smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCC(CC)[C@@H](CNC(=O)N1CCOC2(CCCC2)C1)[NH+]1CCOCC1 ZINC000159424673 326931252 /nfs/dbraw/zinc/93/12/52/326931252.db2.gz OMIQVYSLVLKGIZ-GOSISDBHSA-N 1 1 367.534 2.478 20 70 FEIDMO Cc1[nH+]ccn1CCCN(C)C(=O)Nc1ccc2c(c1)N(C)C(=O)CO2 ZINC000159465561 326932647 /nfs/dbraw/zinc/93/26/47/326932647.db2.gz MLKAQCUZEKFMQN-UHFFFAOYSA-N 1 1 357.414 2.101 20 70 FEIDMO CCCCn1ncc(NC(=O)NC[C@H](C(C)C)[NH+]2CCOCC2)c1C ZINC000159996377 326949593 /nfs/dbraw/zinc/94/95/93/326949593.db2.gz GNJKNAJPEOPLHD-QGZVFWFLSA-N 1 1 351.495 2.470 20 70 FEIDMO Cc1ncc([C@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)c(C)n1 ZINC000161233219 326992801 /nfs/dbraw/zinc/99/28/01/326992801.db2.gz AFZZWGXJPTVKDY-AWEZNQCLSA-N 1 1 355.486 2.236 20 70 FEIDMO O=C(CC1CCOCC1)NCC[NH+]1CCN(c2cccc(Cl)c2)CC1 ZINC000161469148 327000531 /nfs/dbraw/zinc/00/05/31/327000531.db2.gz BJWNRYLGEMYGPI-UHFFFAOYSA-N 1 1 365.905 2.395 20 70 FEIDMO COCC[N@@H+](C)CCNC(=O)CSc1cccc(Br)c1 ZINC000160472248 546043793 /nfs/dbraw/zinc/04/37/93/546043793.db2.gz GQAXNNDEPYSLQU-UHFFFAOYSA-N 1 1 361.305 2.236 20 70 FEIDMO CS(=O)(=O)NCC[C@H]1CCCC[N@H+]1Cc1cccc2c1OCCCO2 ZINC000159372823 545947548 /nfs/dbraw/zinc/94/75/48/545947548.db2.gz ZNWWJDHRDAMSQN-MRXNPFEDSA-N 1 1 368.499 2.142 20 70 FEIDMO CCOC(=O)C1CCN(C(=O)[C@@H](C)[N@H+](C)Cc2cccc(F)c2)CC1 ZINC000159389986 545948858 /nfs/dbraw/zinc/94/88/58/545948858.db2.gz KBMFQZFZXUQVLB-CQSZACIVSA-N 1 1 350.434 2.448 20 70 FEIDMO CCOC(=O)C1CCN(C(=O)[C@@H](C)[N@@H+](C)Cc2cccc(F)c2)CC1 ZINC000159389986 545948863 /nfs/dbraw/zinc/94/88/63/545948863.db2.gz KBMFQZFZXUQVLB-CQSZACIVSA-N 1 1 350.434 2.448 20 70 FEIDMO O=C(N[C@@H]1CCOC2(CCCC2)C1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000159580601 545964152 /nfs/dbraw/zinc/96/41/52/545964152.db2.gz YKYCEUWIHTXJMC-RTBURBONSA-N 1 1 358.482 2.495 20 70 FEIDMO O=C(N[C@@H]1CCOC2(CCCC2)C1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000159580601 545964157 /nfs/dbraw/zinc/96/41/57/545964157.db2.gz YKYCEUWIHTXJMC-RTBURBONSA-N 1 1 358.482 2.495 20 70 FEIDMO CC[N@H+]1CCCN(C(=O)NCCc2nccn2Cc2ccccc2)CC1 ZINC000159583633 545964244 /nfs/dbraw/zinc/96/42/44/545964244.db2.gz DTZUCSLUPJNLAW-UHFFFAOYSA-N 1 1 355.486 2.211 20 70 FEIDMO COc1ccc(OC)c([C@H](C)NC(=O)[C@@H](C)[N@@H+](C)C[C@@H]2CCC[C@@H]2O)c1 ZINC000159775029 545979628 /nfs/dbraw/zinc/97/96/28/545979628.db2.gz YGZZDQNSYMIWRN-KRXQYRFLSA-N 1 1 364.486 2.362 20 70 FEIDMO Cc1cnn([C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1NC(=O)CC(=O)N(C)C ZINC000159788482 545980729 /nfs/dbraw/zinc/98/07/29/545980729.db2.gz BQICBZWBXZZTHJ-QGZVFWFLSA-N 1 1 369.469 2.055 20 70 FEIDMO C[C@@H](C[C@H](O)c1ccccc1)NC(=O)NCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000159808031 545981977 /nfs/dbraw/zinc/98/19/77/545981977.db2.gz ABOLYOHDLSEWJO-BMFAXAFESA-N 1 1 363.502 2.297 20 70 FEIDMO CC[C@H](CNC(=O)N[C@H]1CCc2n[nH]cc2C1)[N@H+]1CCc2ccccc2C1 ZINC000159874518 545988646 /nfs/dbraw/zinc/98/86/46/545988646.db2.gz KIJKYFXCLBJUNV-RBUKOAKNSA-N 1 1 367.497 2.403 20 70 FEIDMO CC(C)N(CCc1nccs1)CC1=Nc2ccccc2S(=O)(=O)N1 ZINC000159906911 545990591 /nfs/dbraw/zinc/99/05/91/545990591.db2.gz MLFYPLPLWBLYLQ-UHFFFAOYSA-N 1 1 364.496 2.418 20 70 FEIDMO C[C@@H]1CC(=O)CC[C@H]1C(=O)NCCC[NH+]1CCN(c2ccccc2)CC1 ZINC000159916933 545991634 /nfs/dbraw/zinc/99/16/34/545991634.db2.gz NAXMOCNCLBIKSO-YLJYHZDGSA-N 1 1 357.498 2.320 20 70 FEIDMO C[C@@H](CCO)NC(=O)N[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000159993807 545997707 /nfs/dbraw/zinc/99/77/07/545997707.db2.gz HNZVDRORSBAIMR-WFASDCNBSA-N 1 1 359.392 2.350 20 70 FEIDMO C[C@@H]1C[C@H](NC(=O)N[C@@H]2CCCCC[C@@H]2C(N)=O)C[N@H+]1Cc1ccccc1 ZINC000160024989 546000748 /nfs/dbraw/zinc/00/07/48/546000748.db2.gz JETCPLWABPBWHS-XGXHKWSGSA-N 1 1 372.513 2.383 20 70 FEIDMO C[C@@H]1C[C@H](NC(=O)N2CCN(CC(F)F)CC2)C[N@H+]1Cc1ccccc1 ZINC000160073216 546005315 /nfs/dbraw/zinc/00/53/15/546005315.db2.gz AHRMSXCAKHCLRJ-WBVHZDCISA-N 1 1 366.456 2.242 20 70 FEIDMO CCC[C@H]1CN(C(=O)NCc2ccc(COC)cc2)CC[N@H+]1CCOC ZINC000160269910 546024286 /nfs/dbraw/zinc/02/42/86/546024286.db2.gz YAOUTJDAUKBMOI-IBGZPJMESA-N 1 1 363.502 2.475 20 70 FEIDMO C[C@H](CNC(=O)NCC(C)(C)c1cccc(F)c1)C[NH+]1CCOCC1 ZINC000160331021 546030670 /nfs/dbraw/zinc/03/06/70/546030670.db2.gz GENARCWFXQIAHZ-OAHLLOKOSA-N 1 1 351.466 2.371 20 70 FEIDMO Cc1c2cc(C)ccc2[nH]c1C(=O)NCCC[N@@H+]1CCC[C@@H]1C(=O)N(C)C ZINC000160373024 546035394 /nfs/dbraw/zinc/03/53/94/546035394.db2.gz WMXHGPWFESODGG-GOSISDBHSA-N 1 1 370.497 2.457 20 70 FEIDMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2cc(S(C)(=O)=O)cs2)C1 ZINC000160597273 546055178 /nfs/dbraw/zinc/05/51/78/546055178.db2.gz HXUYUPVLOJWWEM-ZDUSSCGKSA-N 1 1 358.529 2.394 20 70 FEIDMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2cc(S(C)(=O)=O)cs2)cn1 ZINC000160727690 546066865 /nfs/dbraw/zinc/06/68/65/546066865.db2.gz WJWASWWIYLMKNK-UHFFFAOYSA-N 1 1 362.436 2.293 20 70 FEIDMO Cc1cncc(/C=C/C(=O)NC[C@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)c1 ZINC000160751289 546069486 /nfs/dbraw/zinc/06/94/86/546069486.db2.gz IDXCGTZKWFDUBD-CLJKYYQGSA-N 1 1 351.450 2.155 20 70 FEIDMO COc1cccc2c(N3CCC([N@H+]4CCC[C@@H]4C(N)=O)CC3)cc(C)nc12 ZINC000160804628 546074275 /nfs/dbraw/zinc/07/42/75/546074275.db2.gz FWONIIVXETWFEI-QGZVFWFLSA-N 1 1 368.481 2.470 20 70 FEIDMO O=C(C[N@H+]1CC[C@]2(O)CCCC[C@@H]2C1)NCCc1c(F)cccc1F ZINC000160918201 546084105 /nfs/dbraw/zinc/08/41/05/546084105.db2.gz SHEUDICLEPJPSD-AUUYWEPGSA-N 1 1 352.425 2.251 20 70 FEIDMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)C1 ZINC000161148966 546105097 /nfs/dbraw/zinc/10/50/97/546105097.db2.gz ZRYFXWKDLYAZSZ-DOMZBBRYSA-N 1 1 364.877 2.328 20 70 FEIDMO C[C@H](Oc1cccc(CO)c1)C(=O)N1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC000161269379 546114814 /nfs/dbraw/zinc/11/48/14/546114814.db2.gz ZNSWIYYDXQEXFP-OXJNMPFZSA-N 1 1 354.450 2.462 20 70 FEIDMO C[C@H](Oc1cccc(CO)c1)C(=O)N1CC[N@@H+](C)C[C@@H]1c1ccccc1 ZINC000161269379 546114820 /nfs/dbraw/zinc/11/48/20/546114820.db2.gz ZNSWIYYDXQEXFP-OXJNMPFZSA-N 1 1 354.450 2.462 20 70 FEIDMO CC(=O)N[C@H](CC(=O)NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(F)cc1F ZINC000161341611 546121385 /nfs/dbraw/zinc/12/13/85/546121385.db2.gz RWKVUTPKLXWSHZ-SCLBCKFNSA-N 1 1 365.424 2.133 20 70 FEIDMO CC(C)CCn1ccc(NC(=O)NC[C@H](C(C)C)N2CC[NH+](C)CC2)n1 ZINC000161421755 546128701 /nfs/dbraw/zinc/12/87/01/546128701.db2.gz XETMVUJGBLEXHR-QGZVFWFLSA-N 1 1 364.538 2.323 20 70 FEIDMO C[NH+]1CCN(C(=O)[C@H]2CCCN(C(=O)CC/C=C/c3ccccc3)C2)CC1 ZINC000160188361 326956683 /nfs/dbraw/zinc/95/66/83/326956683.db2.gz ATCMUYLZUMQERR-JOCSGSGBSA-N 1 1 369.509 2.493 20 70 FEIDMO CCCNC(=O)C[NH+]1CCC(NC(=O)[C@@H]2C[C@H]2c2sccc2C)CC1 ZINC000161476291 327000379 /nfs/dbraw/zinc/00/03/79/327000379.db2.gz IZBLHEDNHGGUNQ-HZPDHXFCSA-N 1 1 363.527 2.267 20 70 FEIDMO COc1cc([C@@H](C)[NH2+]C2CCN(C)CC2)ccc1S(=O)(=O)C(F)F ZINC000161487280 327000977 /nfs/dbraw/zinc/00/09/77/327000977.db2.gz HIPWHKYCVGMGFO-LLVKDONJSA-N 1 1 362.442 2.436 20 70 FEIDMO NC(=O)[C@@H]1CCC[N@H+]1C1CCN(Cc2csc(Br)c2)CC1 ZINC000159408917 545951119 /nfs/dbraw/zinc/95/11/19/545951119.db2.gz BHUXYMGXSYAWKE-ZDUSSCGKSA-N 1 1 372.332 2.425 20 70 FEIDMO CCc1ccc(CN2CCN(C(=O)NC[C@@H]3CCC[N@@H+](C)C3)CC2)s1 ZINC000159444911 545954213 /nfs/dbraw/zinc/95/42/13/545954213.db2.gz HXLLXAIUFJITSJ-INIZCTEOSA-N 1 1 364.559 2.480 20 70 FEIDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)C(=O)Nc2cccc(-c3cnco3)c2)C1 ZINC000159453915 545955098 /nfs/dbraw/zinc/95/50/98/545955098.db2.gz UBDZXIDMSQFPIC-OAHLLOKOSA-N 1 1 370.453 2.374 20 70 FEIDMO COC(=O)C1([N@@H+](C)C[C@H](O)Cn2cnc3cc(C)c(C)cc32)CCCC1 ZINC000159483837 545957623 /nfs/dbraw/zinc/95/76/23/545957623.db2.gz LKLBBFLUVWCCAJ-INIZCTEOSA-N 1 1 359.470 2.432 20 70 FEIDMO O=C(Nc1ccnn1C[C@@H]1CCOC1)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000159551527 545962456 /nfs/dbraw/zinc/96/24/56/545962456.db2.gz SSCVANLGCKAZRF-IRXDYDNUSA-N 1 1 361.490 2.306 20 70 FEIDMO CN(C)c1cccc(C[N@@H+](C)CCC(=O)Nc2sccc2C(N)=O)c1 ZINC000159801560 545981440 /nfs/dbraw/zinc/98/14/40/545981440.db2.gz DMYYOFVXOFYRAO-UHFFFAOYSA-N 1 1 360.483 2.374 20 70 FEIDMO CCCN(CC(=O)Nc1ccccc1C)C(=O)C[N@@H+]1CCCC[C@@H]1CO ZINC000159941690 545993534 /nfs/dbraw/zinc/99/35/34/545993534.db2.gz ZWKVUTULJMTQPH-QGZVFWFLSA-N 1 1 361.486 2.019 20 70 FEIDMO CCCN(CC(=O)Nc1ccccc1C)C(=O)C[N@H+]1CCCC[C@@H]1CO ZINC000159941690 545993537 /nfs/dbraw/zinc/99/35/37/545993537.db2.gz ZWKVUTULJMTQPH-QGZVFWFLSA-N 1 1 361.486 2.019 20 70 FEIDMO C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2cnn(C)c2)CC[N@H+]1Cc1ccccc1 ZINC000160007919 545999870 /nfs/dbraw/zinc/99/98/70/545999870.db2.gz FQZKHERIBKMYKS-WBVHZDCISA-N 1 1 362.499 2.094 20 70 FEIDMO Cc1cccc(NC[C@@H]2CC[N@@H+]([C@@H]3CCCN(c4cnn(C)c4)C3=O)C2)n1 ZINC000160092284 546006463 /nfs/dbraw/zinc/00/64/63/546006463.db2.gz CEQAASSUKADWKN-FUHWJXTLSA-N 1 1 368.485 2.053 20 70 FEIDMO Cc1cccc(NC[C@@H]2CC[N@H+]([C@@H]3CCCN(c4cnn(C)c4)C3=O)C2)n1 ZINC000160092284 546006465 /nfs/dbraw/zinc/00/64/65/546006465.db2.gz CEQAASSUKADWKN-FUHWJXTLSA-N 1 1 368.485 2.053 20 70 FEIDMO C[N@@H+]1CCN(C(=O)CCCNC(=O)c2cccnc2)[C@H](c2ccccc2)C1 ZINC000160171393 546013646 /nfs/dbraw/zinc/01/36/46/546013646.db2.gz WIQKNAJHRFQMIN-IBGZPJMESA-N 1 1 366.465 2.107 20 70 FEIDMO C[N@H+]1CCN(C(=O)CCCNC(=O)c2cccnc2)[C@H](c2ccccc2)C1 ZINC000160171393 546013649 /nfs/dbraw/zinc/01/36/49/546013649.db2.gz WIQKNAJHRFQMIN-IBGZPJMESA-N 1 1 366.465 2.107 20 70 FEIDMO COc1cc(C2(C(=O)NC[C@H](C(C)C)N3CC[NH+](C)CC3)CC2)ccc1C ZINC000160346595 546033071 /nfs/dbraw/zinc/03/30/71/546033071.db2.gz OPFJQMOYHMSESK-LJQANCHMSA-N 1 1 373.541 2.423 20 70 FEIDMO C[C@H]1C[C@H](NC(=O)N2CCC(C3OCCO3)CC2)C[N@H+]1Cc1ccccc1 ZINC000160397914 546037660 /nfs/dbraw/zinc/03/76/60/546037660.db2.gz OBTPLCZVPBDAPK-LPHOPBHVSA-N 1 1 373.497 2.444 20 70 FEIDMO C[C@@H]1C[C@H](NC(=O)N2CCC(C3OCCO3)CC2)C[N@H+]1Cc1ccccc1 ZINC000160397785 546037680 /nfs/dbraw/zinc/03/76/80/546037680.db2.gz OBTPLCZVPBDAPK-APWZRJJASA-N 1 1 373.497 2.444 20 70 FEIDMO CCOC[C@@H](O)C[N@H+]1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1 ZINC000160623713 546056661 /nfs/dbraw/zinc/05/66/61/546056661.db2.gz SWTWKGPNGRMJHM-PBHICJAKSA-N 1 1 353.438 2.057 20 70 FEIDMO CC(=O)c1ccccc1C(=O)NC[C@H]1C[C@H](O)C[N@@H+]1Cc1ccccc1 ZINC000160742961 546067948 /nfs/dbraw/zinc/06/79/48/546067948.db2.gz SUZCANBVRCJTOF-MSOLQXFVSA-N 1 1 352.434 2.254 20 70 FEIDMO CC(=O)c1ccccc1C(=O)NC[C@H]1C[C@H](O)C[N@H+]1Cc1ccccc1 ZINC000160742961 546067952 /nfs/dbraw/zinc/06/79/52/546067952.db2.gz SUZCANBVRCJTOF-MSOLQXFVSA-N 1 1 352.434 2.254 20 70 FEIDMO C[N@@H+](CCNC(=O)N1CCCN(CC(F)F)CC1)Cc1ccccc1 ZINC000160860989 546079343 /nfs/dbraw/zinc/07/93/43/546079343.db2.gz NZPZMJXABRFISK-UHFFFAOYSA-N 1 1 354.445 2.101 20 70 FEIDMO CCO[C@@H]1C[C@@H](N(C)C(=O)NCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)C12CCC2 ZINC000160884107 546080754 /nfs/dbraw/zinc/08/07/54/546080754.db2.gz GMYFQVKXCHAYLM-XMTFNYHQSA-N 1 1 367.534 2.475 20 70 FEIDMO CC[C@@H](C(=O)NCc1nnc(-c2ccc(Br)cc2)[nH]1)[NH+](C)C ZINC000160904718 546083295 /nfs/dbraw/zinc/08/32/95/546083295.db2.gz KFVGYRZMKKFDLP-LBPRGKRZSA-N 1 1 366.263 2.191 20 70 FEIDMO CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)N1CCC[C@H](NC(=O)C(C)C)C1 ZINC000160920312 546084631 /nfs/dbraw/zinc/08/46/31/546084631.db2.gz QXPKGPLQMXAWKY-ROUUACIJSA-N 1 1 366.550 2.443 20 70 FEIDMO O=C(NCCC[NH+]1CCOCC1)NOCc1ccc(C(F)(F)F)cc1 ZINC000160981072 546090187 /nfs/dbraw/zinc/09/01/87/546090187.db2.gz ZIYJKDZPGIMEAW-UHFFFAOYSA-N 1 1 361.364 2.159 20 70 FEIDMO O=C(c1cccc(-n2ccnn2)c1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000161189596 546107811 /nfs/dbraw/zinc/10/78/11/546107811.db2.gz RAUAKRUZOBPUIG-UHFFFAOYSA-N 1 1 361.449 2.268 20 70 FEIDMO C[N@H+]1CCC[C@H]1CNC(=O)C(=O)Nc1ccc(Sc2ccncc2)cc1 ZINC000161251150 546113772 /nfs/dbraw/zinc/11/37/72/546113772.db2.gz YFWSERSEHOFFCH-HNNXBMFYSA-N 1 1 370.478 2.382 20 70 FEIDMO CCOC[C@@H]1CC[N@H+](Cc2nc3oc(C)c(C(=O)OCC)c3c(N)n2)C1 ZINC000161392669 546126323 /nfs/dbraw/zinc/12/63/23/546126323.db2.gz HHSOIVUVIUNPMZ-GFCCVEGCSA-N 1 1 362.430 2.149 20 70 FEIDMO CCOC[C@@H]1CC[N@@H+](Cc2nc3oc(C)c(C(=O)OCC)c3c(N)n2)C1 ZINC000161392669 546126327 /nfs/dbraw/zinc/12/63/27/546126327.db2.gz HHSOIVUVIUNPMZ-GFCCVEGCSA-N 1 1 362.430 2.149 20 70 FEIDMO Cc1c(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)cnn1C(C)(C)C ZINC000159594210 326936364 /nfs/dbraw/zinc/93/63/64/326936364.db2.gz FTNSRUAGESXBAR-UHFFFAOYSA-N 1 1 350.507 2.377 20 70 FEIDMO COc1ccc(O[C@@H](C)C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)cc1 ZINC000160288144 326960223 /nfs/dbraw/zinc/96/02/23/326960223.db2.gz NLDBWJQYGUJPOS-INIZCTEOSA-N 1 1 364.486 2.279 20 70 FEIDMO CCc1noc(C)c1NC(=O)C(=O)NC[C@H](c1ccc(C)o1)[NH+]1CCCC1 ZINC000160440405 326965733 /nfs/dbraw/zinc/96/57/33/326965733.db2.gz ITAIDXNMDXKKHQ-OAHLLOKOSA-N 1 1 374.441 2.339 20 70 FEIDMO COc1ccccc1[C@@H](CNC(=O)[C@H](C)Oc1cccc(CO)c1)[NH+](C)C ZINC000160996959 326984509 /nfs/dbraw/zinc/98/45/09/326984509.db2.gz LTOLODZJJPECTM-HNAYVOBHSA-N 1 1 372.465 2.374 20 70 FEIDMO COc1ccc(CC(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)cc1OC ZINC000160204116 518149090 /nfs/dbraw/zinc/14/90/90/518149090.db2.gz XBVNNFSMFFBQMA-UHFFFAOYSA-N 1 1 364.486 2.063 20 70 FEIDMO 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O=C(Nc1ccc(CC[NH+]2CCOCC2)cc1)N1CCOC2(CCC2)C1 ZINC000159822981 545983650 /nfs/dbraw/zinc/98/36/50/545983650.db2.gz DBQJEJANFNNRSM-UHFFFAOYSA-N 1 1 359.470 2.348 20 70 FEIDMO CCC(=O)N[C@@H]1CCCN(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000159968012 545995862 /nfs/dbraw/zinc/99/58/62/545995862.db2.gz DHBPRZUEHZIGED-UHOSZYNNSA-N 1 1 372.513 2.207 20 70 FEIDMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(n2cncn2)CC1 ZINC000160002095 545999069 /nfs/dbraw/zinc/99/90/69/545999069.db2.gz VWBFJVASKPHMQB-LPHOPBHVSA-N 1 1 368.485 2.145 20 70 FEIDMO COC(=O)[C@@H]1CCCN(C(=O)NC[C@H]2CCC[N@H+]2Cc2ccccc2)C1 ZINC000160016253 546000657 /nfs/dbraw/zinc/00/06/57/546000657.db2.gz PURHABCIIWJNTL-QZTJIDSGSA-N 1 1 359.470 2.246 20 70 FEIDMO Cc1n[nH]c(C(C)C)c1C(=O)NCCN1CC[NH+](Cc2ccccc2)CC1 ZINC000160038790 546001839 /nfs/dbraw/zinc/00/18/39/546001839.db2.gz NUTYERKGORALCL-UHFFFAOYSA-N 1 1 369.513 2.389 20 70 FEIDMO CC(C)C[NH+]1CCN(C(=O)C(=O)Nc2cccnc2-c2ccccc2)CC1 ZINC000160157820 546012027 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CCC[C@H]1CN(C(=O)NCCc2cn3ccccc3n2)CC[N@H+]1CCOC ZINC000160097352 546006324 /nfs/dbraw/zinc/00/63/24/546006324.db2.gz IKVDDFAERSZGOQ-SFHVURJKSA-N 1 1 373.501 2.019 20 70 FEIDMO O=C(CN1CC[NH+](Cc2ccccc2)CC1)N[C@H]1CCOC2(CCCC2)C1 ZINC000160100392 546007409 /nfs/dbraw/zinc/00/74/09/546007409.db2.gz KLCWIFJESHAVFB-FQEVSTJZSA-N 1 1 371.525 2.412 20 70 FEIDMO C[C@H]1C[C@H](NC(=O)NC[C@](C)(O)c2ccco2)C[N@H+]1Cc1ccccc1 