCOCC2)cc1)Cc1c[nH+]ccc1N ZINC001209729880 875083798 /nfs/dbraw/zinc/08/37/98/875083798.db2.gz DGIGBNFLJYWRCX-UHFFFAOYSA-N 2 2 312.417 1.963 20 10 DDCDLP C[N@@H+](Cc1ccc(N2CCOCC2)cc1)Cc1c[nH+]ccc1N ZINC001209729880 875083808 /nfs/dbraw/zinc/08/38/08/875083808.db2.gz DGIGBNFLJYWRCX-UHFFFAOYSA-N 2 2 312.417 1.963 20 10 DDCDLP COc1c(O)c(C[N@@H+]2CC[C@]3(CC[NH+](C)C3)C2)ccc1[N+](=O)[O-] ZINC000292852268 409043554 /nfs/dbraw/zinc/04/35/54/409043554.db2.gz UHIDUJSBDXDJFH-INIZCTEOSA-N 2 2 321.377 1.837 20 10 DDCDLP COc1c(O)c(C[N@H+]2CC[C@]3(CC[NH+](C)C3)C2)ccc1[N+](=O)[O-] ZINC000292852268 409043555 /nfs/dbraw/zinc/04/35/55/409043555.db2.gz UHIDUJSBDXDJFH-INIZCTEOSA-N 2 2 321.377 1.837 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@]3(CC[N@H+](C)C3)C2)ccc1[N+](=O)[O-] ZINC000292852268 409043558 /nfs/dbraw/zinc/04/35/58/409043558.db2.gz UHIDUJSBDXDJFH-INIZCTEOSA-N 2 2 321.377 1.837 20 10 DDCDLP COc1c(O)c(C[NH+]2CC[C@]3(CC[N@@H+](C)C3)C2)ccc1[N+](=O)[O-] ZINC000292852268 409043560 /nfs/dbraw/zinc/04/35/60/409043560.db2.gz UHIDUJSBDXDJFH-INIZCTEOSA-N 2 2 321.377 1.837 20 10 DDCDLP C[N@@H+]1CCN(Cc2cc(Br)ccc2O)[C@H](C[NH3+])C1 ZINC000300437735 698600406 /nfs/dbraw/zinc/60/04/06/698600406.db2.gz MJMAIDROKURRJQ-GFCCVEGCSA-N 2 2 314.227 1.229 20 10 DDCDLP C[N@H+]1CCN(Cc2cc(Br)ccc2O)[C@H](C[NH3+])C1 ZINC000300437735 698600408 /nfs/dbraw/zinc/60/04/08/698600408.db2.gz MJMAIDROKURRJQ-GFCCVEGCSA-N 2 2 314.227 1.229 20 10 DDCDLP C[C@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)C(C)(C)n1cncn1 ZINC000817941203 702531524 /nfs/dbraw/zinc/53/15/24/702531524.db2.gz JKCVLKAOVRWYRS-BBRMVZONSA-N 2 2 316.453 1.757 20 10 DDCDLP [NH3+]CCNC(=O)[C@@H]1CCC[N@H+](Cc2cccc(Cl)c2O)C1 ZINC000843048164 702807778 /nfs/dbraw/zinc/80/77/78/702807778.db2.gz QUAWNEUENZLNGJ-GFCCVEGCSA-N 2 2 311.813 1.333 20 10 DDCDLP [NH3+]CCNC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(Cl)c2O)C1 ZINC000843048164 702807780 /nfs/dbraw/zinc/80/77/80/702807780.db2.gz QUAWNEUENZLNGJ-GFCCVEGCSA-N 2 2 311.813 1.333 20 10 DDCDLP C[C@H]1C[NH2+]C[C@H]([NH2+]Cc2ccc(N3CCOCC3)c(F)c2)C1 ZINC000843126802 702825451 /nfs/dbraw/zinc/82/54/51/702825451.db2.gz WMPNZQXNKQLUBE-UKRRQHHQSA-N 2 2 307.413 1.750 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@@H+]2CC[C@@](C)(C[NH3+])C2)cc1 ZINC000844225170 702996801 /nfs/dbraw/zinc/99/68/01/702996801.db2.gz ZVPULXDUWUSTAS-KRWDZBQOSA-N 2 2 304.438 1.040 20 10 DDCDLP CN(C)c1ccc(CNC(=O)C[N@H+]2CC[C@@](C)(C[NH3+])C2)cc1 ZINC000844225170 702996803 /nfs/dbraw/zinc/99/68/03/702996803.db2.gz