ZINC000160109491 546008155 /nfs/dbraw/zinc/00/81/55/546008155.db2.gz CWJYVYIPRUHSTP-KNBMTAEXSA-N 1 1 357.454 2.449 20 70 FEIDMO CO[C@@H]1CCC[C@H]1NC(=O)NCCC[NH+]1CCN(Cc2ccccc2)CC1 ZINC000160355956 546032445 /nfs/dbraw/zinc/03/24/45/546032445.db2.gz DBEUVURUTHKFGB-WOJBJXKFSA-N 1 1 374.529 2.061 20 70 FEIDMO C[C@@H]1C[C@@H](NC(=O)N2CCC(C3OCCO3)CC2)C[N@H+]1Cc1ccccc1 ZINC000160398065 546037231 /nfs/dbraw/zinc/03/72/31/546037231.db2.gz OBTPLCZVPBDAPK-VQIMIIECSA-N 1 1 373.497 2.444 20 70 FEIDMO Cc1sc(C(=O)NC[C@H]2CCC[N@H+]2CC(C)C)cc1CS(C)(=O)=O ZINC000160493611 546045590 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ZINC000160350048 546033259 /nfs/dbraw/zinc/03/32/59/546033259.db2.gz ISNNIESTQRHZJH-QGZVFWFLSA-N 1 1 373.541 2.425 20 70 FEIDMO C[C@@H]1C[N@@H+](C[C@@H]2CCCN2C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)C[C@H](C)O1 ZINC000160489902 546045541 /nfs/dbraw/zinc/04/55/41/546045541.db2.gz PMZSKUVYYCNHQG-PHAGKYIGSA-N 1 1 365.518 2.227 20 70 FEIDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)C[C@H](C)O1 ZINC000160489902 546045544 /nfs/dbraw/zinc/04/55/44/546045544.db2.gz PMZSKUVYYCNHQG-PHAGKYIGSA-N 1 1 365.518 2.227 20 70 FEIDMO CC(C)[C@H](C(=O)NC[C@H]1C[C@H](O)CN1Cc1ccccc1)[NH+]1CCCCC1 ZINC000160549468 546051386 /nfs/dbraw/zinc/05/13/86/546051386.db2.gz YRKODDNTMOSDHR-QHAWAJNXSA-N 1 1 373.541 2.249 20 70 FEIDMO CCCn1nc(C)c(C(=O)NC[C@@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)c1C ZINC000160615242 546056889 /nfs/dbraw/zinc/05/68/89/546056889.db2.gz YRDLJKGYYXKWHW-OALUTQOASA-N 1 1 370.497 2.275 20 70 FEIDMO C[C@@H]1CCCC[N@H+]1CCNC(=O)NCc1cccnc1OCC(F)F ZINC000160687800 546063461 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20 70 FEIDMO COC(=O)c1csc(NC(=O)N(C)CCN(C)C2CC[NH+](C)CC2)c1 ZINC000160892617 546082194 /nfs/dbraw/zinc/08/21/94/546082194.db2.gz PBPWQWQSBIPLJT-UHFFFAOYSA-N 1 1 368.503 2.024 20 70 FEIDMO COCC[N@H+]1CCC[C@H]1CNC(=O)NCCc1ccc(OC)cc1Cl ZINC000161100424 546099576 /nfs/dbraw/zinc/09/95/76/546099576.db2.gz IOAQMLDXZUEIAB-HNNXBMFYSA-N 1 1 369.893 2.301 20 70 FEIDMO COCC[N@@H+]1CCN(C(=O)Nc2cnn(CCC(C)C)c2C)C[C@H]1C ZINC000161338197 546121111 /nfs/dbraw/zinc/12/11/11/546121111.db2.gz MREYTZXUVVLJGU-OAHLLOKOSA-N 1 1 351.495 2.422 20 70 FEIDMO COCC[N@H+]1CCN(C(=O)Nc2cnn(CCC(C)C)c2C)C[C@H]1C ZINC000161338197 546121113 /nfs/dbraw/zinc/12/11/13/546121113.db2.gz MREYTZXUVVLJGU-OAHLLOKOSA-N 1 1 351.495 2.422 20 70 FEIDMO C[C@H](c1ccc(NC(=O)[C@H]2CCn3ccnc3C2)cc1)[NH+]1CCOCC1 ZINC000161446647 546130614 /nfs/dbraw/zinc/13/06/14/546130614.db2.gz DERDIAMZXUUSOF-WBVHZDCISA-N 1 1 354.454 2.477 20 70 FEIDMO C[C@@H]1CCCC[C@@H]1NC(=O)NC(=O)CN1CC[N@H+](C)C[C@@H]1c1ccccc1 ZINC000216737015 548679231 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351.495 2.099 20 70 FEIDMO O=C(Nc1ccnn1C[C@@H]1CCOC1)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC000159551373 545962726 /nfs/dbraw/zinc/96/27/26/545962726.db2.gz SSCVANLGCKAZRF-DLBZAZTESA-N 1 1 361.490 2.306 20 70 FEIDMO COc1cccc(CNC(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000159598668 545966132 /nfs/dbraw/zinc/96/61/32/545966132.db2.gz QQVYYZMEFDSFTA-QAPCUYQASA-N 1 1 354.454 2.410 20 70 FEIDMO CNC(=O)[C@@H]1CCC[N@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000159612077 545967145 /nfs/dbraw/zinc/96/71/45/545967145.db2.gz KGTPBIONVBNZGY-SNVBAGLBSA-N 1 1 351.248 2.283 20 70 FEIDMO CNC(=O)[C@@H]1CCC[N@@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000159612077 545967148 /nfs/dbraw/zinc/96/71/48/545967148.db2.gz KGTPBIONVBNZGY-SNVBAGLBSA-N 1 1 351.248 2.283 20 70 FEIDMO CCOc1ccc([C@@H](C)NC(=O)C[N@@H+](C)C[C@@H]2CCC[C@@H]2O)cc1OC ZINC000159638609 545969083 /nfs/dbraw/zinc/96/90/83/545969083.db2.gz GADRTPSOLGVRFK-PVAVHDDUSA-N 1 1 364.486 2.364 20 70 FEIDMO COC(=O)CC[N@H+](CC(=O)Nc1cc(C(C)(C)C)nn1C)CC(C)C ZINC000159709368 545974789 /nfs/dbraw/zinc/97/47/89/545974789.db2.gz IKTPRXHKNAFJRO-UHFFFAOYSA-N 1 1 352.479 2.177 20 70 FEIDMO COCCOC[C@H]1CC[N@H+]([C@@H]2CCCN(c3ccccc3F)C2=O)C1 ZINC000159737188 545976607 /nfs/dbraw/zinc/97/66/07/545976607.db2.gz LJKXNTOPWVJTEQ-MAUKXSAKSA-N 1 1 350.434 2.306 20 70 FEIDMO COc1ccc(OC)c([C@H](C)NC(=O)[C@H](C)[N@@H+](C)C[C@@H]2CCC[C@@H]2O)c1 ZINC000159775272 545979844 /nfs/dbraw/zinc/97/98/44/545979844.db2.gz YGZZDQNSYMIWRN-XSWJXKHESA-N 1 1 364.486 2.362 20 70 FEIDMO Cc1cc(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)nn1C(C)(C)C ZINC000159841693 545984863 /nfs/dbraw/zinc/98/48/63/545984863.db2.gz VETLRIRMCNPIJX-UHFFFAOYSA-N 1 1 350.507 2.377 20 70 FEIDMO CC[N@H+]1CCCN(C(=O)NC[C@@H](c2c(F)cccc2F)N(C)C)CC1 ZINC000159867050 545986896 /nfs/dbraw/zinc/98/68/96/545986896.db2.gz MUGKJBPODOTZIR-INIZCTEOSA-N 1 1 354.445 2.305 20 70 FEIDMO COCCNC(=O)c1ccc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)nc1 ZINC000160228448 546018961 /nfs/dbraw/zinc/01/89/61/546018961.db2.gz FRZYDUMMMNCJSK-APWZRJJASA-N 1 1 368.481 2.390 20 70 FEIDMO CCN(C(=O)N[C@@H]1CCN(C(C)C)C1=O)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160228830 546019094 /nfs/dbraw/zinc/01/90/94/546019094.db2.gz LIVVWRXAZITYNE-RBUKOAKNSA-N 1 1 372.513 2.302 20 70 FEIDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc(N2CCNC2=O)ccc1F ZINC000160245483 546021633 /nfs/dbraw/zinc/02/16/33/546021633.db2.gz CEZQJJBIIRWASF-CQSZACIVSA-N 1 1 362.449 2.350 20 70 FEIDMO CCc1noc(C)c1NC(=O)C(=O)NCC(C)(C)[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000160267376 546024273 /nfs/dbraw/zinc/02/42/73/546024273.db2.gz QNCBZUBRUZYLGZ-BETUJISGSA-N 1 1 364.490 2.357 20 70 FEIDMO COCCOc1ccccc1C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000160274411 546026145 /nfs/dbraw/zinc/02/61/45/546026145.db2.gz VKLACCXLSDTKTR-UHFFFAOYSA-N 1 1 364.486 2.142 20 70 FEIDMO Cc1ccc(NC(=O)C(=O)N[C@H]2CCC[N@@H+](Cc3ccccc3)C2)cn1 ZINC000160336572 546032221 /nfs/dbraw/zinc/03/22/21/546032221.db2.gz HQOZXNJPIRJMAH-SFHVURJKSA-N 1 1 352.438 2.109 20 70 FEIDMO COc1cc(C2(C(=O)NC[C@@H](C)CN3CC[NH+](C)CC3)CC2)ccc1C ZINC000160349668 546032617 /nfs/dbraw/zinc/03/26/17/546032617.db2.gz YMWZJKLMMZFRCT-MRXNPFEDSA-N 1 1 359.514 2.035 20 70 FEIDMO CC(C)CCn1ccc(NC(=O)C(=O)NCC[N@@H+](C)C2CCCCC2)n1 ZINC000160393041 546036265 /nfs/dbraw/zinc/03/62/65/546036265.db2.gz ZWHZUSRJAYBLRH-UHFFFAOYSA-N 1 1 363.506 2.248 20 70 FEIDMO CCc1cc(N2CCC[C@@H]2C[NH+]2CCOCC2)nc(-c2ccccn2)n1 ZINC000160399746 546037300 /nfs/dbraw/zinc/03/73/00/546037300.db2.gz PPZYEPFDIFKXLM-QGZVFWFLSA-N 1 1 353.470 2.402 20 70 FEIDMO CCN1CC[NH+](CCCNC(=O)[C@@H]2C[C@@H]2c2cccc(F)c2F)CC1 ZINC000160439647 546041180 /nfs/dbraw/zinc/04/11/80/546041180.db2.gz JOPRHVPGUDPQRI-HZPDHXFCSA-N 1 1 351.441 2.212 20 70 FEIDMO CC(C)S(=O)(=O)CCC[N@H+](C)[C@H](C)c1ccc(-n2cncn2)cc1 ZINC000160565579 546052099 /nfs/dbraw/zinc/05/20/99/546052099.db2.gz ZXIHAPGQUJZRLI-OAHLLOKOSA-N 1 1 350.488 2.473 20 70 FEIDMO CC(C)S(=O)(=O)CCC[N@@H+](C)[C@H](C)c1ccc(-n2cncn2)cc1 ZINC000160565579 546052104 /nfs/dbraw/zinc/05/21/04/546052104.db2.gz ZXIHAPGQUJZRLI-OAHLLOKOSA-N 1 1 350.488 2.473 20 70 FEIDMO C[C@H]([NH2+]CC(=O)NCC(F)(F)F)c1ccc(-n2cncn2)cc1Cl ZINC000160587053 546055100 /nfs/dbraw/zinc/05/51/00/546055100.db2.gz HOIFNVPUBLRUHN-VIFPVBQESA-N 1 1 361.755 2.250 20 70 FEIDMO CC[NH+]1CCN(CCCCNC(=O)Nc2ccn(CCC(C)C)n2)CC1 ZINC000160618531 546056874 /nfs/dbraw/zinc/05/68/74/546056874.db2.gz PSWICYUAXRBBNV-UHFFFAOYSA-N 1 1 364.538 2.468 20 70 FEIDMO Cn1cc[nH+]c1CC1CCN(c2nc3c(cnn3C(C)(C)C)c(=O)[nH]2)CC1 ZINC000160670720 546061107 /nfs/dbraw/zinc/06/11/07/546061107.db2.gz CKAVQSSBYMTWQR-UHFFFAOYSA-N 1 1 369.473 2.067 20 70 FEIDMO C[C@@H](Oc1cccc(CO)c1)C(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000160674655 546062267 /nfs/dbraw/zinc/06/22/67/546062267.db2.gz NWNHMBBFKRPUCA-QGZVFWFLSA-N 1 1 354.450 2.291 20 70 FEIDMO Cc1cnn(Cc2cc(C(=O)N3CCC([N@@H+]4CCC[C@H]4C)CC3)no2)c1 ZINC000160812549 546074856 /nfs/dbraw/zinc/07/48/56/546074856.db2.gz XWFHTBDLEGHBDS-OAHLLOKOSA-N 1 1 357.458 2.317 20 70 FEIDMO CN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000160829736 546076474 /nfs/dbraw/zinc/07/64/74/546076474.db2.gz QVVWEELAHDKSAV-IEBWSBKVSA-N 1 1 372.513 2.002 20 70 FEIDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCNC(=O)C[C@H]1c1ccccc1 ZINC000160878566 546079751 /nfs/dbraw/zinc/07/97/51/546079751.db2.gz ZIZPEHUKTYPNRT-MJGOQNOKSA-N 1 1 370.497 2.276 20 70 FEIDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)N1CCN(Cc2ccccn2)CC1 ZINC000160875813 546079915 /nfs/dbraw/zinc/07/99/15/546079915.db2.gz NULKRYMTHGQZEX-HXUWFJFHSA-N 1 1 373.545 2.419 20 70 FEIDMO CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(S(=O)(=O)CC)c1 ZINC000160877651 546080246 /nfs/dbraw/zinc/08/02/46/546080246.db2.gz BELMQDOAMKXTHY-SJORKVTESA-N 1 1 364.511 2.108 20 70 FEIDMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(S(=O)(=O)CC)c1 ZINC000160877651 546080249 /nfs/dbraw/zinc/08/02/49/546080249.db2.gz BELMQDOAMKXTHY-SJORKVTESA-N 1 1 364.511 2.108 20 70 FEIDMO C[N@@H+](CCNC(=O)c1ccc(C(=O)NC2CC2)cc1)Cc1ccccc1 ZINC000160891682 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CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)/C=C/c1cnc2ccccc2n1 ZINC000160335022 546031958 /nfs/dbraw/zinc/03/19/58/546031958.db2.gz TZRDBRSOSUXFDM-CMDGGOBGSA-N 1 1 368.481 2.460 20 70 FEIDMO CCCNC(=O)C[NH+]1CCC(NC(=O)NCC2(CCC)CCC2)CC1 ZINC000160452905 546042140 /nfs/dbraw/zinc/04/21/40/546042140.db2.gz QXPUKVJKRBDSEF-UHFFFAOYSA-N 1 1 352.523 2.247 20 70 FEIDMO CSCCNC(=O)N(C)[C@H]1CCCC[C@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000160481945 546045655 /nfs/dbraw/zinc/04/56/55/546045655.db2.gz SYNRQLJBAUKUQK-SJORKVTESA-N 1 1 356.580 2.328 20 70 FEIDMO CC(C)[C@H](C(=O)NC[C@@H]1C[C@H](O)CN1Cc1ccccc1)[NH+]1CCCCC1 ZINC000160549219 546051606 /nfs/dbraw/zinc/05/16/06/546051606.db2.gz YRKODDNTMOSDHR-PCCBWWKXSA-N 1 1 373.541 2.249 20 70 FEIDMO CCN(C(=O)NCc1ccc(C(N)=O)o1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160569268 546051956 /nfs/dbraw/zinc/05/19/56/546051956.db2.gz ACCOKEPJMROOOZ-MRXNPFEDSA-N 1 1 370.453 2.185 20 70 FEIDMO Cc1[nH+]ccn1CCCN(C)C(=O)Nc1ccc(N2CCOCC2)nc1C ZINC000160581989 546054060 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70 FEIDMO CCN(C(=O)NCC(C)(C)C(=O)NC)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160854556 546077989 /nfs/dbraw/zinc/07/79/89/546077989.db2.gz ILOGORIQGLYHTD-KRWDZBQOSA-N 1 1 360.502 2.065 20 70 FEIDMO CCC(=O)N[C@@H]1CCCN(C(=O)NC[C@H]2CCCC[N@H+]2CC(C)C)C1 ZINC000160943132 546086699 /nfs/dbraw/zinc/08/66/99/546086699.db2.gz SGVXNVRHTCMEMH-IAGOWNOFSA-N 1 1 352.523 2.197 20 70 FEIDMO CCO[C@H]1C[C@H](N(C)C(=O)NC2CC[NH+](CCN(C)C)CC2)C12CCC2 ZINC000160941264 546086897 /nfs/dbraw/zinc/08/68/97/546086897.db2.gz SWTZVWWZAUBADP-ROUUACIJSA-N 1 1 366.550 2.002 20 70 FEIDMO CCc1ncc(NC(=O)N(C)CC[NH+]2CCN(c3ccccc3)CC2)cn1 ZINC000161156985 546104827 /nfs/dbraw/zinc/10/48/27/546104827.db2.gz SSTWAMYKVRHYDB-UHFFFAOYSA-N 1 1 368.485 2.325 20 70 FEIDMO C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)CNC(=O)c2cccnc2)CC1 ZINC000161185033 546107987 /nfs/dbraw/zinc/10/79/87/546107987.db2.gz ZXYZYBVVFXVCGE-QGZVFWFLSA-N 1 1 372.513 2.315 20 70 FEIDMO O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1CCn2ccnc2C1 ZINC000161391011 546126240 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CC[N@@H+](CCc1nccs1)CC(=O)NCCOc1cccc(F)c1 ZINC000159427190 545952740 /nfs/dbraw/zinc/95/27/40/545952740.db2.gz NYXWTNMGZVMSEP-UHFFFAOYSA-N 1 1 351.447 2.342 20 70 FEIDMO CN(Cc1ccc(OC(F)F)cc1)C(=O)C[N@@H+](C)C[C@H]1CCC[C@@H]1O ZINC000159464487 545955906 /nfs/dbraw/zinc/95/59/06/545955906.db2.gz IGNCDCZQJNCVSX-ZBFHGGJFSA-N 1 1 356.413 2.339 20 70 FEIDMO CN(C)CC[NH+]1CCC(NC(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)CC1 ZINC000159543730 545961723 /nfs/dbraw/zinc/96/17/23/545961723.db2.gz KGKXEDRQWOWMLX-VQTJNVASSA-N 1 1 374.529 2.232 20 70 FEIDMO C[C@@H](C(=O)N1CCC(CC(=O)N2CC[NH+](C)CC2)CC1)c1ccsc1 ZINC000159589276 545965229 /nfs/dbraw/zinc/96/52/29/545965229.db2.gz YAXWZLVRSWAAEG-OAHLLOKOSA-N 1 1 363.527 2.254 20 70 FEIDMO CC1(C)C[C@H]1C(=O)NCc1cccc(NC(=O)CC[NH+]2CCOCC2)c1 ZINC000159690629 545973605 /nfs/dbraw/zinc/97/36/05/545973605.db2.gz OWFMWHUZLURTCG-KRWDZBQOSA-N 1 1 359.470 2.010 20 70 FEIDMO CC(C)(C)C(=O)N1CCC(C[NH+]2CCN(C3CCOCC3)CC2)CC1 ZINC000159971210 545996237 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359.470 2.198 20 70 FEIDMO COC[C@H](NCC(=O)NC[C@H](c1ccccc1)[NH+](C)C)c1ccccc1 ZINC000160395407 546036573 /nfs/dbraw/zinc/03/65/73/546036573.db2.gz LBQCGXHXYQARSS-VQTJNVASSA-N 1 1 355.482 2.383 20 70 FEIDMO CC[N@H+]1CCCN(C(=O)[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)CC1 ZINC000160424392 546039826 /nfs/dbraw/zinc/03/98/26/546039826.db2.gz VFBHNCSIYONYIH-ZDUSSCGKSA-N 1 1 367.852 2.386 20 70 FEIDMO CCC[C@@H]1CN(C(=O)NCc2ccc(OC)c(F)c2)CC[N@H+]1CCOC ZINC000160475758 546044127 /nfs/dbraw/zinc/04/41/27/546044127.db2.gz VCDATGREPGLKPB-MRXNPFEDSA-N 1 1 367.465 2.477 20 70 FEIDMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)CNC(=O)c1ccc2c(c1)CCC2 ZINC000160577212 546053207 /nfs/dbraw/zinc/05/32/07/546053207.db2.gz QAADNTWGECFYCM-LJQANCHMSA-N 1 1 357.498 2.142 20 70 FEIDMO C[NH+](C)CC(C)(C)CNC(=O)C1CCN(Cc2cnc3ccccn23)CC1 ZINC000160615729 546057164 /nfs/dbraw/zinc/05/71/64/546057164.db2.gz XVEQIXKPMLRJMU-UHFFFAOYSA-N 1 1 371.529 2.250 20 70 FEIDMO CCC[C@H]1CN(C(=O)NC2CC[NH+](C(C)(C)C)CC2)CCN1CCOC ZINC000160701158 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1 362.440 2.283 20 70 FEIDMO CCCCNC(=O)C1CCN(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)CC1 ZINC000160845507 546077541 /nfs/dbraw/zinc/07/75/41/546077541.db2.gz SPFCJZGRRDCDSN-QGZVFWFLSA-N 1 1 364.534 2.341 20 70 FEIDMO Cc1cnn(Cc2cc(C(=O)N3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)no2)c1 ZINC000160907444 546083044 /nfs/dbraw/zinc/08/30/44/546083044.db2.gz XONCCUDKDGEQJW-DNVCBOLYSA-N 1 1 369.469 2.317 20 70 FEIDMO C[C@H](c1ccc(NC(=O)N(C)CCN2CCCC2=O)cc1)[NH+]1CCOCC1 ZINC000161034922 546095341 /nfs/dbraw/zinc/09/53/41/546095341.db2.gz FTRTUWYVALMOKZ-MRXNPFEDSA-N 1 1 374.485 2.166 20 70 FEIDMO Cc1ccc(S(N)(=O)=O)cc1NC(=O)C[N@@H+]1CCC[C@@H]1c1ccccc1 ZINC000161319365 546119926 /nfs/dbraw/zinc/11/99/26/546119926.db2.gz SJPDTUBTFIXDGJ-GOSISDBHSA-N 1 1 373.478 2.418 20 70 FEIDMO Cc1ccc(S(N)(=O)=O)cc1NC(=O)C[N@H+]1CCC[C@@H]1c1ccccc1 ZINC000161319365 546119928 /nfs/dbraw/zinc/11/99/28/546119928.db2.gz SJPDTUBTFIXDGJ-GOSISDBHSA-N 1 1 373.478 2.418 20 70 FEIDMO Cc1ccc(S(N)(=O)=O)cc1NC(=O)C[N@@H+]1CCC[C@H]1c1ccccc1 ZINC000161319498 546120245 /nfs/dbraw/zinc/12/02/45/546120245.db2.gz SJPDTUBTFIXDGJ-SFHVURJKSA-N 1 1 373.478 2.418 20 70 FEIDMO Cc1ccc(S(N)(=O)=O)cc1NC(=O)C[N@H+]1CCC[C@H]1c1ccccc1 ZINC000161319498 546120249 /nfs/dbraw/zinc/12/02/49/546120249.db2.gz SJPDTUBTFIXDGJ-SFHVURJKSA-N 1 1 373.478 2.418 20 70 FEIDMO COC(=O)[C@H](N[C@H]1CCc2[nH+]c(C)cn2C1)c1cc(OC)cc(OC)c1 ZINC000159383807 326929990 /nfs/dbraw/zinc/92/99/90/326929990.db2.gz IRKPRTZARZUBEW-KBXCAEBGSA-N 1 1 359.426 2.027 20 70 FEIDMO C[NH+]1CCN(C(=O)Cc2cccc(NC(=O)CCCn3cccc3)c2)CC1 ZINC000159782914 326941846 /nfs/dbraw/zinc/94/18/46/326941846.db2.gz MKDNRZXJMREBRE-UHFFFAOYSA-N 1 1 368.481 2.224 20 70 FEIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cncc(Br)c1 ZINC000160233413 326958265 /nfs/dbraw/zinc/95/82/65/326958265.db2.gz QMDGVAOMHBRBHY-UHFFFAOYSA-N 1 1 370.291 2.275 20 70 FEIDMO COc1cc(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)cc(OC)c1C ZINC000160334291 326962132 /nfs/dbraw/zinc/96/21/32/326962132.db2.gz QYYVCYZAUVTEPJ-UHFFFAOYSA-N 1 1 364.486 2.443 20 70 FEIDMO O=C(Cc1cccc(OCC(F)(F)F)c1)NCCC[NH+]1CCOCC1 ZINC000160531424 326968609 /nfs/dbraw/zinc/96/86/09/326968609.db2.gz PGDRUGGWYJOREY-UHFFFAOYSA-N 1 1 360.376 2.009 20 70 FEIDMO O=C(N[C@H]1CCN(c2ccc(Cl)cc2)C1=O)[C@H]1Cc2ccccc2C[NH2+]1 ZINC000161459269 327000036 /nfs/dbraw/zinc/00/00/36/327000036.db2.gz FKBOCWSZUFSQEB-ZWKOTPCHSA-N 1 1 369.852 2.276 20 70 FEIDMO COc1cccc(CCC[N@H+]2CCCC[C@@H]2CCNS(C)(=O)=O)c1 ZINC000159396076 545950296 /nfs/dbraw/zinc/95/02/96/545950296.db2.gz RFYUQQCDAQDQJJ-QGZVFWFLSA-N 1 1 354.516 2.422 20 70 FEIDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)C(=O)Nc2cnc3ccccc3c2)C1 ZINC000159406408 545950993 /nfs/dbraw/zinc/95/09/93/545950993.db2.gz SJWKZZCPVVTKLR-OAHLLOKOSA-N 1 1 354.454 2.267 20 70 FEIDMO C[C@H](c1nc(-c2ccccc2)no1)N1CCC([N@H+]2CCC[C@@H]2C(N)=O)CC1 ZINC000159406243 545951091 /nfs/dbraw/zinc/95/10/91/545951091.db2.gz HBKUQRGZXAISJP-RHSMWYFYSA-N 1 1 369.469 2.212 20 70 FEIDMO COc1ccc(Cl)cc1CN1CCC([N@H+]2CCC[C@H]2C(N)=O)CC1 ZINC000159423534 545951790 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C[N@H+](CC(=O)NCCOc1ccc(C(F)(F)F)cc1)C[C@@H]1CCC[C@@H]1O ZINC000159503875 545959844 /nfs/dbraw/zinc/95/98/44/545959844.db2.gz RHPUXPSLFUKLJM-BBRMVZONSA-N 1 1 374.403 2.293 20 70 FEIDMO CN(C)CC[NH+]1CCC(NC(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)CC1 ZINC000159543326 545961624 /nfs/dbraw/zinc/96/16/24/545961624.db2.gz KGKXEDRQWOWMLX-UXHICEINSA-N 1 1 374.529 2.232 20 70 FEIDMO C[C@H](C(=O)NC(c1ccccc1)c1ccccc1)[N@H+](C)CC(C)(CO)CO ZINC000159557867 545962347 /nfs/dbraw/zinc/96/23/47/545962347.db2.gz RAOUTOYPKAHNTE-QGZVFWFLSA-N 1 1 370.493 2.203 20 70 FEIDMO C[C@H](C(=O)NC(c1ccccc1)c1ccccc1)[N@@H+](C)CC(C)(CO)CO ZINC000159557867 545962348 /nfs/dbraw/zinc/96/23/48/545962348.db2.gz RAOUTOYPKAHNTE-QGZVFWFLSA-N 1 1 370.493 2.203 20 70 FEIDMO C[C@H](C(=O)N1CCC(CC(=O)N2CC[NH+](C)CC2)CC1)c1ccsc1 ZINC000159589129 545965212 /nfs/dbraw/zinc/96/52/12/545965212.db2.gz YAXWZLVRSWAAEG-HNNXBMFYSA-N 1 1 363.527 2.254 20 70 FEIDMO CCCCn1c2nc(C[N@H+]3CC[C@@H]4CCCC[C@@H]43)n(CC)c2c(=O)[nH]c1=O ZINC000159610107 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CC(=O)N(C)C1CCN(C(=O)N[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000160006485 545999306 /nfs/dbraw/zinc/99/93/06/545999306.db2.gz VWDXMMIGIUMVQP-UZLBHIALSA-N 1 1 372.513 2.159 20 70 FEIDMO COC(=O)CC1CCN(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000160027656 546001933 /nfs/dbraw/zinc/00/19/33/546001933.db2.gz YKLYRQCVOSEPBA-APWZRJJASA-N 1 1 373.497 2.492 20 70 FEIDMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)NCCc1nnc(-c2ccccc2)o1 ZINC000160028313 546002228 /nfs/dbraw/zinc/00/22/28/546002228.db2.gz MVMHSQODXIVACV-HNNXBMFYSA-N 1 1 357.458 2.262 20 70 FEIDMO CC(C)OCC[NH+]1CCN([C@@H]2CCCN(c3ccccc3F)C2=O)CC1 ZINC000160130055 546010243 /nfs/dbraw/zinc/01/02/43/546010243.db2.gz SNIUAFDEJKRRCB-LJQANCHMSA-N 1 1 363.477 2.364 20 70 FEIDMO Cc1cccc([C@H]2CCC[N@H+]2CCOc2ccc(S(N)(=O)=O)cc2)n1 ZINC000160314512 546029370 /nfs/dbraw/zinc/02/93/70/546029370.db2.gz UQLHIURUMAVVPJ-GOSISDBHSA-N 1 1 361.467 2.253 20 70 FEIDMO CCC[C@@H]1CN(C(=O)N[C@@H](C)C[NH+]2CCCCC2)CCN1CCOC ZINC000160320638 546029748 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CC[NH+]1CCN(C[C@H](C)CNC(=O)Nc2ccn(CCC(C)C)n2)CC1 ZINC000160448453 546041911 /nfs/dbraw/zinc/04/19/11/546041911.db2.gz BNQOEFKYIXRFHF-QGZVFWFLSA-N 1 1 364.538 2.324 20 70 FEIDMO C[C@@H]1C[N@H+](C[C@@H]2CCCN2c2ncc(Br)cn2)C[C@H](C)O1 ZINC000160502815 546047121 /nfs/dbraw/zinc/04/71/21/546047121.db2.gz QSJUMBYOQLCSFA-SCRDCRAPSA-N 1 1 355.280 2.317 20 70 FEIDMO CCN1CC[NH+](CCC(=O)NCCc2csc(C(C)(C)C)n2)CC1 ZINC000160706185 546065095 /nfs/dbraw/zinc/06/50/95/546065095.db2.gz MZVYRTACABNEIF-UHFFFAOYSA-N 1 1 352.548 2.127 20 70 FEIDMO Cn1cc(CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c(C(F)(F)F)n1 ZINC000160808924 546074460 /nfs/dbraw/zinc/07/44/60/546074460.db2.gz BKRHVLAYYAAWIK-WCQYABFASA-N 1 1 359.396 2.065 20 70 FEIDMO C[C@@]1(CNc2ncc(S(N)(=O)=O)s2)CCC[N@H+]1Cc1ccccc1 ZINC000160807118 546074716 /nfs/dbraw/zinc/07/47/16/546074716.db2.gz RWMOURCSNLYYQW-INIZCTEOSA-N 1 1 366.512 2.257 20 70 FEIDMO CCN(C(=O)NCC(C)(C)C(=O)NC)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160854428 546077925 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CC[N@H+]1CCCN(C(=O)NC[C@H](c2c(F)cccc2F)N(C)C)CC1 ZINC000159867196 545987381 /nfs/dbraw/zinc/98/73/81/545987381.db2.gz MUGKJBPODOTZIR-MRXNPFEDSA-N 1 1 354.445 2.305 20 70 FEIDMO CN(CC1CCOCC1)C(=O)Nc1cccc(C[N@@H+]2CCC[C@@H]2C(N)=O)c1 ZINC000159910947 545991540 /nfs/dbraw/zinc/99/15/40/545991540.db2.gz VZGAOMLCYRLJSX-GOSISDBHSA-N 1 1 374.485 2.027 20 70 FEIDMO CN(CC1CCOCC1)C(=O)Nc1cccc(C[N@H+]2CCC[C@@H]2C(N)=O)c1 ZINC000159910947 545991543 /nfs/dbraw/zinc/99/15/43/545991543.db2.gz VZGAOMLCYRLJSX-GOSISDBHSA-N 1 1 374.485 2.027 20 70 FEIDMO Cc1cccc(NC[C@H]2CC[N@@H+]([C@@H]3CCCN(c4cnn(C)c4)C3=O)C2)n1 ZINC000160092426 546006850 /nfs/dbraw/zinc/00/68/50/546006850.db2.gz CEQAASSUKADWKN-SJLPKXTDSA-N 1 1 368.485 2.053 20 70 FEIDMO Cc1cccc(NC[C@H]2CC[N@H+]([C@@H]3CCCN(c4cnn(C)c4)C3=O)C2)n1 ZINC000160092426 546006854 /nfs/dbraw/zinc/00/68/54/546006854.db2.gz CEQAASSUKADWKN-SJLPKXTDSA-N 1 1 368.485 2.053 20 70 FEIDMO CC(C)[N@@H+](C)CCNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 ZINC000160137093 546011347 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70 FEIDMO CCc1cc(N2CCC[C@H]2C[NH+]2CCOCC2)nc(-c2ccccn2)n1 ZINC000160399888 546037692 /nfs/dbraw/zinc/03/76/92/546037692.db2.gz PPZYEPFDIFKXLM-KRWDZBQOSA-N 1 1 353.470 2.402 20 70 FEIDMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2cccc(S(=O)(=O)CC)c2)[C@H](C)C1 ZINC000160419228 546038741 /nfs/dbraw/zinc/03/87/41/546038741.db2.gz DYTQXLWRECEKTC-CRAIPNDOSA-N 1 1 366.527 2.211 20 70 FEIDMO O=C(N[C@@H]1CC[N@@H+](CC2CCCC2)C1)N1CCN(Cc2ccccn2)CC1 ZINC000160463968 546043116 /nfs/dbraw/zinc/04/31/16/546043116.db2.gz BTGKYBIZUBTSMU-HXUWFJFHSA-N 1 1 371.529 2.173 20 70 FEIDMO CCOC[C@H](O)C[N@H+]1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1 ZINC000160623587 546057405 /nfs/dbraw/zinc/05/74/05/546057405.db2.gz SWTWKGPNGRMJHM-RHSMWYFYSA-N 1 1 353.438 2.057 20 70 FEIDMO CC(=O)c1ccccc1C(=O)NC[C@H]1C[C@@H](O)C[N@@H+]1Cc1ccccc1 ZINC000160743225 546067566 /nfs/dbraw/zinc/06/75/66/546067566.db2.gz SUZCANBVRCJTOF-QZTJIDSGSA-N 1 1 352.434 2.254 20 70 FEIDMO CC(=O)c1ccccc1C(=O)NC[C@H]1C[C@@H](O)C[N@H+]1Cc1ccccc1 ZINC000160743225 546067570 /nfs/dbraw/zinc/06/75/70/546067570.db2.gz SUZCANBVRCJTOF-QZTJIDSGSA-N 1 1 352.434 2.254 20 70 FEIDMO CCC[N@H+]1CC[C@@H](CNC(=O)NCc2ccc(OC)c(NC(C)=O)c2)C1 ZINC000160752896 546068726 /nfs/dbraw/zinc/06/87/26/546068726.db2.gz FBIJKCKMMRZYTR-INIZCTEOSA-N 1 1 362.474 2.185 20 70 FEIDMO O=C(NC[C@H]1C[C@H](O)C[N@@H+]1Cc1ccccc1)c1cc(-c2ccco2)on1 ZINC000160762471 546070424 /nfs/dbraw/zinc/07/04/24/546070424.db2.gz XWJVVTPTASSLSH-CVEARBPZSA-N 1 1 367.405 2.300 20 70 FEIDMO Cc1cccc(OC[C@@H](O)CNC(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)c1 ZINC000160800988 546073068 /nfs/dbraw/zinc/07/30/68/546073068.db2.gz OEJBFYNAZXZZBS-WMZOPIPTSA-N 1 1 361.486 2.051 20 70 FEIDMO CC[N@H+]1CC[C@@H](N(C)C(=O)NCc2cn(C)nc2C(F)(F)F)[C@H](C)C1 ZINC000160792092 546073717 /nfs/dbraw/zinc/07/37/17/546073717.db2.gz RYPPSACTALSSKT-DGCLKSJQSA-N 1 1 361.412 2.311 20 70 FEIDMO O=C(C[N@H+]1CC[C@@]2(O)CCCC[C@@H]2C1)NCCc1c(F)cccc1F ZINC000160918360 546084081 /nfs/dbraw/zinc/08/40/81/546084081.db2.gz SHEUDICLEPJPSD-KUHUBIRLSA-N 1 1 352.425 2.251 20 70 FEIDMO O=C(NCC[N@H+]1CCc2ccccc2C1)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 ZINC000161446702 546130377 /nfs/dbraw/zinc/13/03/77/546130377.db2.gz CUBMHBXJMNWLQG-OTWHNJEPSA-N 1 1 355.482 2.302 20 70 FEIDMO COc1ccc(Br)c(CC(=O)N2CC[NH+](C3CC3)CC2)c1 ZINC000159466752 326932562 /nfs/dbraw/zinc/93/25/62/326932562.db2.gz JUQWSFBUFYFEST-UHFFFAOYSA-N 1 1 353.260 2.307 20 70 FEIDMO Cc1[nH+]ccn1-c1ccc([C@H](C)NC(=O)NCC2(CO)CCOCC2)cc1 ZINC000159537817 326934603 /nfs/dbraw/zinc/93/46/03/326934603.db2.gz GMKNXCSIFDVIKK-HNNXBMFYSA-N 1 1 372.469 2.330 20 70 FEIDMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)Nc1ccnn1C[C@@H]1CCOC1 ZINC000159682961 326939041 /nfs/dbraw/zinc/93/90/41/326939041.db2.gz MFLNBEITCVAWBE-JKSUJKDBSA-N 1 1 358.446 2.121 20 70 FEIDMO COc1cc(OC)cc(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)c1 ZINC000160218659 326957601 /nfs/dbraw/zinc/95/76/01/326957601.db2.gz RIHATDGELYDOLQ-UHFFFAOYSA-N 1 1 350.459 2.134 20 70 FEIDMO COc1ccccc1[C@H](CNC(=O)[C@@H](C)Oc1cccc(CO)c1)[NH+](C)C ZINC000160996797 326984674 /nfs/dbraw/zinc/98/46/74/326984674.db2.gz LTOLODZJJPECTM-BEFAXECRSA-N 1 1 372.465 2.374 20 70 FEIDMO CCN1CC[NH+](CCCNC(=O)Cc2cccc(OC(F)(F)F)c2)CC1 ZINC000161498191 327001181 /nfs/dbraw/zinc/00/11/81/327001181.db2.gz ZJQVEAFRNRXGGK-UHFFFAOYSA-N 1 1 373.419 2.272 20 70 FEIDMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)C(=O)Nc2ccc(OC(F)F)cc2)C1 ZINC000159414007 545950776 /nfs/dbraw/zinc/95/07/76/545950776.db2.gz WHYOYDYGSFAJEB-ZDUSSCGKSA-N 1 1 369.412 2.321 20 70 FEIDMO NC(=O)[C@H]1CCC[N@H+]1C1CCN(Cc2csc(-c3ccco3)n2)CC1 ZINC000159418113 545951757 /nfs/dbraw/zinc/95/17/57/545951757.db2.gz KHDZYLVYIBOFSV-OAHLLOKOSA-N 1 1 360.483 2.317 20 70 FEIDMO O=C(N[C@@H]1CCOC2(CCCC2)C1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000159580444 545964532 /nfs/dbraw/zinc/96/45/32/545964532.db2.gz YKYCEUWIHTXJMC-MOPGFXCFSA-N 1 1 358.482 2.495 20 70 FEIDMO O=C(N[C@@H]1CCOC2(CCCC2)C1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000159580444 545964535 /nfs/dbraw/zinc/96/45/35/545964535.db2.gz YKYCEUWIHTXJMC-MOPGFXCFSA-N 1 1 358.482 2.495 20 70 FEIDMO CCOC(=O)C1CCN(C(=O)C[N@@H+](CCc2nccs2)C(C)C)CC1 ZINC000159821402 545982422 /nfs/dbraw/zinc/98/24/22/545982422.db2.gz CSYKUNGCUKCUGV-UHFFFAOYSA-N 1 1 367.515 2.198 20 70 FEIDMO CCOc1cc(Cl)ccc1CNC(=O)N[C@@H](C)C[NH+]1CCN(C)CC1 ZINC000159858259 545986030 /nfs/dbraw/zinc/98/60/30/545986030.db2.gz XXPGZRNCZNZJPZ-AWEZNQCLSA-N 1 1 368.909 2.174 20 70 FEIDMO C[N@H+](CC(=O)NCc1ccc(OC(F)(F)F)cc1)C[C@@H]1CCC[C@@H]1O ZINC000159857513 545986212 /nfs/dbraw/zinc/98/62/12/545986212.db2.gz SHPAPJPNBSXGPR-ZFWWWQNUSA-N 1 1 360.376 2.294 20 70 FEIDMO NC(=O)C[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccnn1CC1CCCCC1 ZINC000159858796 545986882 /nfs/dbraw/zinc/98/68/82/545986882.db2.gz QDNZFQKJUZQELG-INIZCTEOSA-N 1 1 361.490 2.132 20 70 FEIDMO NC(=O)C[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccnn1CC1CCCCC1 ZINC000159858796 545986885 /nfs/dbraw/zinc/98/68/85/545986885.db2.gz QDNZFQKJUZQELG-INIZCTEOSA-N 1 1 361.490 2.132 20 70 FEIDMO CC[N@H+]1CCCN(C(=O)NCc2ccc(C)cc2O[C@@H]2CCOC2)CC1 ZINC000159980175 545997549 /nfs/dbraw/zinc/99/75/49/545997549.db2.gz WGEDXXUFTHDZND-GOSISDBHSA-N 1 1 361.486 2.400 20 70 FEIDMO CCOC(=O)C[C@H](C)NC(=O)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000160020953 546000584 /nfs/dbraw/zinc/00/05/84/546000584.db2.gz CYWBHMSHKZKDHL-GOEBONIOSA-N 1 1 350.434 2.496 20 70 FEIDMO CCN1CC[NH+](CCCNC(=O)c2cc(Cl)c(N)c(Cl)c2)CC1 ZINC000160031118 546002402 /nfs/dbraw/zinc/00/24/02/546002402.db2.gz PTRSGULMRIHAIJ-UHFFFAOYSA-N 1 1 359.301 2.333 20 70 FEIDMO C[C@H]1C[C@@H](NC(=O)N2CCN(CC(F)F)CC2)C[N@H+]1Cc1ccccc1 ZINC000160073636 546005353 /nfs/dbraw/zinc/00/53/53/546005353.db2.gz AHRMSXCAKHCLRJ-DOTOQJQBSA-N 1 1 366.456 2.242 20 70 FEIDMO CC[N@@H+](C)CCNS(=O)(=O)c1c(Cl)cc(F)cc1Br ZINC000160248023 546021560 /nfs/dbraw/zinc/02/15/60/546021560.db2.gz JAYRAIKGXAUOBN-UHFFFAOYSA-N 1 1 373.675 2.472 20 70 FEIDMO CCC[C@H]1CN(C(=O)NCc2ccccc2COC)CC[N@H+]1CCOC ZINC000160271284 546025433 /nfs/dbraw/zinc/02/54/33/546025433.db2.gz UZBKCGQWBYVICE-IBGZPJMESA-N 1 1 363.502 2.475 20 70 FEIDMO CCc1noc(C)c1NC(=O)C(=O)N[C@H]1CCC[N@H+](C2CCCCC2)C1 ZINC000160559252 546050844 /nfs/dbraw/zinc/05/08/44/546050844.db2.gz LJEPDVTXHWBADZ-AWEZNQCLSA-N 1 1 362.474 2.397 20 70 FEIDMO C[C@@H](C(=O)NCCCOc1ccc2ccccc2c1)N1CC[NH+](C)CC1 ZINC000160718316 546065556 /nfs/dbraw/zinc/06/55/56/546065556.db2.gz FWODHENCYXKTHS-KRWDZBQOSA-N 1 1 355.482 2.361 20 70 FEIDMO C[C@]1(CNc2ncc(S(N)(=O)=O)s2)CCC[N@H+]1Cc1ccccc1 ZINC000160806966 546074243 /nfs/dbraw/zinc/07/42/43/546074243.db2.gz RWMOURCSNLYYQW-MRXNPFEDSA-N 1 1 366.512 2.257 20 70 FEIDMO COc1cccc(Cl)c1CC(=O)NC[C@H]1C[N@@H+]2CCCC[C@@H]2CO1 ZINC000160820102 546075447 /nfs/dbraw/zinc/07/54/47/546075447.db2.gz WUWSPWGGGFRYLF-KGLIPLIRSA-N 1 1 352.862 2.261 20 70 FEIDMO COc1cccc(Cl)c1CC(=O)NC[C@H]1C[N@H+]2CCCC[C@@H]2CO1 ZINC000160820102 546075449 /nfs/dbraw/zinc/07/54/49/546075449.db2.gz WUWSPWGGGFRYLF-KGLIPLIRSA-N 1 1 352.862 2.261 20 70 FEIDMO Cc1nc(C[C@@H]2CCCN(C(=O)N[C@H]3CC[N@H+](C4CCCC4)C3)C2)no1 ZINC000160897627 546082704 /nfs/dbraw/zinc/08/27/04/546082704.db2.gz ZXSCVVIHUKTWLK-HOTGVXAUSA-N 1 1 361.490 2.359 20 70 FEIDMO Cc1cccc(NC(=O)C2CC[NH+](CCCS(=O)(=O)C(C)C)CC2)n1 ZINC000160907201 546083203 /nfs/dbraw/zinc/08/32/03/546083203.db2.gz STOSJSCJNYSJSD-UHFFFAOYSA-N 1 1 367.515 2.254 20 70 FEIDMO Cc1nc2cc(=O)[nH]n2c(C)c1CCC(=O)N[C@H](C)C[N@H+]1CCC[C@H](C)C1 ZINC000160969945 546088795 /nfs/dbraw/zinc/08/87/95/546088795.db2.gz SRCRFXVTINNYQZ-UONOGXRCSA-N 1 1 373.501 2.221 20 70 FEIDMO CO[C@@H](C)c1noc(CN2CCC[N@H+](Cc3cnc4ccccn34)CC2)n1 ZINC000160980313 546090197 /nfs/dbraw/zinc/09/01/97/546090197.db2.gz LKPBLZHTBPIFCR-HNNXBMFYSA-N 1 1 370.457 2.133 20 70 FEIDMO CO[C@@H](C)c1noc(CN2CCC[N@@H+](Cc3cnc4ccccn34)CC2)n1 ZINC000160980313 546090203 /nfs/dbraw/zinc/09/02/03/546090203.db2.gz LKPBLZHTBPIFCR-HNNXBMFYSA-N 1 1 370.457 2.133 20 70 FEIDMO CC(=O)N(C)C1CCN(C(=O)NC[C@H]2CCCC[N@@H+]2CC(C)C)CC1 ZINC000161012865 546092890 /nfs/dbraw/zinc/09/28/90/546092890.db2.gz XGGNOAOVQMRVTN-GOSISDBHSA-N 1 1 352.523 2.149 20 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C[C@@H](CNC(=O)NCCCc1c[nH]c2ccccc12)C[NH+]1CCOCC1 ZINC000159391435 545950260 /nfs/dbraw/zinc/95/02/60/545950260.db2.gz UGMYRGLYIXNHBY-INIZCTEOSA-N 1 1 358.486 2.368 20 70 FEIDMO NC(=O)[C@@H]1CCC[N@H+]1C1CCN(CCSc2ccccc2F)CC1 ZINC000159406545 545950641 /nfs/dbraw/zinc/95/06/41/545950641.db2.gz JLDQWVAHBXLKMX-INIZCTEOSA-N 1 1 351.491 2.332 20 70 FEIDMO NC(=O)[C@@H]1CCCN1C1CC[NH+](CCSc2ccccc2F)CC1 ZINC000159406545 545950646 /nfs/dbraw/zinc/95/06/46/545950646.db2.gz JLDQWVAHBXLKMX-INIZCTEOSA-N 1 1 351.491 2.332 20 70 FEIDMO CCOc1ccc(NC(=O)C(=O)NC[C@@H]2CC[N@@H+](CC(C)C)C2)cc1F ZINC000159458231 545955349 /nfs/dbraw/zinc/95/53/49/545955349.db2.gz ZKJYYJCJVXCSHB-AWEZNQCLSA-N 1 1 365.449 2.257 20 70 FEIDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)[C@@H]1CCc2[nH]nc(C(F)(F)F)c2C1 ZINC000159636240 545969512 /nfs/dbraw/zinc/96/95/12/545969512.db2.gz CQLCMGCCDDPADM-BXUZGUMPSA-N 1 1 358.408 2.332 20 70 FEIDMO Cc1ccc(F)c(OCC(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)c1 ZINC000159904342 545990526 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20 70 FEIDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)N[C@H]1CCc2n[nH]cc2C1 ZINC000160005612 546000023 /nfs/dbraw/zinc/00/00/23/546000023.db2.gz FNLPBYYSQNOMMW-KRWDZBQOSA-N 1 1 355.486 2.477 20 70 FEIDMO COc1ccc([C@@H]2CC[N@@H+](CCN3C(=O)NC4(CCCC4)C3=O)C2)cc1 ZINC000160034255 546001903 /nfs/dbraw/zinc/00/19/03/546001903.db2.gz IJSFEDGOZZIANM-MRXNPFEDSA-N 1 1 357.454 2.349 20 70 FEIDMO CC[C@@H](CNC(=O)C(=O)Nc1ccc(C)nc1)[N@H+]1CCc2ccccc2C1 ZINC000160039393 546001972 /nfs/dbraw/zinc/00/19/72/546001972.db2.gz GVNCVHHOXQRQDF-IBGZPJMESA-N 1 1 366.465 2.282 20 70 FEIDMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)C(=O)Nc1cccnc1-c1ccccc1 ZINC000160094717 546006620 /nfs/dbraw/zinc/00/66/20/546006620.db2.gz JTLLGYAKCUYGQD-OAHLLOKOSA-N 1 1 364.449 2.288 20 70 FEIDMO C[C@H]1CCC[N@@H+](Cc2ccc(NC(=O)C(=O)NCCn3cccc3)cc2)C1 ZINC000160190646 546015999 /nfs/dbraw/zinc/01/59/99/546015999.db2.gz STBGTSHTEWAITF-KRWDZBQOSA-N 1 1 368.481 2.475 20 70 FEIDMO Cc1cc(Cl)ncc1NC(=O)C(=O)NC[C@H]1CCC[N@H+](C(C)C)C1 ZINC000160409762 546038345 /nfs/dbraw/zinc/03/83/45/546038345.db2.gz UMJPHDGMNKAKLN-CYBMUJFWSA-N 1 1 352.866 2.219 20 70 FEIDMO NC(=O)C[C@H]1CCC[N@H+]([C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C1 ZINC000160465510 546042817 /nfs/dbraw/zinc/04/28/17/546042817.db2.gz HYVSHNAUZCKKMK-IAQYHMDHSA-N 1 1 353.825 2.172 20 70 FEIDMO COCC[N@@H+](C)CCNC(=O)c1nn(-c2ccccc2Cl)cc1C ZINC000160471602 546044435 /nfs/dbraw/zinc/04/44/35/546044435.db2.gz USOAFTDBWTWTNG-UHFFFAOYSA-N 1 1 350.850 2.142 20 70 FEIDMO CCc1noc(C)c1NC(=O)C(=O)N[C@@H]1CCC[N@H+](C2CCCCC2)C1 ZINC000160559124 546050868 /nfs/dbraw/zinc/05/08/68/546050868.db2.gz LJEPDVTXHWBADZ-CQSZACIVSA-N 1 1 362.474 2.397 20 70 FEIDMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)C(=O)Nc1c(C)onc1CC ZINC000160667631 546061072 /nfs/dbraw/zinc/06/10/72/546061072.db2.gz QEIGMKAKYYYILI-AWEZNQCLSA-N 1 1 350.463 2.255 20 70 FEIDMO CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)CS(=O)(=O)C(C)(C)C ZINC000160753828 546068904 /nfs/dbraw/zinc/06/89/04/546068904.db2.gz RYVPOMFRXANXPB-UHFFFAOYSA-N 1 1 354.516 2.356 20 70 FEIDMO COc1cccc2c(N3CCC([N@H+]4CCC[C@H]4C(N)=O)CC3)cc(C)nc12 ZINC000160804750 546074133 /nfs/dbraw/zinc/07/41/33/546074133.db2.gz FWONIIVXETWFEI-KRWDZBQOSA-N 1 1 368.481 2.470 20 70 FEIDMO COCC[NH+]1CCN(C(=O)N[C@H](c2ccco2)c2ccccc2OC)CC1 ZINC000160819408 546075367 /nfs/dbraw/zinc/07/53/67/546075367.db2.gz VSIJCWSIWDUAPO-IBGZPJMESA-N 1 1 373.453 2.351 20 70 FEIDMO CCO[C@@H]1C[C@H](N(C)C(=O)NCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)C12CCC2 ZINC000160883835 546080886 /nfs/dbraw/zinc/08/08/86/546080886.db2.gz GMYFQVKXCHAYLM-XWTMOSNGSA-N 1 1 367.534 2.475 20 70 FEIDMO C[C@H](Oc1cccc(CO)c1)C(=O)N1CC[NH+](CCc2ccccc2)CC1 ZINC000161193972 546108365 /nfs/dbraw/zinc/10/83/65/546108365.db2.gz YVWQTSQVXILTPU-SFHVURJKSA-N 1 1 368.477 2.333 20 70 FEIDMO CC(C)CCn1ccc(NC(=O)NC2CC[NH+](CCN(C)C)CC2)n1 ZINC000161228405 546111896 /nfs/dbraw/zinc/11/18/96/546111896.db2.gz RRABEQOFBGZUGB-UHFFFAOYSA-N 1 1 350.511 2.077 20 70 FEIDMO C[N@H+]1CCC[C@@H]2CN([C@H](C(N)=O)c3cccc(Br)c3)CC[C@@H]21 ZINC000161392786 546126349 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/nfs/dbraw/zinc/95/08/87/545950887.db2.gz LQGCLVFEQOZZHT-GFCCVEGCSA-N 1 1 369.412 2.006 20 70 FEIDMO CCN(C(=O)[C@H](C)[NH2+][C@@H](C)c1cccc(F)c1F)[C@@H]1CCS(=O)(=O)C1 ZINC000159466409 545956350 /nfs/dbraw/zinc/95/63/50/545956350.db2.gz IWBBTZKZHTXCGQ-RWMBFGLXSA-N 1 1 374.453 2.040 20 70 FEIDMO CC[N@H+]1CCCN(C(=O)N[C@@H](c2nccn2C)c2cccc(F)c2)CC1 ZINC000159565748 545963343 /nfs/dbraw/zinc/96/33/43/545963343.db2.gz QFWPDZPBYXXDRV-QGZVFWFLSA-N 1 1 359.449 2.386 20 70 FEIDMO C[N@H+](CC(=O)NCc1cccc(OCC(F)(F)F)c1)C[C@@H]1CCC[C@@H]1O ZINC000159580063 545963936 /nfs/dbraw/zinc/96/39/36/545963936.db2.gz OYEXTBUFFMHGBQ-HOCLYGCPSA-N 1 1 374.403 2.337 20 70 FEIDMO CN(CC(C)(C)CN1CCOCC1)C(=O)[C@@H]1CCC[N@H+]1Cc1ccccc1 ZINC000159602917 545966334 /nfs/dbraw/zinc/96/63/34/545966334.db2.gz WIOBYCTZYMBSRD-FQEVSTJZSA-N 1 1 373.541 2.468 20 70 FEIDMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)NC[C@@H](C)CN2CCOCC2)C1 ZINC000159609043 545967527 /nfs/dbraw/zinc/96/75/27/545967527.db2.gz UWMBBDSFSNMAPW-MSOLQXFVSA-N 1 1 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ZINC000159864200 545987470 /nfs/dbraw/zinc/98/74/70/545987470.db2.gz SCKSCPDJEHUBHJ-DOMZBBRYSA-N 1 1 359.499 2.075 20 70 FEIDMO C[C@H](CNC(=O)N[C@H]1CCc2n[nH]cc2C1)[N@H+]1CCc2sccc2C1 ZINC000159864200 545987475 /nfs/dbraw/zinc/98/74/75/545987475.db2.gz SCKSCPDJEHUBHJ-DOMZBBRYSA-N 1 1 359.499 2.075 20 70 FEIDMO CC[N@H+]1CCCN(C(=O)NCCc2nc(C(F)(F)F)cs2)CC1 ZINC000159930782 545993037 /nfs/dbraw/zinc/99/30/37/545993037.db2.gz MYWQFMPGQNVTPR-UHFFFAOYSA-N 1 1 350.410 2.442 20 70 FEIDMO CCN1CCO[C@@H](C(=O)N2CCC[C@H](c3nc4ccc(C)cc4[nH]3)C2)C1 ZINC000160001150 545998284 /nfs/dbraw/zinc/99/82/84/545998284.db2.gz RFKPDJPAUKFSJV-MAUKXSAKSA-N 1 1 356.470 2.298 20 70 FEIDMO CC[N@@H+]1CCO[C@@H](C(=O)N2CCC[C@H](c3nc4cc(C)ccc4[nH]3)C2)C1 ZINC000160001150 545998292 /nfs/dbraw/zinc/99/82/92/545998292.db2.gz RFKPDJPAUKFSJV-MAUKXSAKSA-N 1 1 356.470 2.298 20 70 FEIDMO CC[N@H+]1CCO[C@@H](C(=O)N2CCC[C@H](c3nc4cc(C)ccc4[nH]3)C2)C1 ZINC000160001150 545998297 /nfs/dbraw/zinc/99/82/97/545998297.db2.gz RFKPDJPAUKFSJV-MAUKXSAKSA-N 1 1 356.470 2.298 20 70 FEIDMO CC[N@@H+]1CCO[C@@H](C(=O)N2CCC[C@H](c3nc4ccc(C)cc4[nH]3)C2)C1 ZINC000160001150 545998303 /nfs/dbraw/zinc/99/83/03/545998303.db2.gz RFKPDJPAUKFSJV-MAUKXSAKSA-N 1 1 356.470 2.298 20 70 FEIDMO CC[N@H+]1CCO[C@@H](C(=O)N2CCC[C@H](c3nc4ccc(C)cc4[nH]3)C2)C1 ZINC000160001150 545998307 /nfs/dbraw/zinc/99/83/07/545998307.db2.gz RFKPDJPAUKFSJV-MAUKXSAKSA-N 1 1 356.470 2.298 20 70 FEIDMO C[C@H]1C[NH+](Cc2ccccc2NC(=O)c2cccc(=O)n2C)C[C@H](C)O1 ZINC000160076249 546005981 /nfs/dbraw/zinc/00/59/81/546005981.db2.gz OHKDBICHLQZMBX-GJZGRUSLSA-N 1 1 355.438 2.247 20 70 FEIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccn(-c2ccc(F)cc2)n1 ZINC000160133636 546010124 /nfs/dbraw/zinc/01/01/24/546010124.db2.gz DERNHJHQYZIDOR-UHFFFAOYSA-N 1 1 374.460 2.442 20 70 FEIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)CSCc1ccncc1 ZINC000160134362 546010607 /nfs/dbraw/zinc/01/06/07/546010607.db2.gz CQQXJWMJKJVYEX-UHFFFAOYSA-N 1 1 351.516 2.132 20 70 FEIDMO CSC[C@H](CCO)NC(=O)NC[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC000160289745 546026769 /nfs/dbraw/zinc/02/67/69/546026769.db2.gz ISTBXKNFJHSIBK-NXHRZFHOSA-N 1 1 365.543 2.310 20 70 FEIDMO C[C@@H](CNC(=O)NCC(C)(C)c1cccc(F)c1)C[NH+]1CCOCC1 ZINC000160330884 546030491 /nfs/dbraw/zinc/03/04/91/546030491.db2.gz GENARCWFXQIAHZ-HNNXBMFYSA-N 1 1 351.466 2.371 20 70 FEIDMO Cc1c2cc(C)ccc2[nH]c1C(=O)NCCC[N@@H+]1CCC[C@H]1C(=O)N(C)C ZINC000160373162 546035112 /nfs/dbraw/zinc/03/51/12/546035112.db2.gz WMXHGPWFESODGG-SFHVURJKSA-N 1 1 370.497 2.457 20 70 FEIDMO COC[C@@H](NCC(=O)NC[C@H](c1ccccc1)[NH+](C)C)c1ccccc1 ZINC000160395644 546035917 /nfs/dbraw/zinc/03/59/17/546035917.db2.gz LBQCGXHXYQARSS-WOJBJXKFSA-N 1 1 355.482 2.383 20 70 FEIDMO C[N@@H+](CCN1CCCC1=O)C1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C ZINC000160409145 546038381 /nfs/dbraw/zinc/03/83/81/546038381.db2.gz GEZLBUDQUMXGFP-XYPWUTKMSA-N 1 1 351.491 2.471 20 70 FEIDMO CC(C)c1nc(N(C)C)nc(N2CCC[C@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)n1 ZINC000160477452 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MDYDSOLHJWTLFD-IRXDYDNUSA-N 1 1 370.497 2.387 20 70 FEIDMO CCCC(=O)NC[C@@H]1CCCN(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)C1 ZINC000160897919 546082423 /nfs/dbraw/zinc/08/24/23/546082423.db2.gz OGSIKCUOWGIVTI-DLBZAZTESA-N 1 1 364.534 2.341 20 70 FEIDMO Cc1conc1NC(=O)C(=O)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000160902390 546082895 /nfs/dbraw/zinc/08/28/95/546082895.db2.gz GSYBQMZVKINHKF-CYBMUJFWSA-N 1 1 362.455 2.011 20 70 FEIDMO O=C(c1cccc(-n2ccnn2)c1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000160912957 546084063 /nfs/dbraw/zinc/08/40/63/546084063.db2.gz YRIFLKZZYVAPGF-VQIMIIECSA-N 1 1 351.454 2.356 20 70 FEIDMO CCC[C@@H]1CN(C(=O)Nc2ccc(C)c(C(N)=O)c2)CC[N@H+]1CCOC ZINC000161024783 546093408 /nfs/dbraw/zinc/09/34/08/546093408.db2.gz SRZYWYAPVOCXRP-MRXNPFEDSA-N 1 1 362.474 2.059 20 70 FEIDMO C[N@@H+](CCCO)C1CCN(C[C@@H](O)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000161030462 546093853 /nfs/dbraw/zinc/09/38/53/546093853.db2.gz ZVCOHTPPRTXBOL-SFHVURJKSA-N 1 1 374.447 2.387 20 70 FEIDMO CC[N@H+](Cc1ccccn1)[C@H](C)C(=O)NCCc1ccc2c(c1)OCCO2 ZINC000161190331 546107882 /nfs/dbraw/zinc/10/78/82/546107882.db2.gz JDTWTCIOHLLLQW-MRXNPFEDSA-N 1 1 369.465 2.422 20 70 FEIDMO CC[N@@H+](Cc1ccccn1)[C@H](C)C(=O)NCCc1ccc2c(c1)OCCO2 ZINC000161190331 546107886 /nfs/dbraw/zinc/10/78/86/546107886.db2.gz JDTWTCIOHLLLQW-MRXNPFEDSA-N 1 1 369.465 2.422 20 70 FEIDMO C[C@@H]1C[N@H+](CCCNC(=O)Nc2ccc(-c3ncn(C)n3)cc2)C[C@H](C)O1 ZINC000161238428 546112898 /nfs/dbraw/zinc/11/28/98/546112898.db2.gz KEAOKTWSDQATPV-GASCZTMLSA-N 1 1 372.473 2.103 20 70 FEIDMO Cc1ccc2cc(C(=O)N3CCC([N@H+]4CCC[C@@H]4C(N)=O)CC3)ccc2n1 ZINC000161400697 546127043 /nfs/dbraw/zinc/12/70/43/546127043.db2.gz PGSUCQNUPDJLRX-LJQANCHMSA-N 1 1 366.465 2.098 20 70 FEIDMO CCc1nn(C)c(Cl)c1C(=O)NCc1ccc(-n2cc[nH+]c2C)nc1 ZINC000161430611 546129850 /nfs/dbraw/zinc/12/98/50/546129850.db2.gz OFUZENNFVOIBKG-UHFFFAOYSA-N 1 1 358.833 2.455 20 70 FEIDMO CC[NH+]1CCN(C(=O)Cc2ccc(N[C@@H](C)CCn3cccn3)cc2)CC1 ZINC000159477627 326932894 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Cc1cc(NC(=O)C(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)ccc1N(C)C ZINC000159475993 545956014 /nfs/dbraw/zinc/95/60/14/545956014.db2.gz QUKBZHRNJUJCOH-MRXNPFEDSA-N 1 1 360.502 2.094 20 70 FEIDMO CCN(C(=O)[C@@H](C)[NH2+][C@@H](C)c1cccc(F)c1F)[C@@H]1CCS(=O)(=O)C1 ZINC000159466148 545956118 /nfs/dbraw/zinc/95/61/18/545956118.db2.gz IWBBTZKZHTXCGQ-YNEHKIRRSA-N 1 1 374.453 2.040 20 70 FEIDMO Cc1cc(C)cc(CCC(=O)N2CCN(C(=O)[C@@H]3CCC[N@@H+]3C)CC2)c1 ZINC000159494906 545958761 /nfs/dbraw/zinc/95/87/61/545958761.db2.gz DCXCXESBUHGAEJ-IBGZPJMESA-N 1 1 357.498 2.001 20 70 FEIDMO Cc1ccc(-c2noc(CCC[N@H+](C)CC(C)(CO)CO)n2)cc1F ZINC000159517991 545960472 /nfs/dbraw/zinc/96/04/72/545960472.db2.gz NNHGHYJSZGJNFT-UHFFFAOYSA-N 1 1 351.422 2.039 20 70 FEIDMO CNC(=O)[C@H]1CCC[N@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000159612211 545967025 /nfs/dbraw/zinc/96/70/25/545967025.db2.gz KGTPBIONVBNZGY-JTQLQIEISA-N 1 1 351.248 2.283 20 70 FEIDMO CNC(=O)[C@H]1CCC[N@@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000159612211 545967029 /nfs/dbraw/zinc/96/70/29/545967029.db2.gz KGTPBIONVBNZGY-JTQLQIEISA-N 1 1 351.248 2.283 20 70 FEIDMO C[N@@H+]1Cc2ccc(NC(=O)C(=O)N3CCO[C@H](c4ccsc4)C3)cc2C1 ZINC000159619248 545967044 /nfs/dbraw/zinc/96/70/44/545967044.db2.gz UJPIFTNIKLDWIV-KRWDZBQOSA-N 1 1 371.462 2.232 20 70 FEIDMO C[N@H+]1Cc2ccc(NC(=O)C(=O)N3CCO[C@H](c4ccsc4)C3)cc2C1 ZINC000159619248 545967048 /nfs/dbraw/zinc/96/70/48/545967048.db2.gz UJPIFTNIKLDWIV-KRWDZBQOSA-N 1 1 371.462 2.232 20 70 FEIDMO COCCCOc1cccc(CNC(=O)NC[C@H]2CC[N@H+](C3CC3)C2)c1 ZINC000159626748 545968400 /nfs/dbraw/zinc/96/84/00/545968400.db2.gz AJSJEJLFXJPEME-QGZVFWFLSA-N 1 1 361.486 2.385 20 70 FEIDMO C[N@H+](CC(=O)Nc1ccccc1C(=O)NC1CCCC1)C[C@H]1CCC[C@@H]1O ZINC000159731538 545976820 /nfs/dbraw/zinc/97/68/20/545976820.db2.gz SHFQEMDTFUBOST-BEFAXECRSA-N 1 1 373.497 2.390 20 70 FEIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc(Cn2cccn2)cc1 ZINC000159794643 545980928 /nfs/dbraw/zinc/98/09/28/545980928.db2.gz ATSZYENLQJHLHW-UHFFFAOYSA-N 1 1 370.497 2.362 20 70 FEIDMO Cc1[nH+]ccn1-c1ccc(CNC(=O)NCCc2ccncc2C)cn1 ZINC000159802120 545981862 /nfs/dbraw/zinc/98/18/62/545981862.db2.gz OMLFIDRUXVSCHW-UHFFFAOYSA-N 1 1 350.426 2.321 20 70 FEIDMO CC(C)(C)C(=O)N1CCC(C[N@H+]2CCC[C@H]2CN2CCOCC2)CC1 ZINC000159833908 545984439 /nfs/dbraw/zinc/98/44/39/545984439.db2.gz LOMDJKDOZKKTPZ-SFHVURJKSA-N 1 1 351.535 2.068 20 70 FEIDMO Cc1c[nH]c(=O)n1-c1ccc([C@H](C)[NH2+][C@@H](C(N)=O)c2ccccc2)cc1 ZINC000159878116 545988355 /nfs/dbraw/zinc/98/83/55/545988355.db2.gz JGSHVPRPKDIWOH-KBXCAEBGSA-N 1 1 350.422 2.351 20 70 FEIDMO Cc1ccc(-c2nc(SCC(=O)N(C)[C@@H]3CCC[N@@H+](C)C3)n[nH]2)cc1 ZINC000159920459 545991228 /nfs/dbraw/zinc/99/12/28/545991228.db2.gz XYPQXQCGUXVXRN-OAHLLOKOSA-N 1 1 359.499 2.425 20 70 FEIDMO Cc1ccc(-c2n[nH]c(SCC(=O)N(C)[C@@H]3CCC[N@H+](C)C3)n2)cc1 ZINC000159920459 545991231 /nfs/dbraw/zinc/99/12/31/545991231.db2.gz XYPQXQCGUXVXRN-OAHLLOKOSA-N 1 1 359.499 2.425 20 70 FEIDMO CCC(=O)N1CCCN(C(=O)N[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000159980880 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2.288 20 70 FEIDMO C[NH+](C)[C@H](CNC(=O)CN[C@@H](CCO)c1ccccc1)c1ccccc1 ZINC000160293232 546027633 /nfs/dbraw/zinc/02/76/33/546027633.db2.gz ZBTNHHZKHAQLKD-VQTJNVASSA-N 1 1 355.482 2.119 20 70 FEIDMO CC[C@@H](NC(=O)NCC1(C)COC1)[C@@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000160423947 546040244 /nfs/dbraw/zinc/04/02/44/546040244.db2.gz LELLOXJNKCLHRT-MSOLQXFVSA-N 1 1 361.486 2.002 20 70 FEIDMO CC[C@@H](NC(=O)NCC1(C)COC1)[C@@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000160423947 546040249 /nfs/dbraw/zinc/04/02/49/546040249.db2.gz LELLOXJNKCLHRT-MSOLQXFVSA-N 1 1 361.486 2.002 20 70 FEIDMO CCN1CC[NH+](CCCNC(=O)[C@H]2C[C@@H]2c2cccc(F)c2F)CC1 ZINC000160439787 546041478 /nfs/dbraw/zinc/04/14/78/546041478.db2.gz JOPRHVPGUDPQRI-CVEARBPZSA-N 1 1 351.441 2.212 20 70 FEIDMO C[C@H]1C[C@@H](CNC(=O)Nc2cccn(C)c2=O)C[N@H+]1Cc1ccccc1 ZINC000160480408 546045728 /nfs/dbraw/zinc/04/57/28/546045728.db2.gz OJTCRYPGKOUIFU-RDJZCZTQSA-N 1 1 354.454 2.417 20 70 FEIDMO COc1cccc(COCCNC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c1 ZINC000160609554 546057196 /nfs/dbraw/zinc/05/71/96/546057196.db2.gz RCRDYHFQSRYHAX-MJGOQNOKSA-N 1 1 361.486 2.338 20 70 FEIDMO CCS(=O)(=O)c1ccc(CCC(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000160669114 546061381 /nfs/dbraw/zinc/06/13/81/546061381.db2.gz AWTKKZLRGNBXSO-INIZCTEOSA-N 1 1 364.511 2.013 20 70 FEIDMO C[C@]1(CNc2ncccc2S(N)(=O)=O)CCC[N@H+]1Cc1ccccc1 ZINC000160804972 546074345 /nfs/dbraw/zinc/07/43/45/546074345.db2.gz