ZVPULXDUWUSTAS-KRWDZBQOSA-N 2 2 304.438 1.040 20 10 DDCDLP Cc1cc(C[N@@H+]2CCN(CC[NH+](C)C)C(=O)C2)ccc1N(C)C ZINC000844381196 703023105 /nfs/dbraw/zinc/02/31/05/703023105.db2.gz JIJMJFPUMWKNSW-UHFFFAOYSA-N 2 2 318.465 1.267 20 10 DDCDLP Cc1cc(C[N@H+]2CCN(CC[NH+](C)C)C(=O)C2)ccc1N(C)C ZINC000844381196 703023108 /nfs/dbraw/zinc/02/31/08/703023108.db2.gz JIJMJFPUMWKNSW-UHFFFAOYSA-N 2 2 318.465 1.267 20 10 DDCDLP C[C@@H](C[NH2+]Cc1cc(F)cc(F)c1O)CN1CC[NH+](C)CC1 ZINC000882979761 707882423 /nfs/dbraw/zinc/88/24/23/707882423.db2.gz LVTHZIRDUBGKEB-LBPRGKRZSA-N 2 2 313.392 1.644 20 10 DDCDLP CCO[C@H](C[NH2+]Cc1ccc(OC)c(OC)c1O)C[NH+](C)C ZINC000896876676 708170182 /nfs/dbraw/zinc/17/01/82/708170182.db2.gz FCGCDDAITBQSAJ-CYBMUJFWSA-N 2 2 312.410 1.466 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H]([NH3+])[C@@H](F)CC3)cc2)CC1 ZINC001206173999 872110971 /nfs/dbraw/zinc/11/09/71/872110971.db2.gz LCORGOOVXFOCLB-ROUUACIJSA-N 3 2 320.456 1.700 20 10 DDCDLP C[NH+]1CCN(c2ccc(C[N@H+]3CC[C@H]([NH3+])[C@@H](F)CC3)cc2)CC1 ZINC001206173999 872110975 /nfs/dbraw/zinc/11/09/75/872110975.db2.gz LCORGOOVXFOCLB-ROUUACIJSA-N 3 2 320.456 1.700 20 10 DDCDLP COC[C@H]([NH3+])C(=O)N(C)C1CC[NH+](c2ccc(OC)cc2)CC1 ZINC000375966183 418690720 /nfs/dbraw/zinc/69/07/20/418690720.db2.gz XFIIGGJLHCTKKX-INIZCTEOSA-N 2 2 321.421 1.096 20 10 DDCDLP COC[C@@H]([NH2+]C[C@H]([NH3+])c1ccc(N(C)C)cc1)C1CCOCC1 ZINC000817940662 702530312 /nfs/dbraw/zinc/53/03/12/702530312.db2.gz GNDFTEYTDUNAHD-ZWKOTPCHSA-N 2 2 321.465 1.784 20 10 DDCDLP CC[N@H+](C)C[C@H](O)C[NH+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000846777005 703329733 /nfs/dbraw/zinc/32/97/33/703329733.db2.gz CBSVDGHFLBSSIM-KRWDZBQOSA-N 2 2 321.465 1.520 20 10 DDCDLP CC[N@@H+](C)C[C@H](O)C[NH+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000846777005 703329735 /nfs/dbraw/zinc/32/97/35/703329735.db2.gz CBSVDGHFLBSSIM-KRWDZBQOSA-N 2 2 321.465 1.520 20 10 DDCDLP CC[NH+](C)C[C@H](O)C[N@@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000846777005 703329736 /nfs/dbraw/zinc/32/97/36/703329736.db2.gz CBSVDGHFLBSSIM-KRWDZBQOSA-N 2 2 321.465 1.520 20 10 DDCDLP CC[NH+](C)C[C@H](O)C[N@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000846777005 703329738 /nfs/dbraw/zinc/32/97/38/703329738.db2.gz CBSVDGHFLBSSIM-KRWDZBQOSA-N 2 2 321.465 1.520 20 10 DDCDLP Cc1ccc(O)c(C[NH+]2C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C2)c1 ZINC000877669407 706175380 /nfs/dbraw/zinc/17/53/80/706175380.db2.gz HYUZYFGLFHYEEU-IAGOWNOFSA-N 3 2 305.466 1.872 20 10 DDCDLP