HNVSDEDKOVGLFQ-GOSISDBHSA-N 1 1 360.483 2.196 20 70 FEIDMO CCOCCN1CCN(C(=O)N[C@@H]2CC[N@@H+](C3CCCC3)C2)C[C@H]1CC ZINC000160808202 546074604 /nfs/dbraw/zinc/07/46/04/546074604.db2.gz BPNFPZMEHCUIFI-QZTJIDSGSA-N 1 1 366.550 2.146 20 70 FEIDMO CCOCCN1CCN(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)C[C@H]1CC ZINC000160808202 546074613 /nfs/dbraw/zinc/07/46/13/546074613.db2.gz BPNFPZMEHCUIFI-QZTJIDSGSA-N 1 1 366.550 2.146 20 70 FEIDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCO[C@H](c2nccs2)C1 ZINC000160830861 546076562 /nfs/dbraw/zinc/07/65/62/546076562.db2.gz VEFJFXDTASKLQJ-HIFRSBDPSA-N 1 1 350.488 2.243 20 70 FEIDMO O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000160833630 546076798 /nfs/dbraw/zinc/07/67/98/546076798.db2.gz MDYDSOLHJWTLFD-DLBZAZTESA-N 1 1 370.497 2.387 20 70 FEIDMO CC(C)c1nc2n(n1)C[C@H](NC(=O)N[C@@H]1CC[N@H+](C3CCCC3)C1)CC2 ZINC000160856648 546078724 /nfs/dbraw/zinc/07/87/24/546078724.db2.gz XCBITGDYCHQRKE-HUUCEWRRSA-N 1 1 360.506 2.032 20 70 FEIDMO CCCN(C)C(=O)C(=O)Nc1ccnn1[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160883015 546081613 /nfs/dbraw/zinc/08/16/13/546081613.db2.gz IKODPECGRLLZNB-KRWDZBQOSA-N 1 1 369.469 2.137 20 70 FEIDMO CC[C@H]([NH2+][C@@H](C)C(=O)N(C)[C@@H]1CCS(=O)(=O)C1)c1ccc(F)cc1F ZINC000161048695 546095861 /nfs/dbraw/zinc/09/58/61/546095861.db2.gz VXPJLDBQVCBGLK-GHJWDPDVSA-N 1 1 374.453 2.040 20 70 FEIDMO Cc1nccn1CCCC[N@H+](C)[C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000161301096 546118249 /nfs/dbraw/zinc/11/82/49/546118249.db2.gz KXYJEJKVUMMGGG-AWEZNQCLSA-N 1 1 350.488 2.312 20 70 FEIDMO CN(C(=O)[C@@H]1Cc2ccccc2C[NH2+]1)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000159938072 326947859 /nfs/dbraw/zinc/94/78/59/326947859.db2.gz ACSYBNRPKRYBBN-PKOBYXMFSA-N 1 1 367.424 2.104 20 70 FEIDMO C[C@H](CNC(=O)NOCc1cccnc1)[NH+]1CCN(c2ccccc2)CC1 ZINC000161084593 326987533 /nfs/dbraw/zinc/98/75/33/326987533.db2.gz SPOLEDNHCZOUOH-QGZVFWFLSA-N 1 1 369.469 2.023 20 70 FEIDMO CC(C)[C@H](CNC(=O)N1CCc2c(F)cc(F)cc2C1)[NH+]1CCOCC1 ZINC000159366574 545946226 /nfs/dbraw/zinc/94/62/26/545946226.db2.gz BFYWHKCYEWPRGS-SFHVURJKSA-N 1 1 367.440 2.389 20 70 FEIDMO C[C@H](CCNC(=O)N1CCC[C@@H]1C(=O)NC1CC1)[N@@H+](C)Cc1ccccc1 ZINC000159395084 545950082 /nfs/dbraw/zinc/95/00/82/545950082.db2.gz OKTYNRBWPGJNDO-VQIMIIECSA-N 1 1 372.513 2.350 20 70 FEIDMO Cc1c(CS(C)(=O)=O)cccc1NC(=O)[C@@H]1[NH2+]CCc2ccccc21 ZINC000159412020 545950786 /nfs/dbraw/zinc/95/07/86/545950786.db2.gz HYFULODLQABXOQ-GOSISDBHSA-N 1 1 358.463 2.365 20 70 FEIDMO NC(=O)[C@@H]1CCC[N@H+]1C1CCN(Cc2csc(-c3ccco3)n2)CC1 ZINC000159418270 545951710 /nfs/dbraw/zinc/95/17/10/545951710.db2.gz KHDZYLVYIBOFSV-HNNXBMFYSA-N 1 1 360.483 2.317 20 70 FEIDMO Cn1cc(N2CCC[C@H]([N@H+]3CCCN(c4ccc(F)cc4)CC3)C2=O)cn1 ZINC000159457476 545955149 /nfs/dbraw/zinc/95/51/49/545955149.db2.gz ACXUMIMOOVEUPO-IBGZPJMESA-N 1 1 371.460 2.267 20 70 FEIDMO C[C@H]1C[C@H](NC(=O)NCCc2nnc(-c3ccccc3)o2)C[N@H+]1C1CC1 ZINC000159526277 545960829 /nfs/dbraw/zinc/96/08/29/545960829.db2.gz DQBITAGIYWUTKQ-ZFWWWQNUSA-N 1 1 355.442 2.204 20 70 FEIDMO O=C(Nc1ccnn1C[C@@H]1CCOC1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000159577794 545963848 /nfs/dbraw/zinc/96/38/48/545963848.db2.gz IGKZGBIZCKUOSI-JZXOWHBKSA-N 1 1 373.501 2.400 20 70 FEIDMO CC(C)C[N@@H+]1CCCC[C@@H]1CNC(=O)c1cc(S(C)(=O)=O)cs1 ZINC000159581033 545964449 /nfs/dbraw/zinc/96/44/49/545964449.db2.gz BPIXQAKWKYVYHN-CYBMUJFWSA-N 1 1 358.529 2.392 20 70 FEIDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1cc(S(C)(=O)=O)cs1 ZINC000159581033 545964452 /nfs/dbraw/zinc/96/44/52/545964452.db2.gz BPIXQAKWKYVYHN-CYBMUJFWSA-N 1 1 358.529 2.392 20 70 FEIDMO CC[N@H+]1CCCN(C(=O)NCc2ccc(N3CCCCC3=O)cc2)CC1 ZINC000159737178 545976186 /nfs/dbraw/zinc/97/61/86/545976186.db2.gz YYUQYZLDCSWECP-UHFFFAOYSA-N 1 1 358.486 2.441 20 70 FEIDMO CC[N@H+]1CCCN(C(=O)N[C@H](C)c2cccc(N3CCOC3=O)c2)CC1 ZINC000159771039 545979371 /nfs/dbraw/zinc/97/93/71/545979371.db2.gz VECFZTOXLRFRLU-OAHLLOKOSA-N 1 1 360.458 2.441 20 70 FEIDMO O=C(Nc1ccnn1C[C@@H]1CCOC1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000159834201 545984173 /nfs/dbraw/zinc/98/41/73/545984173.db2.gz UDSRNQDAFHRZME-SFHVURJKSA-N 1 1 369.469 2.269 20 70 FEIDMO COCC(C)(C)C(=O)NCC[NH+]1CCN(c2cccc(Cl)c2)CC1 ZINC000159846001 545986398 /nfs/dbraw/zinc/98/63/98/545986398.db2.gz LBYGPGVOBLIHNP-UHFFFAOYSA-N 1 1 353.894 2.251 20 70 FEIDMO CC[N@H+]1CCCN(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)CC1 ZINC000159891139 545989769 /nfs/dbraw/zinc/98/97/69/545989769.db2.gz DRRMSMYYCQDKIF-INIZCTEOSA-N 1 1 364.877 2.183 20 70 FEIDMO Cc1ccc(-c2n[nH]c(SCC(=O)NCC3CC[NH+](C)CC3)n2)cc1 ZINC000159914161 545991422 /nfs/dbraw/zinc/99/14/22/545991422.db2.gz QPFUIWMLNQSOPB-UHFFFAOYSA-N 1 1 359.499 2.330 20 70 FEIDMO C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H]1NC(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000159957575 545994456 /nfs/dbraw/zinc/99/44/56/545994456.db2.gz QNIQGOYSOSBPDD-RLLQIKCJSA-N 1 1 358.530 2.490 20 70 FEIDMO CCc1noc(C)c1NC(=O)C(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000159972747 545996363 /nfs/dbraw/zinc/99/63/63/545996363.db2.gz BVWCQHPHEJNHHQ-HNNXBMFYSA-N 1 1 374.441 2.420 20 70 FEIDMO CCOC(=O)C[C@@H](C)NC(=O)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC000160021026 546001419 /nfs/dbraw/zinc/00/14/19/546001419.db2.gz CYWBHMSHKZKDHL-ZBFHGGJFSA-N 1 1 350.434 2.496 20 70 FEIDMO Cc1nn(C)c(C)c1OCC(=O)N1C[C@H]2CCC[N@H+]2Cc2ccccc21 ZINC000160131218 546010590 /nfs/dbraw/zinc/01/05/90/546010590.db2.gz SEEMIVYZYGUXOB-QGZVFWFLSA-N 1 1 354.454 2.427 20 70 FEIDMO Cc1cccc(N2CCC(NC(=O)N3CC[N@H+](C)C[C@H]3C(C)C)CC2)n1 ZINC000160249908 546023159 /nfs/dbraw/zinc/02/31/59/546023159.db2.gz AMUAXPCFVFHGKN-SFHVURJKSA-N 1 1 359.518 2.340 20 70 FEIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cccc(N2CCCC2=O)c1 ZINC000160277522 546025237 /nfs/dbraw/zinc/02/52/37/546025237.db2.gz XJEGMPGPSYCZBB-UHFFFAOYSA-N 1 1 373.497 2.244 20 70 FEIDMO C[C@H](CNC(=O)NCc1ccccc1OC1CCC1)C[NH+]1CCOCC1 ZINC000160336070 546031819 /nfs/dbraw/zinc/03/18/19/546031819.db2.gz MCXMECZZWPDRSQ-MRXNPFEDSA-N 1 1 361.486 2.385 20 70 FEIDMO COC(=O)[C@H]1CCCN(C(=O)N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)C1 ZINC000160346905 546032644 /nfs/dbraw/zinc/03/26/44/546032644.db2.gz GZBFAVIBXUEWDP-SZMVWBNQSA-N 1 1 359.470 2.244 20 70 FEIDMO CC[NH+]1CCN(C[C@@H](C)CNC(=O)C2(c3ccc(C)c(OC)c3)CC2)CC1 ZINC000160349899 546033277 /nfs/dbraw/zinc/03/32/77/546033277.db2.gz ISNNIESTQRHZJH-KRWDZBQOSA-N 1 1 373.541 2.425 20 70 FEIDMO CC(C)CCn1ccc(NC(=O)NCCCC[N@H+]2CCC[C@H]2CO)n1 ZINC000160423096 546040164 /nfs/dbraw/zinc/04/01/64/546040164.db2.gz GOXFTKZXABYEAW-INIZCTEOSA-N 1 1 351.495 2.288 20 70 FEIDMO CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000160708762 546064474 /nfs/dbraw/zinc/06/44/74/546064474.db2.gz SVAXNVQHBUZLSU-LJQANCHMSA-N 1 1 372.513 2.404 20 70 FEIDMO CC(=O)c1ccccc1C(=O)NC[C@@H]1C[C@@H](O)C[N@@H+]1Cc1ccccc1 ZINC000160743102 546067671 /nfs/dbraw/zinc/06/76/71/546067671.db2.gz SUZCANBVRCJTOF-ZWKOTPCHSA-N 1 1 352.434 2.254 20 70 FEIDMO CC(=O)c1ccccc1C(=O)NC[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccccc1 ZINC000160743102 546067675 /nfs/dbraw/zinc/06/76/75/546067675.db2.gz SUZCANBVRCJTOF-ZWKOTPCHSA-N 1 1 352.434 2.254 20 70 FEIDMO CC(C)c1nccn1CCC(=O)NC[C@H]1C[C@@H](O)C[N@H+]1Cc1ccccc1 ZINC000160780110 546071126 /nfs/dbraw/zinc/07/11/26/546071126.db2.gz RHKJWXNLSOXIIG-RTBURBONSA-N 1 1 370.497 2.148 20 70 FEIDMO Cc1c(C(=O)NCCC[NH+]2CCOCC2)cnn1-c1cc(C)ccc1C ZINC000160942368 546086858 /nfs/dbraw/zinc/08/68/58/546086858.db2.gz WTFZRSIONUZVCE-UHFFFAOYSA-N 1 1 356.470 2.250 20 70 FEIDMO Cc1ccc(NC(=O)C(=O)N2CCC[N@@H+](CC3CCCCC3)CC2)cn1 ZINC000161123757 546101651 /nfs/dbraw/zinc/10/16/51/546101651.db2.gz LCLQIFSMCFSLSF-UHFFFAOYSA-N 1 1 358.486 2.443 20 70 FEIDMO Cc1ccc(C(=O)N2CC[NH+](CC(C)(C)O)CC2)c(Br)c1 ZINC000161171082 546106845 /nfs/dbraw/zinc/10/68/45/546106845.db2.gz JUBZLLFUVGULLT-UHFFFAOYSA-N 1 1 355.276 2.286 20 70 FEIDMO Cc1ncc([C@@H](C)NCc2cccc(C(=O)NCC[NH+](C)C)c2)c(C)n1 ZINC000161233093 546112001 /nfs/dbraw/zinc/11/20/01/546112001.db2.gz AFZZWGXJPTVKDY-CQSZACIVSA-N 1 1 355.486 2.236 20 70 FEIDMO CCOCCC[N@H+]1CC[C@H](NC(=O)NCCc2ccncc2C)[C@H](C)C1 ZINC000161303764 546118223 /nfs/dbraw/zinc/11/82/23/546118223.db2.gz FZHPCFJKGPTXEE-MJGOQNOKSA-N 1 1 362.518 2.369 20 70 FEIDMO O=C(Cc1csc(-c2ccc3c(c2)OCO3)n1)N1CC[NH+](C2CC2)CC1 ZINC000161428193 546129647 /nfs/dbraw/zinc/12/96/47/546129647.db2.gz BBYJTNZQIFHPNB-UHFFFAOYSA-N 1 1 371.462 2.388 20 70 FEIDMO CC(C)C[NH+]1CCN(C(=O)[C@]23CCC(=O)N2c2ccccc2S3)CC1 ZINC000218353753 548686670 /nfs/dbraw/zinc/68/66/70/548686670.db2.gz VLOOCHAMWGBQDU-LJQANCHMSA-N 1 1 359.495 2.416 20 70 FEIDMO COC(=O)[C@H](N[C@@H]1CCc2[nH+]c(C)cn2C1)c1cc(OC)cc(OC)c1 ZINC000159383919 326929980 /nfs/dbraw/zinc/92/99/80/326929980.db2.gz IRKPRTZARZUBEW-RDTXWAMCSA-N 1 1 359.426 2.027 20 70 FEIDMO CC[NH+]1CCN(c2ccc(CN[C@H](C)c3cnc(C)nc3C)cn2)CC1 ZINC000159492452 326933268 /nfs/dbraw/zinc/93/32/68/326933268.db2.gz WPRGHYAXVWXMTH-OAHLLOKOSA-N 1 1 354.502 2.481 20 70 FEIDMO Cc1cccc(-n2cc(C(=O)N(C)CC(C)(C)C[NH+]3CCOCC3)nn2)c1 ZINC000159709089 326939519 /nfs/dbraw/zinc/93/95/19/326939519.db2.gz KQUIDTTZRKFDPG-UHFFFAOYSA-N 1 1 371.485 2.006 20 70 FEIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc(N2CCCC2)nc1 ZINC000160343331 326962162 /nfs/dbraw/zinc/96/21/62/326962162.db2.gz FAVOVXPLPNSBRZ-UHFFFAOYSA-N 1 1 360.502 2.112 20 70 FEIDMO CC(C)(C)[C@@H](CCO)NC(=O)NCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000161424118 326999019 /nfs/dbraw/zinc/99/90/19/326999019.db2.gz BSSSKEMONZLGKK-GOSISDBHSA-N 1 1 363.502 2.115 20 70 FEIDMO C[NH+](C)C[C@H](Cc1ccccc1)NC(=O)c1cc(S(C)(=O)=O)cs1 ZINC000161497430 327001014 /nfs/dbraw/zinc/00/10/14/327001014.db2.gz BCHHFZWIAAVITA-AWEZNQCLSA-N 1 1 366.508 2.054 20 70 FEIDMO COc1cc(CN2CCC([N@H+]3CCC[C@H]3C(N)=O)CC2)ccc1SC ZINC000159372727 545947394 /nfs/dbraw/zinc/94/73/94/545947394.db2.gz DBOVWMNIEPCCIF-INIZCTEOSA-N 1 1 363.527 2.331 20 70 FEIDMO CCN1CC[NH+](CCCNC(=O)[C@H](O)c2cc(Cl)cc(Cl)c2)CC1 ZINC000159435598 545953120 /nfs/dbraw/zinc/95/31/20/545953120.db2.gz VEWUCBMBQYACIX-MRXNPFEDSA-N 1 1 374.312 2.171 20 70 FEIDMO CC[N@H+]1CCC[C@@H]1CNC(=O)Cc1cccc(I)c1 ZINC000159568531 545963586 /nfs/dbraw/zinc/96/35/86/545963586.db2.gz ALHDAPSCUPWHGS-CQSZACIVSA-N 1 1 372.250 2.434 20 70 FEIDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)NCCCO[C@@H]1CCOC1 ZINC000159762058 545978658 /nfs/dbraw/zinc/97/86/58/545978658.db2.gz SKMYXKLAWLFDOJ-GOSISDBHSA-N 1 1 363.502 2.392 20 70 FEIDMO CCOc1cc(C[N@@H+](C)C[C@@H]2CCC[C@@H]2O)nc2nc(C(F)(F)F)nn21 ZINC000159823555 545984447 /nfs/dbraw/zinc/98/44/47/545984447.db2.gz MWSDQARDPVIWRU-JQWIXIFHSA-N 1 1 373.379 2.135 20 70 FEIDMO COC(=O)C1CCN(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000159943141 545994121 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/nfs/dbraw/zinc/95/83/73/326958373.db2.gz HIODLHSQQLMXSC-UHFFFAOYSA-N 1 1 373.501 2.016 20 70 FEIDMO Cc1nn(C(F)F)c(C)c1CC(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000160339090 326962085 /nfs/dbraw/zinc/96/20/85/326962085.db2.gz QVEHYBZUUGEMFT-UHFFFAOYSA-N 1 1 372.460 2.254 20 70 FEIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccncc1Br ZINC000160346024 326962407 /nfs/dbraw/zinc/96/24/07/326962407.db2.gz OVROFSSXQDQYII-UHFFFAOYSA-N 1 1 370.291 2.275 20 70 FEIDMO CCCCn1ncc(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)c1C ZINC000160356677 326962551 /nfs/dbraw/zinc/96/25/51/326962551.db2.gz IOZPBHDOVMNKJA-UHFFFAOYSA-N 1 1 350.507 2.422 20 70 FEIDMO C[N@H+]1CCC[C@H]1C(=O)N1CCN(C(=O)c2ccccc2C(C)(C)C)CC1 ZINC000159389502 545948408 /nfs/dbraw/zinc/94/84/08/545948408.db2.gz BFSMNNQNLOEDIB-SFHVURJKSA-N 1 1 357.498 2.363 20 70 FEIDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)C(=O)Nc2ccc3ncccc3c2)C1 ZINC000159408546 545950622 /nfs/dbraw/zinc/95/06/22/545950622.db2.gz SFEIAUCKAHVFJM-OAHLLOKOSA-N 1 1 354.454 2.267 20 70 FEIDMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1ccccc1CSc1nc[nH]n1 ZINC000159489964 545958641 /nfs/dbraw/zinc/95/86/41/545958641.db2.gz GJIORPIRIHKOSG-OAHLLOKOSA-N 1 1 357.483 2.311 20 70 FEIDMO COc1cc(NC(=O)C[N@@H+](C)C[C@H]2CCC[C@@H]2O)c(OC)cc1Cl ZINC000159548851 545962430 /nfs/dbraw/zinc/96/24/30/545962430.db2.gz IINIFAYUDSIRCK-RISCZKNCSA-N 1 1 356.850 2.389 20 70 FEIDMO CNS(=O)(=O)c1cc(NC(=O)C[N@H+]2CC[C@@H]3CCCC[C@@H]32)ccc1C ZINC000159612525 545967809 /nfs/dbraw/zinc/96/78/09/545967809.db2.gz PZZVWUSFVUAYJG-HOCLYGCPSA-N 1 1 365.499 2.106 20 70 FEIDMO C[N@H+](CC(=O)Nc1ccccc1C(=O)NC1CCCC1)C[C@@H]1CCC[C@@H]1O ZINC000159731374 545976748 /nfs/dbraw/zinc/97/67/48/545976748.db2.gz SHFQEMDTFUBOST-KXBFYZLASA-N 1 1 373.497 2.390 20 70 FEIDMO C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCN(c3ncccc3Cl)C2)CC[N@H+]1C ZINC000159828921 545983989 /nfs/dbraw/zinc/98/39/89/545983989.db2.gz RVVLJJPJEQHBJJ-RBSFLKMASA-N 1 1 365.909 2.438 20 70 FEIDMO COc1cccc(C2(NC(=O)NC[C@@H](C(C)C)[NH+]3CCOCC3)CC2)c1 ZINC000159845761 545985939 /nfs/dbraw/zinc/98/59/39/545985939.db2.gz HXVIEFXBWQDXHH-SFHVURJKSA-N 1 1 361.486 2.340 20 70 FEIDMO CC(C)[C@H](CNC(=O)N1CCO[C@H](c2ccsc2)C1)[NH+]1CCOCC1 ZINC000159848166 545985954 /nfs/dbraw/zinc/98/59/54/545985954.db2.gz ZZEIBARVAXQFCV-IRXDYDNUSA-N 1 1 367.515 2.188 20 70 FEIDMO CCN1CC[NH+](CCC(=O)NC[C@@H]2C[C@]23CCCc2ccccc23)CC1 ZINC000159865391 545987592 /nfs/dbraw/zinc/98/75/92/545987592.db2.gz KUTPQLUUGZHGFK-SIKLNZKXSA-N 1 1 355.526 2.424 20 70 FEIDMO C[C@@H](CNC(=O)CNC(=O)CC1CCCC1)[N@H+]1CCc2ccccc2C1 ZINC000159907551 545990070 /nfs/dbraw/zinc/99/00/70/545990070.db2.gz MGHSXBOJFPATBA-INIZCTEOSA-N 1 1 357.498 2.246 20 70 FEIDMO COCCCS(=O)(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 ZINC000159993870 545997870 /nfs/dbraw/zinc/99/78/70/545997870.db2.gz ZDOZYUNNBRCFOV-AEFFLSMTSA-N 1 1 354.516 2.338 20 70 FEIDMO CSC[C@](C)(O)CNC(=O)NC[C@H]1CCC[N@H+]1Cc1ccccc1 ZINC000160017973 546001408 /nfs/dbraw/zinc/00/14/08/546001408.db2.gz WILXYCIUDUPWBI-SJLPKXTDSA-N 1 1 351.516 2.064 20 70 FEIDMO CCc1noc(C)c1NC(=O)C(=O)NCCCC[N@H+]1CCC[C@H](C)C1 ZINC000160084684 546005945 /nfs/dbraw/zinc/00/59/45/546005945.db2.gz JJCIFDITRMAWNE-ZDUSSCGKSA-N 1 1 350.463 2.112 20 70 FEIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cccnc1Br ZINC000160309043 546028129 /nfs/dbraw/zinc/02/81/29/546028129.db2.gz JDBUVGUQXZIEQO-UHFFFAOYSA-N 1 1 370.291 2.275 20 70 FEIDMO COCC[C@H](C)NC(=O)N(C)[C@@H]1CCCC[C@@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000160408655 546037257 /nfs/dbraw/zinc/03/72/57/546037257.db2.gz WLRCKYYGIQPIMN-YTQUADARSA-N 1 1 368.566 2.390 20 70 FEIDMO Nc1cc(N)[nH+]c(S[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)n1 ZINC000160433981 546041543 /nfs/dbraw/zinc/04/15/43/546041543.db2.gz SGTVSGKUVXRNBM-SNVBAGLBSA-N 1 1 353.810 2.331 20 70 FEIDMO NC(=O)C[C@H]1CCC[N@H+]([C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C1 ZINC000160465367 546043237 /nfs/dbraw/zinc/04/32/37/546043237.db2.gz HYVSHNAUZCKKMK-ABAIWWIYSA-N 1 1 353.825 2.172 20 70 FEIDMO C[C@@H]1C[NH+](C[C@@H]2CCCN2C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)C[C@@H](C)O1 ZINC000160490089 546045493 /nfs/dbraw/zinc/04/54/93/546045493.db2.gz PMZSKUVYYCNHQG-LIEJCIORSA-N 1 1 365.518 2.227 20 70 FEIDMO COc1ccc(S(C)(=O)=O)cc1C(=O)N(CC[NH+](C)C)C1CCCC1 ZINC000160496017 546046730 /nfs/dbraw/zinc/04/67/30/546046730.db2.gz JHPMWKQPKMSUNV-UHFFFAOYSA-N 1 1 368.499 2.045 20 70 FEIDMO CCC[C@@H]1CN(C(=O)Nc2cc(C(N)=O)ccc2C)CC[N@H+]1CCOC ZINC000160529853 546049502 /nfs/dbraw/zinc/04/95/02/546049502.db2.gz UIFMIMREYUMZQO-MRXNPFEDSA-N 1 1 362.474 2.059 20 70 FEIDMO C[C@H](COc1ccccc1)C(=O)NC[C@H]1C[C@H](O)C[N@H+]1Cc1ccccc1 ZINC000160568423 546052374 /nfs/dbraw/zinc/05/23/74/546052374.db2.gz SQIZRORUTFBHNJ-RLLQIKCJSA-N 1 1 368.477 2.453 20 70 FEIDMO COc1ccccc1CN1CCN(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)CC1 ZINC000160776125 546071187 /nfs/dbraw/zinc/07/11/87/546071187.db2.gz UIAWIIJUUHWWAH-IBGZPJMESA-N 1 1 372.513 2.007 20 70 FEIDMO CC[C@H]([NH2+][C@H](C)C(=O)N(C)[C@@H]1CCS(=O)(=O)C1)c1ccc(F)cc1F ZINC000161048950 546096241 /nfs/dbraw/zinc/09/62/41/546096241.db2.gz VXPJLDBQVCBGLK-KFNAQCHYSA-N 1 1 374.453 2.040 20 70 FEIDMO COCCC1(CNC(=O)N2CCN(CC[N@@H+]3[C@H](C)CC[C@@H]3C)CC2)CC1 ZINC000161153294 546105298 /nfs/dbraw/zinc/10/52/98/546105298.db2.gz COBHLXAGALVOKX-HDICACEKSA-N 1 1 366.550 2.003 20 70 FEIDMO C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)N2CCN3CCCC[C@@H]3C2)CC1 ZINC000161175682 546107269 /nfs/dbraw/zinc/10/72/69/546107269.db2.gz PIOIJZARJBEJEQ-YLJYHZDGSA-N 1 1 371.529 2.487 20 70 FEIDMO CN(C(=O)NCC1(C)COC1)[C@@H]1CCCC[C@@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000161212942 546110150 /nfs/dbraw/zinc/11/01/50/546110150.db2.gz NWYJDMKHVGNFLF-ZWKOTPCHSA-N 1 1 366.550 2.002 20 70 FEIDMO CC[C@H](C)[N@@H+](C)CCNC(=O)C(=O)Nc1cc(C)ccc1-n1cc(C)cn1 ZINC000161259603 546114238 /nfs/dbraw/zinc/11/42/38/546114238.db2.gz NOSXZLJHEDUONX-INIZCTEOSA-N 1 1 371.485 2.274 20 70 FEIDMO CC(C)[N@H+]1C[C@H](NC(=O)c2ccc(S(=O)(=O)C(C)C)cc2)[C@@H](C)C1 ZINC000161302468 546118240 /nfs/dbraw/zinc/11/82/40/546118240.db2.gz NSVDVDIKRMHWCT-YOEHRIQHSA-N 1 1 352.500 2.327 20 70 FEIDMO CC(C)[N@@H+]1C[C@H](NC(=O)c2ccc(S(=O)(=O)C(C)C)cc2)[C@@H](C)C1 ZINC000161302468 546118243 /nfs/dbraw/zinc/11/82/43/546118243.db2.gz NSVDVDIKRMHWCT-YOEHRIQHSA-N 1 1 352.500 2.327 20 70 FEIDMO C[C@@H](CNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1)[N@@H+](C)C1CC1 ZINC000161311189 546119295 /nfs/dbraw/zinc/11/92/95/546119295.db2.gz XGCOQVTWJNKUPU-NWDGAFQWSA-N 1 1 367.852 2.431 20 70 FEIDMO CCC[C@H]1CN(C(=O)NCC2CC[NH+](CCC)CC2)CCN1CCOC ZINC000161413452 546128356 /nfs/dbraw/zinc/12/83/56/546128356.db2.gz LTPGMSAQXMEYIB-IBGZPJMESA-N 1 1 368.566 2.251 20 70 FEIDMO COc1cccc(C(=O)N2CCC[C@@H]2C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1OC ZINC000217199511 548680174 /nfs/dbraw/zinc/68/01/74/548680174.db2.gz JTTWTUDWOXFBHN-OWCLPIDISA-N 1 1 362.470 2.418 20 70 FEIDMO COc1cccc(C(=O)N2CCC[C@@H]2C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1OC ZINC000217199511 548680179 /nfs/dbraw/zinc/68/01/79/548680179.db2.gz JTTWTUDWOXFBHN-OWCLPIDISA-N 1 1 362.470 2.418 20 70 FEIDMO c1nc2nc(-c3ccccc3)cc(N3CCC[C@@H]3C[NH+]3CCOCC3)n2n1 ZINC000160395842 326964112 /nfs/dbraw/zinc/96/41/12/326964112.db2.gz AXDNECXKQCRABV-QGZVFWFLSA-N 1 1 364.453 2.092 20 70 FEIDMO C[C@@H](CCn1cccn1)Nc1ccc(C[N@H+]2CCC[C@H](C(N)=O)C2)cc1 ZINC000159443895 545953843 /nfs/dbraw/zinc/95/38/43/545953843.db2.gz QASBHIFQUZBVJH-WMZOPIPTSA-N 1 1 355.486 2.471 20 70 FEIDMO CS(=O)(=O)NCC[C@@H]1CCCC[N@@H+]1Cc1cc(-c2ccccc2)n[nH]1 ZINC000159469291 545956597 /nfs/dbraw/zinc/95/65/97/545956597.db2.gz YZSYDWNNGLAYJB-KRWDZBQOSA-N 1 1 362.499 2.371 20 70 FEIDMO CS(=O)(=O)NCC[C@@H]1CCCC[N@H+]1Cc1cc(-c2ccccc2)n[nH]1 ZINC000159469291 545956601 /nfs/dbraw/zinc/95/66/01/545956601.db2.gz YZSYDWNNGLAYJB-KRWDZBQOSA-N 1 1 362.499 2.371 20 70 FEIDMO COc1ccc(CN(C)C(=O)[C@H](C)[N@@H+](C)C[C@@H]2CCC[C@@H]2O)cc1F ZINC000159538647 545961488 /nfs/dbraw/zinc/96/14/88/545961488.db2.gz FBBFWAKBRQGCFJ-QRTARXTBSA-N 1 1 352.450 2.274 20 70 FEIDMO O=C1NC2(CCCC2)C(=O)N1CC[N@@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000159586959 545965196 /nfs/dbraw/zinc/96/51/96/545965196.db2.gz RXXOTRVPRWWBNW-MRXNPFEDSA-N 1 1 361.442 2.125 20 70 FEIDMO O=C1NC2(CCCC2)C(=O)N1CC[N@H+](Cc1ccco1)C[C@H]1CCCO1 ZINC000159586959 545965202 /nfs/dbraw/zinc/96/52/02/545965202.db2.gz RXXOTRVPRWWBNW-MRXNPFEDSA-N 1 1 361.442 2.125 20 70 FEIDMO CC[C@@H](C)NC(=O)c1cccc(CNC(=O)N2CCC[N@@H+](CC)CC2)c1 ZINC000159630322 545968518 /nfs/dbraw/zinc/96/85/18/545968518.db2.gz YZJGLNOEQKUEAO-MRXNPFEDSA-N 1 1 360.502 2.452 20 70 FEIDMO C[C@H](CS(C)(=O)=O)[N@@H+](CC1CCN(C(=O)C(C)(C)C)CC1)C1CC1 ZINC000159674396 545971980 /nfs/dbraw/zinc/97/19/80/545971980.db2.gz FDPFOLNMGNXJKJ-CQSZACIVSA-N 1 1 358.548 2.169 20 70 FEIDMO CC(C)c1ccccc1OCCNC(=O)NC[C@@H](C)C[NH+]1CCOCC1 ZINC000159673474 545972029 /nfs/dbraw/zinc/97/20/29/545972029.db2.gz MPWFJOXEPOHCDV-QGZVFWFLSA-N 1 1 363.502 2.456 20 70 FEIDMO CC[C@H]1CCCC[N@H+]1CCNC(=O)C(=O)Nc1cnc(Cl)cc1C ZINC000159757156 545978220 /nfs/dbraw/zinc/97/82/20/545978220.db2.gz PBIBINDETDYFPW-ZDUSSCGKSA-N 1 1 352.866 2.363 20 70 FEIDMO CCOc1cc(Cl)ccc1CNC(=O)N[C@H](C)C[NH+]1CCN(C)CC1 ZINC000159858395 545986487 /nfs/dbraw/zinc/98/64/87/545986487.db2.gz XXPGZRNCZNZJPZ-CQSZACIVSA-N 1 1 368.909 2.174 20 70 FEIDMO CC[N@H+]1CCCN(C(=O)N[C@@H]2CCCN(c3cccc(OC)c3)C2)CC1 ZINC000159873524 545988483 /nfs/dbraw/zinc/98/84/83/545988483.db2.gz RQDADKDFQRNBJF-QGZVFWFLSA-N 1 1 360.502 2.401 20 70 FEIDMO CCCNC(=O)[C@@H]1CCC[N@H+](Cc2nnc(-c3ccccc3OC)o2)C1 ZINC000159877740 545988703 /nfs/dbraw/zinc/98/87/03/545988703.db2.gz ZAIKWCYSFYSDOE-CQSZACIVSA-N 1 1 358.442 2.483 20 70 FEIDMO CCCNC(=O)[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3OC)o2)C1 ZINC000159877740 545988706 /nfs/dbraw/zinc/98/87/06/545988706.db2.gz ZAIKWCYSFYSDOE-CQSZACIVSA-N 1 1 358.442 2.483 20 70 FEIDMO CCc1noc(C)c1NC(=O)C(=O)NCCC[N@@H+](C)Cc1ccccc1 ZINC000160014547 546001170 /nfs/dbraw/zinc/00/11/70/546001170.db2.gz NFIBBJHVBMYOIT-UHFFFAOYSA-N 1 1 358.442 2.122 20 70 FEIDMO C[C@H](CNC(=O)N[C@@H]1C[C@@H]1c1c(F)cccc1F)C[NH+]1CCOCC1 ZINC000160205777 546017395 /nfs/dbraw/zinc/01/73/95/546017395.db2.gz MICBUGCHNLCBFJ-DVOMOZLQSA-N 1 1 353.413 2.088 20 70 FEIDMO Cc1cnn(Cc2cc(C(=O)NCCC[N@H+](C)Cc3ccccc3)no2)c1 ZINC000160403202 546037882 /nfs/dbraw/zinc/03/78/82/546037882.db2.gz ZLPZLWNSDDICLC-UHFFFAOYSA-N 1 1 367.453 2.480 20 70 FEIDMO COCC[C@H](C)NC(=O)N(C)[C@H]1CCCC[C@@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000160408917 546039104 /nfs/dbraw/zinc/03/91/04/546039104.db2.gz WLRCKYYGIQPIMN-WDSOQIARSA-N 1 1 368.566 2.390 20 70 FEIDMO Cc1ccc(S(C)(=O)=O)cc1C(=O)NC[C@H]1CCC[N@@H+]1CC(C)C ZINC000160557198 546051406 /nfs/dbraw/zinc/05/14/06/546051406.db2.gz FNCDYLHQVMITAC-OAHLLOKOSA-N 1 1 352.500 2.249 20 70 FEIDMO COc1ccccc1CN1CCN(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)CC1 ZINC000160775993 546071061 /nfs/dbraw/zinc/07/10/61/546071061.db2.gz UIAWIIJUUHWWAH-LJQANCHMSA-N 1 1 372.513 2.007 20 70 FEIDMO CC[N@H+]1CC[C@H](N(C)C(=O)NCc2cn(C)nc2C(F)(F)F)[C@H](C)C1 ZINC000160791951 546073160 /nfs/dbraw/zinc/07/31/60/546073160.db2.gz RYPPSACTALSSKT-YPMHNXCESA-N 1 1 361.412 2.311 20 70 FEIDMO COCC[NH+]1CCN(C(=O)N[C@@H](c2ccco2)c2ccccc2OC)CC1 ZINC000160819534 546075511 /nfs/dbraw/zinc/07/55/11/546075511.db2.gz VSIJCWSIWDUAPO-LJQANCHMSA-N 1 1 373.453 2.351 20 70 FEIDMO CC(C)C(=O)NC[C@H]1CCCN(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)C1 ZINC000160883581 546081512 /nfs/dbraw/zinc/08/15/12/546081512.db2.gz PJECMLGBIKCWDW-SJORKVTESA-N 1 1 364.534 2.197 20 70 FEIDMO CC(C)c1csc(CNC(=O)NC[C@@H](C(C)C)N2CC[NH+](C)CC2)n1 ZINC000160908007 546083219 /nfs/dbraw/zinc/08/32/19/546083219.db2.gz DZSXDPKHFHMYAY-INIZCTEOSA-N 1 1 367.563 2.338 20 70 FEIDMO O=C(C[N@@H+]1CC[C@]2(O)CCCC[C@@H]2C1)Nc1ccc2c(c1)OCCCO2 ZINC000160931970 546085810 /nfs/dbraw/zinc/08/58/10/546085810.db2.gz ZFBOGAGZHIBZCJ-FOIQADDNSA-N 1 1 360.454 2.413 20 70 FEIDMO O=C(C[N@H+]1CC[C@]2(O)CCCC[C@@H]2C1)Nc1ccc2c(c1)OCCCO2 ZINC000160931970 546085813 /nfs/dbraw/zinc/08/58/13/546085813.db2.gz ZFBOGAGZHIBZCJ-FOIQADDNSA-N 1 1 360.454 2.413 20 70 FEIDMO CN(C)CC[NH+]1CCC(NC(=O)N2CCC[C@@H](Nc3ccccc3)C2)CC1 ZINC000160940471 546086746 /nfs/dbraw/zinc/08/67/46/546086746.db2.gz MGTSFLOZOWCRKX-HXUWFJFHSA-N 1 1 373.545 2.299 20 70 FEIDMO CCOC(=O)C1CCN(C(=O)[C@H](C)[NH2+][C@H](CC)c2nccs2)CC1 ZINC000161089750 546098559 /nfs/dbraw/zinc/09/85/59/546098559.db2.gz VPDIJEGTZMDRKI-GXTWGEPZSA-N 1 1 353.488 2.374 20 70 FEIDMO CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N1CC[NH+](C2CC2)CC1 ZINC000161426331 546127836 /nfs/dbraw/zinc/12/78/36/546127836.db2.gz FXQMXZYKMCZYNF-UZLBHIALSA-N 1 1 369.509 2.293 20 70 FEIDMO CCCNC(=O)C[NH+]1CCC(NC(=O)c2cc(F)cc3cccnc32)CC1 ZINC000160322045 326961477 /nfs/dbraw/zinc/96/14/77/326961477.db2.gz HGWBOZQAFFCSAW-UHFFFAOYSA-N 1 1 372.444 2.094 20 70 FEIDMO CCCCn1ncc(C(=O)NC[C@H](CC(C)C)[NH+]2CCOCC2)c1C ZINC000161437047 326999290 /nfs/dbraw/zinc/99/92/90/326999290.db2.gz STDPKCFKAKOVBR-KRWDZBQOSA-N 1 1 350.507 2.468 20 70 FEIDMO O=C(NCC[NH+]1CCN(c2cccc(Cl)c2)CC1)[C@H]1C[C@H]2CC[C@@H]1O2 ZINC000161466980 327000293 /nfs/dbraw/zinc/00/02/93/327000293.db2.gz MEONHTMZPNQAOC-SQNIBIBYSA-N 1 1 363.889 2.146 20 70 FEIDMO CCCNC(=O)C[NH+]1CCC(NC(=O)[C@H]2C[C@@H]2c2sccc2C)CC1 ZINC000161476174 327000537 /nfs/dbraw/zinc/00/05/37/327000537.db2.gz IZBLHEDNHGGUNQ-HOTGVXAUSA-N 1 1 363.527 2.267 20 70 FEIDMO C[C@H](C(=O)Nc1ccc2c(c1)OC(F)(F)O2)[N@@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000159530053 545960732 /nfs/dbraw/zinc/96/07/32/545960732.db2.gz XRVHAXRCWWJBLK-MDZLAQPJSA-N 1 1 356.369 2.428 20 70 FEIDMO CC[N@H+]1CCCN(C(=O)N[C@H](c2nccn2C)c2ccc(OC)cc2)CC1 ZINC000159568773 545963456 /nfs/dbraw/zinc/96/34/56/545963456.db2.gz OSTGPJQWLOHUDG-SFHVURJKSA-N 1 1 371.485 2.255 20 70 FEIDMO CC[N@H+]1CCCN(C(=O)NC[C@@H](c2cccc(C)c2)N2CCOCC2)CC1 ZINC000159619527 545967650 /nfs/dbraw/zinc/96/76/50/545967650.db2.gz KJGUNSHCNAOGSQ-FQEVSTJZSA-N 1 1 374.529 2.106 20 70 FEIDMO CN(CCCOc1ccc(F)cc1)C(=O)C[N@@H+](C)C[C@H]1CCC[C@@H]1O ZINC000159810524 545983160 /nfs/dbraw/zinc/98/31/60/545983160.db2.gz URHWUYSLCKRRGJ-QAPCUYQASA-N 1 1 352.450 2.146 20 70 FEIDMO Cc1cc(NC(=O)C[N@@H+](C)C[C@H]2CCC[C@@H]2O)n(-c2ccc(F)cc2)n1 ZINC000159823980 545984131 /nfs/dbraw/zinc/98/41/31/545984131.db2.gz RCRVBXFVRMDLER-PBHICJAKSA-N 1 1 360.433 2.351 20 70 FEIDMO CCC(=O)N1CCCN(C(=O)N[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000159865759 545986958 /nfs/dbraw/zinc/98/69/58/545986958.db2.gz VCXZRPQRMZIGPH-HKUYNNGSSA-N 1 1 372.513 2.303 20 70 FEIDMO C[C@@H](C(=O)Nc1ccc(C(N)=O)cc1)[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000159875604 545987892 /nfs/dbraw/zinc/98/78/92/545987892.db2.gz BUKGTYYPIDIVHN-AWEZNQCLSA-N 1 1 354.454 2.311 20 70 FEIDMO COc1cccc(C2(NC(=O)NC[C@H](C(C)C)N3CC[NH+](C)CC3)CC2)c1 ZINC000159905331 545990739 /nfs/dbraw/zinc/99/07/39/545990739.db2.gz XAOWPPCUMBLCBT-LJQANCHMSA-N 1 1 374.529 2.256 20 70 FEIDMO COC(=O)[C@]1(C)CCN(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)C1 ZINC000159934536 545992434 /nfs/dbraw/zinc/99/24/34/545992434.db2.gz XGFRYJQDGSUUAE-RIFZZMRRSA-N 1 1 359.470 2.102 20 70 FEIDMO O=c1[nH]c(CSCC[NH+]2CCOCC2)nc2sc3c(c21)CCCC3 ZINC000160006172 545999940 /nfs/dbraw/zinc/99/99/40/545999940.db2.gz LOBZBLOSVURRBP-UHFFFAOYSA-N 1 1 365.524 2.429 20 70 FEIDMO COc1ccc([C@H]2CC[N@H+]([C@H]3CCCN(c4cnn(C)c4)C3=O)C2)cc1 ZINC000160036332 546001799 /nfs/dbraw/zinc/00/17/99/546001799.db2.gz JBIVBOSXDXBWFZ-LPHOPBHVSA-N 1 1 354.454 2.414 20 70 FEIDMO CC(C)OC(=O)CCCNC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000160050317 546002953 /nfs/dbraw/zinc/00/29/53/546002953.db2.gz JBHWBXXMKHGFJZ-NVXWUHKLSA-N 1 1 351.491 2.377 20 70 FEIDMO C[C@H]1C[C@@H](NC(=O)NC[C@](C)(O)c2ccco2)C[N@H+]1Cc1ccccc1 ZINC000160109736 546007292 /nfs/dbraw/zinc/00/72/92/546007292.db2.gz CWJYVYIPRUHSTP-VPWXQRGCSA-N 1 1 357.454 2.449 20 70 FEIDMO COCC[N@H+](Cc1c(C)nn(C)c1N1CCOCC1)Cc1ccccc1 ZINC000160454611 546042412 /nfs/dbraw/zinc/04/24/12/546042412.db2.gz XBKHZPJGRBGRQM-UHFFFAOYSA-N 1 1 358.486 2.214 20 70 FEIDMO COCC[N@@H+](Cc1c(C)nn(C)c1N1CCOCC1)Cc1ccccc1 ZINC000160454611 546042415 /nfs/dbraw/zinc/04/24/15/546042415.db2.gz XBKHZPJGRBGRQM-UHFFFAOYSA-N 1 1 358.486 2.214 20 70 FEIDMO CCOC(=O)c1c(C)oc2nc(C[N@H+](CCOC)CC(C)C)nc(N)c21 ZINC000160581258 546053402 /nfs/dbraw/zinc/05/34/02/546053402.db2.gz NOTMMFNWUKLFGZ-UHFFFAOYSA-N 1 1 364.446 2.395 20 70 FEIDMO CCOC(=O)c1c(C)oc2nc(C[N@@H+](CCOC)CC(C)C)nc(N)c21 ZINC000160581258 546053408 /nfs/dbraw/zinc/05/34/08/546053408.db2.gz NOTMMFNWUKLFGZ-UHFFFAOYSA-N 1 1 364.446 2.395 20 70 FEIDMO CC(C)(C)C(=O)N1CCC(C[N@@H+]2CCNC(=O)[C@@H]2c2ccccc2)CC1 ZINC000160594969 546054716 /nfs/dbraw/zinc/05/47/16/546054716.db2.gz OWYSPJCHCYUXPQ-SFHVURJKSA-N 1 1 357.498 2.444 20 70 FEIDMO CC(C)(C)C(=O)N1CCC(C[N@H+]2CCNC(=O)[C@@H]2c2ccccc2)CC1 ZINC000160594969 546054722 /nfs/dbraw/zinc/05/47/22/546054722.db2.gz OWYSPJCHCYUXPQ-SFHVURJKSA-N 1 1 357.498 2.444 20 70 FEIDMO CN(C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1)[C@@H]1CCN(c2ccccc2F)C1=O ZINC000160627052 546057709 /nfs/dbraw/zinc/05/77/09/546057709.db2.gz CEOOAKWROVRICZ-MAUKXSAKSA-N 1 1 374.460 2.057 20 70 FEIDMO CCS(=O)(=O)c1ccc(CCC(=O)NC[C@H]2CC[N@H+](C3CC3)C2)cc1 ZINC000160669229 546061213 /nfs/dbraw/zinc/06/12/13/546061213.db2.gz AWTKKZLRGNBXSO-MRXNPFEDSA-N 1 1 364.511 2.013 20 70 FEIDMO COC(=O)c1ccc2[nH]cc(C(=O)C[N@@H+]3CCC[C@@H](CCC(N)=O)C3)c2c1 ZINC000160850270 546077572 /nfs/dbraw/zinc/07/75/72/546077572.db2.gz QYTGSWLWJDKDBZ-ZDUSSCGKSA-N 1 1 371.437 2.115 20 70 FEIDMO COC(=O)c1ccc2[nH]cc(C(=O)C[N@H+]3CCC[C@@H](CCC(N)=O)C3)c2c1 ZINC000160850270 546077576 /nfs/dbraw/zinc/07/75/76/546077576.db2.gz QYTGSWLWJDKDBZ-ZDUSSCGKSA-N 1 1 371.437 2.115 20 70 FEIDMO Cc1ccccc1C[NH+]1CCC(NC(=O)CS(=O)(=O)C(C)(C)C)CC1 ZINC000160869662 546079891 /nfs/dbraw/zinc/07/98/91/546079891.db2.gz JXZATFQJUUCTRZ-UHFFFAOYSA-N 1 1 366.527 2.289 20 70 FEIDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCN(c2ccccc2O)CC1 ZINC000160887429 546081078 /nfs/dbraw/zinc/08/10/78/546081078.db2.gz JXUUFZONPJYUFY-MRXNPFEDSA-N 1 1 358.486 2.241 20 70 FEIDMO CC(C)C(=O)NC[C@H]1CCCN(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)C1 ZINC000160883320 546081539 /nfs/dbraw/zinc/08/15/39/546081539.db2.gz PJECMLGBIKCWDW-IAGOWNOFSA-N 1 1 364.534 2.197 20 70 FEIDMO CCCC(=O)N[C@@H]1CCCN(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)C1 ZINC000160900481 546083059 /nfs/dbraw/zinc/08/30/59/546083059.db2.gz CWEASVYWUHRRIH-HZPDHXFCSA-N 1 1 350.507 2.094 20 70 FEIDMO O=C(c1cccc(-n2ccnn2)c1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000160913202 546084425 /nfs/dbraw/zinc/08/44/25/546084425.db2.gz YRIFLKZZYVAPGF-QFBILLFUSA-N 1 1 351.454 2.356 20 70 FEIDMO O=C(c1cccc(-n2ccnn2)c1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000160913339 546084645 /nfs/dbraw/zinc/08/46/45/546084645.db2.gz YRIFLKZZYVAPGF-LPHOPBHVSA-N 1 1 351.454 2.356 20 70 FEIDMO O=C(C[N@@H+]1CC[C@@]2(O)CCCC[C@@H]2C1)Nc1ccc2c(c1)OCCCO2 ZINC000160932018 546085746 /nfs/dbraw/zinc/08/57/46/546085746.db2.gz ZFBOGAGZHIBZCJ-QRWLVFNGSA-N 1 1 360.454 2.413 20 70 FEIDMO O=C(C[N@H+]1CC[C@@]2(O)CCCC[C@@H]2C1)Nc1ccc2c(c1)OCCCO2 ZINC000160932018 546085749 /nfs/dbraw/zinc/08/57/49/546085749.db2.gz ZFBOGAGZHIBZCJ-QRWLVFNGSA-N 1 1 360.454 2.413 20 70 FEIDMO CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)N[C@@H]1CCCCC[C@@H]1C(N)=O ZINC000160988176 546090070 /nfs/dbraw/zinc/09/00/70/546090070.db2.gz VUBSXONRVRZSGH-IXDOHACOSA-N 1 1 352.523 2.230 20 70 FEIDMO O=C(NCCOc1ncccc1Cl)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000161126007 546102520 /nfs/dbraw/zinc/10/25/20/546102520.db2.gz QQOKMIIUJWFDOK-ZDUSSCGKSA-N 1 1 352.866 2.430 20 70 FEIDMO C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)N2CCN(CC3CC3)CC2)CC1 ZINC000161178578 546106890 /nfs/dbraw/zinc/10/68/90/546106890.db2.gz YNQYONHYXIIIDQ-QGZVFWFLSA-N 1 1 371.529 2.344 20 70 FEIDMO COc1cc(C(=O)N2CC[NH+](CCc3ccccc3)CC2)cc(OC)c1O ZINC000161193225 546108073 /nfs/dbraw/zinc/10/80/73/546108073.db2.gz JEPMNQVTCPOMFK-UHFFFAOYSA-N 1 1 370.449 2.410 20 70 FEIDMO CCc1c(C(=O)NCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cnn1CC(C)C ZINC000161374033 546125063 /nfs/dbraw/zinc/12/50/63/546125063.db2.gz UIFYLGJULUFCTO-IYBDPMFKSA-N 1 1 350.507 2.331 20 70 FEIDMO Cc1ccc2cc(C(=O)NCCC[N@@H+]3CCC[C@@H]3C(=O)N(C)C)ccc2n1 ZINC000161386998 546125684 /nfs/dbraw/zinc/12/56/84/546125684.db2.gz YPGJGEBTTRGCDN-LJQANCHMSA-N 1 1 368.481 2.216 20 70 FEIDMO CC[N@@H+](C)C[C@H]1CCN(CC(=O)c2c[nH]c3ccc(C(=O)OC)cc23)C1 ZINC000161418316 546127979 /nfs/dbraw/zinc/12/79/79/546127979.db2.gz VDEJBNXQTAYWFW-CQSZACIVSA-N 1 1 357.454 2.411 20 70 FEIDMO CCc1c(C(=O)NC[C@H](C(C)C)[NH+]2CCOCC2)cnn1CC(C)C ZINC000161464067 546131425 /nfs/dbraw/zinc/13/14/25/546131425.db2.gz FNWDTYWJGVWWGP-GOSISDBHSA-N 1 1 350.507 2.188 20 70 FEIDMO CN1CC[N@@H+](C)C[C@@H]1CNC(=O)c1ccc(Br)c(Cl)c1 ZINC000217816366 548683996 /nfs/dbraw/zinc/68/39/96/548683996.db2.gz UNZJUDOUHCOXDQ-NSHDSACASA-N 1 1 360.683 2.078 20 70 FEIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cc(-c2cccnc2)on1 ZINC000159634305 326937447 /nfs/dbraw/zinc/93/74/47/326937447.db2.gz PRUGQDKSKQLXLG-UHFFFAOYSA-N 1 1 358.442 2.167 20 70 FEIDMO CCc1cc(N2CCC[C@H]2C[NH+]2CCOCC2)nc(-c2ccncc2)n1 ZINC000160386764 326963990 /nfs/dbraw/zinc/96/39/90/326963990.db2.gz PDYWHJHTTDAGFL-SFHVURJKSA-N 1 1 353.470 2.402 20 70 FEIDMO CCCNC(=O)C[NH+]1CCC(NC(=O)[C@@H]2C[C@@H]2c2sccc2C)CC1 ZINC000161476063 327000490 /nfs/dbraw/zinc/00/04/90/327000490.db2.gz IZBLHEDNHGGUNQ-JKSUJKDBSA-N 1 1 363.527 2.267 20 70 FEIDMO C[C@H]1CCN(CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)C[C@@H]1n1ccnc1 ZINC000159384815 545948472 /nfs/dbraw/zinc/94/84/72/545948472.db2.gz ASTICZBPESUJSP-IHPCNDPISA-N 1 1 369.513 2.185 20 70 FEIDMO Cc1cccc(C)c1OCCC[NH+]1CCN(C(=O)c2ccc(=O)[nH]c2)CC1 ZINC000159448198 545953792 /nfs/dbraw/zinc/95/37/92/545953792.db2.gz ZRRGLMIKILIBEO-UHFFFAOYSA-N 1 1 369.465 2.219 20 70 FEIDMO COc1ccc(Cl)c(NC(=O)C(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)c1 ZINC000159456420 545955525 /nfs/dbraw/zinc/95/55/25/545955525.db2.gz ONCPDOKKIGENQX-CYBMUJFWSA-N 1 1 367.877 2.381 20 70 FEIDMO C[N@H+](CC(=O)NCCOc1ccc(C(F)(F)F)cc1)C[C@H]1CCC[C@@H]1O ZINC000159504023 545959674 /nfs/dbraw/zinc/95/96/74/545959674.db2.gz RHPUXPSLFUKLJM-CJNGLKHVSA-N 1 1 374.403 2.293 20 70 FEIDMO Cc1ccc(NC(=O)[C@@H](C)[N@H+](C)CC(C)(CO)CO)c(Br)c1 ZINC000159583773 545964313 /nfs/dbraw/zinc/96/43/13/545964313.db2.gz UFBWMTBHWKSZCX-GFCCVEGCSA-N 1 1 373.291 2.007 20 70 FEIDMO Cc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CC(C)(CO)CO)c(Br)c1 ZINC000159583773 545964316 /nfs/dbraw/zinc/96/43/16/545964316.db2.gz UFBWMTBHWKSZCX-GFCCVEGCSA-N 1 1 373.291 2.007 20 70 FEIDMO Cc1nn(-c2ccccc2)c(C)c1CNC(=O)C[N@@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000159605367 545966372 /nfs/dbraw/zinc/96/63/72/545966372.db2.gz KWYWQHMRBWHVOL-PXNSSMCTSA-N 1 1 370.497 2.198 20 70 FEIDMO CCN(CC)C(=O)c1ccc(CNC(=O)N2CCC[N@@H+](CC)CC2)cc1 ZINC000159602616 545966544 /nfs/dbraw/zinc/96/65/44/545966544.db2.gz GNBXZNZZXGZXNP-UHFFFAOYSA-N 1 1 360.502 2.406 20 70 FEIDMO CCN(CC)C(=O)c1cccc(NC(=O)C[N@@H+](C)C[C@H]2CCC[C@@H]2O)c1 ZINC000159656825 545970300 /nfs/dbraw/zinc/97/03/00/545970300.db2.gz NWLBNPNCPFEDNI-AEFFLSMTSA-N 1 1 361.486 2.200 20 70 FEIDMO CC[N@H+]1CCCN(C(=O)NCc2cccc(CN3CCO[C@H](C)C3)c2)CC1 ZINC000159753211 545977538 /nfs/dbraw/zinc/97/75/38/545977538.db2.gz RKQGHGBICNDUSD-GOSISDBHSA-N 1 1 374.529 2.145 20 70 FEIDMO C[N@H+](CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2)C[C@@H]1CCC[C@@H]1O ZINC000159838543 545985227 /nfs/dbraw/zinc/98/52/27/545985227.db2.gz PZUZZOSUDOHWPO-KSZLIROESA-N 1 1 374.481 2.214 20 70 FEIDMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)N1CCC(C2OCCO2)CC1 ZINC000159989976 545997896 /nfs/dbraw/zinc/99/78/96/545997896.db2.gz RBNZKDJCHKQWBB-APWZRJJASA-N 1 1 373.497 2.301 20 70 FEIDMO CCC[N@H+]1CC[C@H](CNC(=O)N2CCC[C@H](c3nnc(C4CC4)[nH]3)C2)C1 ZINC000160065443 546004447 /nfs/dbraw/zinc/00/44/47/546004447.db2.gz MQHPONVIZDFXOE-ZBFHGGJFSA-N 1 1 360.506 2.303 20 70 FEIDMO CCC[N@@H+]1CC[C@H](CNC(=O)N2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)C1 ZINC000160065443 546004448 /nfs/dbraw/zinc/00/44/48/546004448.db2.gz MQHPONVIZDFXOE-ZBFHGGJFSA-N 1 1 360.506 2.303 20 70 FEIDMO CCC[N@H+]1CC[C@H](CNC(=O)N2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)C1 ZINC000160065443 546004449 /nfs/dbraw/zinc/00/44/49/546004449.db2.gz MQHPONVIZDFXOE-ZBFHGGJFSA-N 1 1 360.506 2.303 20 70 FEIDMO CC(=O)N1CCc2cc(C(=O)N(C)CC(C)(C)C[NH+]3CCOCC3)ccc21 ZINC000160235871 546020597 /nfs/dbraw/zinc/02/05/97/546020597.db2.gz RSXVLBPSIAVVNC-UHFFFAOYSA-N 1 1 373.497 2.026 20 70 FEIDMO COCc1cc(N[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)n2ncnc2n1 ZINC000160248408 546021683 /nfs/dbraw/zinc/02/16/83/546021683.db2.gz AUMLKHBBUHPQRM-YOEHRIQHSA-N 1 1 352.442 2.203 20 70 FEIDMO Cc1cc(Cl)ccc1C(=O)NCCC[N@@H+]1CCC[C@H]1C(=O)N(C)C ZINC000160369429 546033586 /nfs/dbraw/zinc/03/35/86/546033586.db2.gz DJEIJCOMOPCCMP-INIZCTEOSA-N 1 1 351.878 2.321 20 70 FEIDMO Cc1nn(C)c(C)c1-c1cc(C(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)[nH]n1 ZINC000160440387 546040849 /nfs/dbraw/zinc/04/08/49/546040849.db2.gz WDOFUFMJEYUBPH-OAHLLOKOSA-N 1 1 358.490 2.277 20 70 FEIDMO C[C@@H]1C[C@@H](CNC(=O)Nc2cccn(C)c2=O)C[N@H+]1Cc1ccccc1 ZINC000160480293 546045366 /nfs/dbraw/zinc/04/53/66/546045366.db2.gz OJTCRYPGKOUIFU-WBVHZDCISA-N 1 1 354.454 2.417 20 70 FEIDMO C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC(=O)c1cnc2c(c1)ncn2C ZINC000160535100 546050066 /nfs/dbraw/zinc/05/00/66/546050066.db2.gz YVFYUHAKSXWDPE-PBHICJAKSA-N 1 1 364.453 2.004 20 70 FEIDMO Cc1ncc(/C=C/C(=O)NC[C@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)s1 ZINC000160603942 546056067 /nfs/dbraw/zinc/05/60/67/546056067.db2.gz ROOMPDIMIKLDRC-PWHGLLLSSA-N 1 1 357.479 2.216 20 70 FEIDMO CCCn1nc(C)c(C(=O)NC[C@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)c1C ZINC000160615609 546056984 /nfs/dbraw/zinc/05/69/84/546056984.db2.gz YRDLJKGYYXKWHW-RTBURBONSA-N 1 1 370.497 2.275 20 70 FEIDMO CC(C)[C@H](C)NC(=O)C1CCN(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)CC1 ZINC000160688909 546063975 /nfs/dbraw/zinc/06/39/75/546063975.db2.gz BRGZCYURZQLYEB-MAUKXSAKSA-N 1 1 364.534 2.053 20 70 FEIDMO O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)N1CCN(C(=O)c2ccccc2)CC1 ZINC000160779767 546071442 /nfs/dbraw/zinc/07/14/42/546071442.db2.gz GZLAYBBHAKHWFJ-SFHVURJKSA-N 1 1 370.497 2.171 20 70 FEIDMO CCOCCC[N@H+]1CC[C@H](NC(=O)N(C)Cc2cccn2C)[C@H](C)C1 ZINC000160859726 546078999 /nfs/dbraw/zinc/07/89/99/546078999.db2.gz MRHVMBDIOHCZCF-AEFFLSMTSA-N 1 1 350.507 2.304 20 70 FEIDMO CCNC(=O)C(C)(C)CNC(=O)N(CC)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160858736 546079238 /nfs/dbraw/zinc/07/92/38/546079238.db2.gz HAGMYOWCMAKTBO-GOSISDBHSA-N 1 1 374.529 2.455 20 70 FEIDMO O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)N1CCNC(=O)C[C@@H]1c1ccccc1 ZINC000160878681 546080772 /nfs/dbraw/zinc/08/07/72/546080772.db2.gz ZIZPEHUKTYPNRT-IEBWSBKVSA-N 1 1 370.497 2.276 20 70 FEIDMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)NCc1cn(C)nc1C(F)(F)F ZINC000160890367 546081206 /nfs/dbraw/zinc/08/12/06/546081206.db2.gz QMYAUPXRQGIBDM-CYBMUJFWSA-N 1 1 361.412 2.455 20 70 FEIDMO Cc1c(CNC(=O)NC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)cnn1C ZINC000161029709 546093545 /nfs/dbraw/zinc/09/35/45/546093545.db2.gz UOFSBSVHRLSRAF-SFHVURJKSA-N 1 1 355.486 2.092 20 70 FEIDMO O=C(NCCOc1ccc(Cl)cn1)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000161122819 546101994 /nfs/dbraw/zinc/10/19/94/546101994.db2.gz HAQUCYYPCKYSQE-AWEZNQCLSA-N 1 1 352.866 2.430 20 70 FEIDMO Cc1c(C(=O)NC2CCN(C3CC[NH+](C)CC3)CC2)cnn1CC(C)C ZINC000161144827 546103809 /nfs/dbraw/zinc/10/38/09/546103809.db2.gz IJQJHPUACRZYQQ-UHFFFAOYSA-N 1 1 361.534 2.136 20 70 FEIDMO CCOC(=O)c1c(C)oc2nc(C[N@H+](CCCCO)C3CC3)nc(N)c21 ZINC000161223199 546111041 /nfs/dbraw/zinc/11/10/41/546111041.db2.gz FUOLPVAWAITKEZ-UHFFFAOYSA-N 1 1 362.430 2.027 20 70 FEIDMO CCOC(=O)c1c(C)oc2nc(C[N@@H+](CCCCO)C3CC3)nc(N)c21 ZINC000161223199 546111044 /nfs/dbraw/zinc/11/10/44/546111044.db2.gz FUOLPVAWAITKEZ-UHFFFAOYSA-N 1 1 362.430 2.027 20 70 FEIDMO CC[N@H+]1CCCC[C@@H]1CNC(=O)C(=O)Nc1cnn(-c2ccccc2)c1C ZINC000161263438 546115089 /nfs/dbraw/zinc/11/50/89/546115089.db2.gz QXPDVAPWDZZKQU-QGZVFWFLSA-N 1 1 369.469 2.110 20 70 FEIDMO CCC(=O)N1CC[C@@H](C(=O)N2CCC[N@@H+](CCCc3ccccc3)CC2)C1 ZINC000161370575 546124145 /nfs/dbraw/zinc/12/41/45/546124145.db2.gz VVOJQWBEDSWILG-HXUWFJFHSA-N 1 1 371.525 2.412 20 70 FEIDMO Cc1ccc(S(N)(=O)=O)cc1NC(=O)C[N@H+](C)[C@H]1CCC[C@H](C)C1 ZINC000161416473 546127943 /nfs/dbraw/zinc/12/79/43/546127943.db2.gz YNJQWUCNRMDLPQ-JSGCOSHPSA-N 1 1 353.488 2.091 20 70 FEIDMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H]1CCCN(c2ccccn2)C1 ZINC000161408219 546128056 /nfs/dbraw/zinc/12/80/56/546128056.db2.gz KZUUIIJOZJCUIX-WBVHZDCISA-N 1 1 356.474 2.191 20 70 FEIDMO Cc1c[nH]c(=O)n1-c1ccc([C@H](C)[NH2+][C@H](C(N)=O)c2ccccc2)cc1 ZINC000159877848 326945347 /nfs/dbraw/zinc/94/53/47/326945347.db2.gz JGSHVPRPKDIWOH-KSSFIOAISA-N 1 1 350.422 2.351 20 70 FEIDMO O=C(NC1CC[NH+](Cc2ccc(F)c(F)c2)CC1)C1(O)CCSCC1 ZINC000160139042 326954773 /nfs/dbraw/zinc/95/47/73/326954773.db2.gz PTTGIUOBBPHZTJ-UHFFFAOYSA-N 1 1 370.465 2.304 20 70 FEIDMO CCO[C@@H]1C[C@@H](N(C)C(=O)NC[C@@H](C(C)C)[NH+]2CCOCC2)C12CCC2 ZINC000160891603 326981187 /nfs/dbraw/zinc/98/11/87/326981187.db2.gz XFUSKJAYRIYBOV-RCCFBDPRSA-N 1 1 367.534 2.332 20 70 FEIDMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1 ZINC000159388114 545948648 /nfs/dbraw/zinc/94/86/48/545948648.db2.gz FGHOZGLKCXLNFD-RBSFLKMASA-N 1 1 363.893 2.192 20 70 FEIDMO CCOc1ccc(NC(=O)C(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)c(C)c1 ZINC000159471588 545956293 /nfs/dbraw/zinc/95/62/93/545956293.db2.gz LSXICLFJOOFOFZ-MRXNPFEDSA-N 1 1 361.486 2.426 20 70 FEIDMO COC(=O)C1(N(C)C/C=C/C[N@H+](C)C2(C(=O)OC)CCCC2)CCCC1 ZINC000159477113 545957646 /nfs/dbraw/zinc/95/76/46/545957646.db2.gz YKBXTNGFOHMIKI-MDZDMXLPSA-N 1 1 366.502 2.378 20 70 FEIDMO COC(=O)C1(N(C)C/C=C/C[N@@H+](C)C2(C(=O)OC)CCCC2)CCCC1 ZINC000159477113 545957648 /nfs/dbraw/zinc/95/76/48/545957648.db2.gz YKBXTNGFOHMIKI-MDZDMXLPSA-N 1 1 366.502 2.378 20 70 FEIDMO CCC[C@H]1CN(C(=O)NC[C@@H](C(CC)CC)[NH+]2CCOCC2)CCO1 ZINC000159502238 545959162 /nfs/dbraw/zinc/95/91/62/545959162.db2.gz JDOINFMWENYEJE-ROUUACIJSA-N 1 1 355.523 2.334 20 70 FEIDMO C[C@@H]1C[C@H](CNC(=O)CS(=O)(=O)C(C)(C)C)C[N@H+]1Cc1ccccc1 ZINC000159606275 545966589 /nfs/dbraw/zinc/96/65/89/545966589.db2.gz NMNAXKKTRLFWMA-NVXWUHKLSA-N 1 1 366.527 2.227 20 70 FEIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cc(Br)c[nH]1 ZINC000159638492 545969547 /nfs/dbraw/zinc/96/95/47/545969547.db2.gz AQSSAARLIOWJBD-UHFFFAOYSA-N 1 1 358.280 2.208 20 70 FEIDMO CCCCn1ncc(NC(=O)NC[C@@H](C)CN2CC[NH+](CC)CC2)c1C ZINC000159788855 545980498 /nfs/dbraw/zinc/98/04/98/545980498.db2.gz VYLUGQIWKSMGOS-MRXNPFEDSA-N 1 1 364.538 2.387 20 70 FEIDMO CCN1CC[NH+](CCC(=O)NC[C@H]2C[C@@]23CCCc2ccccc23)CC1 ZINC000159865255 545987696 /nfs/dbraw/zinc/98/76/96/545987696.db2.gz KUTPQLUUGZHGFK-KNQAVFIVSA-N 1 1 355.526 2.424 20 70 FEIDMO CCN(C(=O)NCCNC(=O)C(C)(C)C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000159888438 545989531 /nfs/dbraw/zinc/98/95/31/545989531.db2.gz FVLRZETWLLMXED-SFHVURJKSA-N 1 1 374.529 2.455 20 70 FEIDMO CCC(CC)[C@H](CNC(=O)c1cccc(-c2nc[nH]n2)c1)[NH+]1CCOCC1 ZINC000160054725 546003345 /nfs/dbraw/zinc/00/33/45/546003345.db2.gz RSWAHZTXCCVEHB-SFHVURJKSA-N 1 1 371.485 2.339 20 70 FEIDMO CC(C)OC(=O)CCCNC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000160050602 546003729 /nfs/dbraw/zinc/00/37/29/546003729.db2.gz JBHWBXXMKHGFJZ-DOTOQJQBSA-N 1 1 351.491 2.377 20 70 FEIDMO CCc1noc(C)c1NC(=O)C(=O)NCCC[N@H+]1CCc2ccccc2C1 ZINC000160076836 546005509 /nfs/dbraw/zinc/00/55/09/546005509.db2.gz GZLBCMRMCFJIGM-UHFFFAOYSA-N 1 1 370.453 2.049 20 70 FEIDMO Cc1cccc([C@@H]2CCCN2C(=O)NCCCCN2CC[NH+](C)CC2)n1 ZINC000160078895 546005760 /nfs/dbraw/zinc/00/57/60/546005760.db2.gz BCMRRCNCYRXQHN-IBGZPJMESA-N 1 1 359.518 2.264 20 70 FEIDMO CCOC(=O)[C@@H]1CCCN(C(=O)C[N@@H+]2CCC[C@@H]2c2cccc(C)n2)C1 ZINC000160087937 546006425 /nfs/dbraw/zinc/00/64/25/546006425.db2.gz KZFSHUIXNRKSAR-SJLPKXTDSA-N 1 1 359.470 2.329 20 70 FEIDMO CCOC(=O)[C@@H]1CCCN(C(=O)C[N@H+]2CCC[C@@H]2c2cccc(C)n2)C1 ZINC000160087937 546006429 /nfs/dbraw/zinc/00/64/29/546006429.db2.gz KZFSHUIXNRKSAR-SJLPKXTDSA-N 1 1 359.470 2.329 20 70 FEIDMO C[C@@H]1C[C@H](NC(=O)NC[C@](C)(O)c2ccco2)C[N@H+]1Cc1ccccc1 ZINC000160109369 546007840 /nfs/dbraw/zinc/00/78/40/546007840.db2.gz CWJYVYIPRUHSTP-SYNHAJSKSA-N 1 1 357.454 2.449 20 70 FEIDMO C[N@@H+]1CCN(C(=O)CCCNC(=O)c2cccnc2)[C@@H](c2ccccc2)C1 ZINC000160171539 546013240 /nfs/dbraw/zinc/01/32/40/546013240.db2.gz 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Cc1cccc(C)c1NC(=O)C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1 ZINC000160269598 546024051 /nfs/dbraw/zinc/02/40/51/546024051.db2.gz OYFXULKDKKSFQT-UHFFFAOYSA-N 1 1 361.486 2.059 20 70 FEIDMO C[NH+](C)[C@@H](CNC(=O)CN[C@H](CCO)c1ccccc1)c1ccccc1 ZINC000160293351 546026690 /nfs/dbraw/zinc/02/66/90/546026690.db2.gz ZBTNHHZKHAQLKD-UXHICEINSA-N 1 1 355.482 2.119 20 70 FEIDMO Cc1noc2nc(C)cc(C(=O)N(C)CC(C)(C)C[NH+]3CCOCC3)c12 ZINC000160315314 546029854 /nfs/dbraw/zinc/02/98/54/546029854.db2.gz KDSJFTVCKVWTBS-UHFFFAOYSA-N 1 1 360.458 2.270 20 70 FEIDMO CSC[C@@H](C)NC(=O)N(C)CC[NH+]1CCN(c2ccccc2)CC1 ZINC000160425882 546039966 /nfs/dbraw/zinc/03/99/66/546039966.db2.gz XORGKJJCKMNQCX-MRXNPFEDSA-N 1 1 350.532 2.202 20 70 FEIDMO CC[N@H+]1CCCN(C(=O)[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)CC1 ZINC000160424254 546040020 /nfs/dbraw/zinc/04/00/20/546040020.db2.gz VFBHNCSIYONYIH-CYBMUJFWSA-N 1 1 367.852 2.386 20 70 FEIDMO COCCNc1nc(N(C)Cc2ccco2)nc(N(C)Cc2ccco2)[nH+]1 ZINC000160439685 546040677 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ZINC000161237291 546112717 /nfs/dbraw/zinc/11/27/17/546112717.db2.gz GCYMDMRKNVSCMX-UHFFFAOYSA-N 1 1 353.488 2.091 20 70 FEIDMO C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)C(=O)Nc1ccc(F)nc1 ZINC000161371697 546124728 /nfs/dbraw/zinc/12/47/28/546124728.db2.gz ORKAJTCBLIWKHS-HNNXBMFYSA-N 1 1 370.428 2.282 20 70 FEIDMO C[NH+](C)[C@H](CNC(=O)N[C@H]1CCCN(c2ccccn2)C1)c1ccco1 ZINC000159783797 326941718 /nfs/dbraw/zinc/94/17/18/326941718.db2.gz NBKWIOXXDROMOM-JKSUJKDBSA-N 1 1 357.458 2.246 20 70 FEIDMO Cc1ccc(NC(=O)[C@@H]([NH2+]C[C@@H]2CC[C@H](C(N)=O)O2)c2ccccc2)cc1 ZINC000160786024 326977261 /nfs/dbraw/zinc/97/72/61/326977261.db2.gz ACCICZUQIUUFBA-OTWHNJEPSA-N 1 1 367.449 2.297 20 70 FEIDMO Cc1ccc(S(N)(=O)=O)cc1NC(=O)C[N@@H+](C)[C@H](C)c1cccs1 ZINC000161475078 327000373 /nfs/dbraw/zinc/00/03/73/327000373.db2.gz JNSUIJTYUABJFN-GFCCVEGCSA-N 1 1 367.496 2.335 20 70 FEIDMO Cc1ccc(S(N)(=O)=O)cc1NC(=O)C[N@H+](C)[C@H](C)c1cccs1 ZINC000161475078 327000375 /nfs/dbraw/zinc/00/03/75/327000375.db2.gz 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C[C@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[N@@H+](C)Cc1cccc(N(C)C)c1 ZINC000159846708 545985997 /nfs/dbraw/zinc/98/59/97/545985997.db2.gz RCWQNVDSKQPKTG-CYBMUJFWSA-N 1 1 367.453 2.381 20 70 FEIDMO COC(=O)C1CCN(C(=O)N[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000159943010 545993861 /nfs/dbraw/zinc/99/38/61/545993861.db2.gz DEDHNOHDPLORTJ-QAPCUYQASA-N 1 1 359.470 2.102 20 70 FEIDMO C[C@H]1C[NH+](Cc2ccccc2)C[C@@H]1NC(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000159957702 545994632 /nfs/dbraw/zinc/99/46/32/545994632.db2.gz QNIQGOYSOSBPDD-SXLOBPIMSA-N 1 1 358.530 2.490 20 70 FEIDMO CC(C)OC(=O)CCCNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000160050736 546003400 /nfs/dbraw/zinc/00/34/00/546003400.db2.gz JBHWBXXMKHGFJZ-RDJZCZTQSA-N 1 1 351.491 2.377 20 70 FEIDMO C[C@H]1C[C@H](NC(=O)N2CCN(CC(F)F)CC2)C[N@H+]1Cc1ccccc1 ZINC000160073347 546005773 /nfs/dbraw/zinc/00/57/73/546005773.db2.gz AHRMSXCAKHCLRJ-RDJZCZTQSA-N 1 1 366.456 2.242 20 70 FEIDMO Cc1conc1NC(=O)C(=O)NCc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 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350.463 2.111 20 70 FEIDMO C[C@@H](NCC(=O)NC[C@H](c1ccccc1)[NH+](C)C)c1ccc2c(c1)OCO2 ZINC000160286649 546025656 /nfs/dbraw/zinc/02/56/56/546025656.db2.gz MVZYHDBDOJEMKI-CRAIPNDOSA-N 1 1 369.465 2.485 20 70 FEIDMO C[NH+](C)[C@@H](CNC(=O)CN[C@@H](CCO)c1ccccc1)c1ccccc1 ZINC000160293102 546026626 /nfs/dbraw/zinc/02/66/26/546026626.db2.gz ZBTNHHZKHAQLKD-PMACEKPBSA-N 1 1 355.482 2.119 20 70 FEIDMO C[C@@H](CNC(=O)NCc1ccccc1OC1CCC1)C[NH+]1CCOCC1 ZINC000160335951 546031440 /nfs/dbraw/zinc/03/14/40/546031440.db2.gz MCXMECZZWPDRSQ-INIZCTEOSA-N 1 1 361.486 2.385 20 70 FEIDMO c1ccc(-c2nnc3ccc(N4CCC[C@H]4C[NH+]4CCOCC4)nn32)cc1 ZINC000160391344 546036291 /nfs/dbraw/zinc/03/62/91/546036291.db2.gz ZLNYEMZAMILMGS-KRWDZBQOSA-N 1 1 364.453 2.092 20 70 FEIDMO CNC(=O)c1cccc(CCC(=O)NCC[N@@H+](C)Cc2ccccc2)c1 ZINC000160677722 546062754 /nfs/dbraw/zinc/06/27/54/546062754.db2.gz XLMQFOGOMRBMMD-UHFFFAOYSA-N 1 1 353.466 2.227 20 70 FEIDMO CCS(=O)(=O)Nc1ccc(NC(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)cc1 ZINC000160715928 546066079 /nfs/dbraw/zinc/06/60/79/546066079.db2.gz UNFATGMVQXXZRT-MRXNPFEDSA-N 1 1 366.487 2.054 20 70 FEIDMO C[C@@]1(CNc2ncccc2S(N)(=O)=O)CCC[N@H+]1Cc1ccccc1 ZINC000160805094 546074337 /nfs/dbraw/zinc/07/43/37/546074337.db2.gz HNVSDEDKOVGLFQ-SFHVURJKSA-N 1 1 360.483 2.196 20 70 FEIDMO CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1 ZINC000160829869 546076065 /nfs/dbraw/zinc/07/60/65/546076065.db2.gz QVVWEELAHDKSAV-MJGOQNOKSA-N 1 1 372.513 2.002 20 70 FEIDMO C[C@H]1CCCC[N@H+]1CCC1CCN(C(=O)NCC(=O)N2CCCC2)CC1 ZINC000160875792 546080188 /nfs/dbraw/zinc/08/01/88/546080188.db2.gz GRZLUCSOJZPWOA-KRWDZBQOSA-N 1 1 364.534 2.295 20 70 FEIDMO CCOC(=O)c1c(C)oc2nc(C[N@@H+]3CCCC[C@@H]3[C@@H](C)O)nc(N)c21 ZINC000161000297 546091445 /nfs/dbraw/zinc/09/14/45/546091445.db2.gz MPUKXPOEKYTVTO-ZYHUDNBSSA-N 1 1 362.430 2.025 20 70 FEIDMO CCOC(=O)c1c(C)oc2nc(C[N@H+]3CCCC[C@@H]3[C@@H](C)O)nc(N)c21 ZINC000161000297 546091449 /nfs/dbraw/zinc/09/14/49/546091449.db2.gz MPUKXPOEKYTVTO-ZYHUDNBSSA-N 1 1 362.430 2.025 20 70 FEIDMO Cc1conc1NC(=O)C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000161140853 546103735 /nfs/dbraw/zinc/10/37/35/546103735.db2.gz YPBMDSFBOQNTHU-ALOPSCKCSA-N 1 1 368.437 2.233 20 70 FEIDMO Cc1conc1NC(=O)C(=O)NC[C@@H]1CCC[N@H+](C)[C@@H]1c1cccs1 ZINC000161386062 546125851 /nfs/dbraw/zinc/12/58/51/546125851.db2.gz SLHOHFJMWSYWAU-JSGCOSHPSA-N 1 1 362.455 2.182 20 70 FEIDMO Cc1cccc(OCCNC(=O)CN2CC[N@@H+](C)C[C@@H]2c2ccccc2)c1 ZINC000216739151 548678967 /nfs/dbraw/zinc/67/89/67/548678967.db2.gz CMXGRTUPWASNOI-OAQYLSRUSA-N 1 1 367.493 2.479 20 70 FEIDMO Cc1cccc(OCCNC(=O)CN2CC[N@H+](C)C[C@@H]2c2ccccc2)c1 ZINC000216739151 548678969 /nfs/dbraw/zinc/67/89/69/548678969.db2.gz CMXGRTUPWASNOI-OAQYLSRUSA-N 1 1 367.493 2.479 20 70 FEIDMO CCC(CC)[C@H](CNC(=O)N1CCOC2(CCCC2)C1)[NH+]1CCOCC1 ZINC000159424799 326931374 /nfs/dbraw/zinc/93/13/74/326931374.db2.gz OMIQVYSLVLKGIZ-SFHVURJKSA-N 1 1 367.534 2.478 20 70 FEIDMO Cc1nnc(-c2ccccc2C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)o1 ZINC000159617819 326936949 /nfs/dbraw/zinc/93/69/49/326936949.db2.gz WLVSCUNTWQKCLU-UHFFFAOYSA-N 1 1 372.469 2.475 20 70 FEIDMO O=C(c1ccc(C[NH+]2CCC(CO)CC2)cc1)N1CCN(CC2CC2)CC1 ZINC000160124873 326954173 /nfs/dbraw/zinc/95/41/73/326954173.db2.gz ZWWBVXPHJLMLCC-UHFFFAOYSA-N 1 1 371.525 2.059 20 70 FEIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)CSCc1cccnc1 ZINC000160242583 326958432 /nfs/dbraw/zinc/95/84/32/326958432.db2.gz WQPMOKOQFSNGGN-UHFFFAOYSA-N 1 1 351.516 2.132 20 70 FEIDMO Cc1ccc(C)c(CC(=O)NC[C@@H](O)C[N@H+]2CCc3ccccc3C2)c1 ZINC000159375567 545947703 /nfs/dbraw/zinc/94/77/03/545947703.db2.gz MQFIZJYJKAXUEN-OAQYLSRUSA-N 1 1 352.478 2.381 20 70 FEIDMO CCn1c(=O)c2cc(F)ccc2nc1SCCC[NH+]1CCOCC1 ZINC000159390675 545950045 /nfs/dbraw/zinc/95/00/45/545950045.db2.gz PNHBFNCUEMJNCV-UHFFFAOYSA-N 1 1 351.447 2.370 20 70 FEIDMO COCCOc1ccc(C[N@H+]2CCCC[C@H]2CCNS(C)(=O)=O)cc1 ZINC000159451291 545955420 /nfs/dbraw/zinc/95/54/20/545955420.db2.gz DOWCRIXYQDJMFU-KRWDZBQOSA-N 1 1 370.515 2.006 20 70 FEIDMO COc1ccc(-n2c(C[N@H+](C)CC(C)(CO)CO)nc3ccccc32)cc1 ZINC000159530951 545960817 /nfs/dbraw/zinc/96/08/17/545960817.db2.gz RQECEWBJQGEFCU-UHFFFAOYSA-N 1 1 369.465 2.457 20 70 FEIDMO COc1ccc(-n2c(C[N@@H+](C)CC(C)(CO)CO)nc3ccccc32)cc1 ZINC000159530951 545960821 /nfs/dbraw/zinc/96/08/21/545960821.db2.gz RQECEWBJQGEFCU-UHFFFAOYSA-N 1 1 369.465 2.457 20 70 FEIDMO Cc1nn(C)c(=O)c(-c2nc(C[N@H+](C)C[C@@H]3CCC[C@@H]3O)cs2)c1C ZINC000159730238 545975860 /nfs/dbraw/zinc/97/58/60/545975860.db2.gz BIBMFLOGTRVZRH-ZFWWWQNUSA-N 1 1 362.499 2.113 20 70 FEIDMO Cc1nn(C)c(=O)c(-c2nc(C[N@@H+](C)C[C@@H]3CCC[C@@H]3O)cs2)c1C ZINC000159730238 545975865 /nfs/dbraw/zinc/97/58/65/545975865.db2.gz BIBMFLOGTRVZRH-ZFWWWQNUSA-N 1 1 362.499 2.113 20 70 FEIDMO CC[NH+]1CCN(C[C@H](C)CNC(=O)N2CCc3cccc(F)c3C2)CC1 ZINC000159747623 545978012 /nfs/dbraw/zinc/97/80/12/545978012.db2.gz ALUYPDBYKVEBEZ-MRXNPFEDSA-N 1 1 362.493 2.167 20 70 FEIDMO CCC(=O)N1CCCN(C(=O)N[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000159866027 545987189 /nfs/dbraw/zinc/98/71/89/545987189.db2.gz VCXZRPQRMZIGPH-MJGOQNOKSA-N 1 1 372.513 2.303 20 70 FEIDMO CCCNC(=O)[C@H]1CCC[N@H+](Cc2nnc(-c3ccccc3OC)o2)C1 ZINC000159877886 545988558 /nfs/dbraw/zinc/98/85/58/545988558.db2.gz ZAIKWCYSFYSDOE-AWEZNQCLSA-N 1 1 358.442 2.483 20 70 FEIDMO CCCNC(=O)[C@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3OC)o2)C1 ZINC000159877886 545988562 /nfs/dbraw/zinc/98/85/62/545988562.db2.gz ZAIKWCYSFYSDOE-AWEZNQCLSA-N 1 1 358.442 2.483 20 70 FEIDMO CCc1noc(C)c1NC(=O)C(=O)NCCCC[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000160085003 546005681 /nfs/dbraw/zinc/00/56/81/546005681.db2.gz UUDAXWAECZEQTR-OKILXGFUSA-N 1 1 364.490 2.358 20 70 FEIDMO CC(C)OCC[NH+]1CCN([C@H]2CCCN(c3ccccc3F)C2=O)CC1 ZINC000160130181 546010319 /nfs/dbraw/zinc/01/03/19/546010319.db2.gz SNIUAFDEJKRRCB-IBGZPJMESA-N 1 1 363.477 2.364 20 70 FEIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cccc(NC(=O)C2CC2)c1 ZINC000160287195 546025337 /nfs/dbraw/zinc/02/53/37/546025337.db2.gz QHOUSVNAQFPKMS-UHFFFAOYSA-N 1 1 373.497 2.466 20 70 FEIDMO CNC(=O)CC1CCN(C(=O)N[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)CC1 ZINC000160334409 546030235 /nfs/dbraw/zinc/03/02/35/546030235.db2.gz LHKQHIGIRMOVLN-APWZRJJASA-N 1 1 372.513 2.207 20 70 FEIDMO COCC[NH+]1CCN(C(=O)NCc2cccc(-c3ccccn3)c2)CC1 ZINC000160361722 546033925 /nfs/dbraw/zinc/03/39/25/546033925.db2.gz PAXDLMRQOAIDGY-UHFFFAOYSA-N 1 1 354.454 2.222 20 70 FEIDMO C[C@@H]1C[C@H](NC(=O)N2CCC3(CC2)OCCO3)C[N@H+]1Cc1ccccc1 ZINC000160383721 546034752 /nfs/dbraw/zinc/03/47/52/546034752.db2.gz VRMVZDLIZRWMOL-AEFFLSMTSA-N 1 1 359.470 2.198 20 70 FEIDMO CC[C@@H](NC(=O)NCC1(C)COC1)[C@H]1C[N@H+](Cc2ccccc2)CCO1 ZINC000160424213 546039302 /nfs/dbraw/zinc/03/93/02/546039302.db2.gz LELLOXJNKCLHRT-QZTJIDSGSA-N 1 1 361.486 2.002 20 70 FEIDMO CC[C@@H](NC(=O)NCC1(C)COC1)[C@H]1C[N@@H+](Cc2ccccc2)CCO1 ZINC000160424213 546039308 /nfs/dbraw/zinc/03/93/08/546039308.db2.gz LELLOXJNKCLHRT-QZTJIDSGSA-N 1 1 361.486 2.002 20 70 FEIDMO CCc1noc(C)c1NC(=O)C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000160562140 546052391 /nfs/dbraw/zinc/05/23/91/546052391.db2.gz MVCWGWVMTMWUPL-CYBMUJFWSA-N 1 1 358.442 2.121 20 70 FEIDMO Cc1ccc(S(=O)(=O)CCC(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)cc1 ZINC000160604201 546055973 /nfs/dbraw/zinc/05/59/73/546055973.db2.gz GBMAPLFMWHKAKV-QGZVFWFLSA-N 1 1 366.527 2.395 20 70 FEIDMO CC(C)S(=O)(=O)CCC[NH+]1CCC(NC(=O)c2ccccc2)CC1 ZINC000160616419 546056738 /nfs/dbraw/zinc/05/67/38/546056738.db2.gz UIGVMLZZSRPNHR-UHFFFAOYSA-N 1 1 352.500 2.094 20 70 FEIDMO CCc1nc2c(s1)[C@H](N(C)C(=O)NCCC[NH+]1CCOCC1)CCC2 ZINC000160643807 546058609 /nfs/dbraw/zinc/05/86/09/546058609.db2.gz QRBFXSVIMUQHTA-OAHLLOKOSA-N 1 1 366.531 2.447 20 70 FEIDMO O=C(CCOc1ccccc1)NC[C@H]1C[C@H](O)C[N@@H+]1Cc1ccccc1 ZINC000160710585 546065078 /nfs/dbraw/zinc/06/50/78/546065078.db2.gz MOTLARGYSMQQAR-MOPGFXCFSA-N 1 1 354.450 2.207 20 70 FEIDMO CN(C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1)[C@@H]1CCCN(c2ccccc2)C1=O ZINC000160724040 546066260 /nfs/dbraw/zinc/06/62/60/546066260.db2.gz PDTRWRUODGRMDG-IEBWSBKVSA-N 1 1 370.497 2.308 20 70 FEIDMO Cc1cncc(/C=C/C(=O)NC[C@@H]2C[C@@H](O)C[N@H+]2Cc2ccccc2)c1 ZINC000160751378 546068876 /nfs/dbraw/zinc/06/88/76/546068876.db2.gz IDXCGTZKWFDUBD-OYQYDDJWSA-N 1 1 351.450 2.155 20 70 FEIDMO Cc1conc1NC(=O)C(=O)NC[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000160812520 546074890 /nfs/dbraw/zinc/07/48/90/546074890.db2.gz QTQONQAGCASUDJ-MRXNPFEDSA-N 1 1 356.426 2.092 20 70 FEIDMO CC(C)c1nc2n(n1)C[C@H](NC(=O)N[C@H]1CC[N@H+](C3CCCC3)C1)CC2 ZINC000160856929 546078966 /nfs/dbraw/zinc/07/89/66/546078966.db2.gz XCBITGDYCHQRKE-CABCVRRESA-N 1 1 360.506 2.032 20 70 FEIDMO C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2csc(S(C)(=O)=O)c2)C1 ZINC000160885156 546081423 /nfs/dbraw/zinc/08/14/23/546081423.db2.gz UMLJTXAFDIWNMH-LBPRGKRZSA-N 1 1 358.529 2.392 20 70 FEIDMO CC[NH+]1CCN(CCCCNC(=O)Nc2cc(C(=O)OC)cs2)CC1 ZINC000160932097 546085538 /nfs/dbraw/zinc/08/55/38/546085538.db2.gz LPZFKTMCSDIFBC-UHFFFAOYSA-N 1 1 368.503 2.074 20 70 FEIDMO CCC[C@H]1CN(C(=O)Nc2ccc(C)c(C(N)=O)c2)CC[N@H+]1CCOC ZINC000161024902 546093226 /nfs/dbraw/zinc/09/32/26/546093226.db2.gz SRZYWYAPVOCXRP-INIZCTEOSA-N 1 1 362.474 2.059 20 70 FEIDMO CCOC(=O)C1CCN(C(=O)[C@H](C)[NH2+][C@@H](CC)c2nccs2)CC1 ZINC000161089620 546098212 /nfs/dbraw/zinc/09/82/12/546098212.db2.gz VPDIJEGTZMDRKI-JSGCOSHPSA-N 1 1 353.488 2.374 20 70 FEIDMO Cc1ccc(C(=O)NCCC[NH+]2CCN(C)CC2)c(Br)c1 ZINC000161150261 546105320 /nfs/dbraw/zinc/10/53/20/546105320.db2.gz VGPFXBOZKYRMNO-UHFFFAOYSA-N 1 1 354.292 2.125 20 70 FEIDMO CC(=O)N[C@H](CC(=O)NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc(F)cc1F ZINC000161341784 546121027 /nfs/dbraw/zinc/12/10/27/546121027.db2.gz RWKVUTPKLXWSHZ-FZKQIMNGSA-N 1 1 365.424 2.133 20 70 FEIDMO CC[C@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N1CC[NH+](C2CC2)CC1 ZINC000161426463 546128576 /nfs/dbraw/zinc/12/85/76/546128576.db2.gz FXQMXZYKMCZYNF-JXFKEZNVSA-N 1 1 369.509 2.293 20 70 FEIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1csc([C@@H]2CCCO2)n1 ZINC000161445138 546130974 /nfs/dbraw/zinc/13/09/74/546130974.db2.gz LNQFSJPUSIHOCI-HNNXBMFYSA-N 1 1 367.515 2.425 20 70 FEIDMO CCC[C@H]1CN(C(=O)NC[C@H](C(CC)CC)[NH+]2CCOCC2)CCO1 ZINC000159502513 326933591 /nfs/dbraw/zinc/93/35/91/326933591.db2.gz JDOINFMWENYEJE-ZWKOTPCHSA-N 1 1 355.523 2.334 20 70 FEIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ncccc1OCC(F)F ZINC000159609094 326936708 /nfs/dbraw/zinc/93/67/08/326936708.db2.gz KWXGXVIYQBMCOC-UHFFFAOYSA-N 1 1 371.428 2.156 20 70 FEIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cc(-c2ccncc2)on1 ZINC000159655541 326938029 /nfs/dbraw/zinc/93/80/29/326938029.db2.gz YDVQXJDHMMJNGZ-UHFFFAOYSA-N 1 1 358.442 2.167 20 70 FEIDMO CC(C)[C@H](CNC(=O)N[C@H](C)C[C@H](O)c1ccccc1)[NH+]1CCOCC1 ZINC000159844339 326943974 /nfs/dbraw/zinc/94/39/74/326943974.db2.gz JXSKBJJRGSILKT-NEWSRXKRSA-N 1 1 363.502 2.155 20 70 FEIDMO O=C(NCC[NH+]1CCN(c2cccc(Cl)c2)CC1)[C@@H]1C[C@H]2CC[C@@H]1O2 ZINC000161466845 327000515 /nfs/dbraw/zinc/00/05/15/327000515.db2.gz MEONHTMZPNQAOC-KURKYZTESA-N 1 1 363.889 2.146 20 70 FEIDMO CC(C)C[N@H+]1CC[C@H](CNC(=O)C(=O)Nc2ccc3c(c2)C(=O)CCC3)C1 ZINC000159427644 545952791 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CCC[N@H+]1CC[C@H](CNC(=O)NCc2ccc(OC)c(NC(C)=O)c2)C1 ZINC000160752760 546068757 /nfs/dbraw/zinc/06/87/57/546068757.db2.gz FBIJKCKMMRZYTR-MRXNPFEDSA-N 1 1 362.474 2.185 20 70 FEIDMO CCC(=O)N1CC[C@H](NC(=O)N(CC)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)C1 ZINC000160752741 546069608 /nfs/dbraw/zinc/06/96/08/546069608.db2.gz LRPDQIXATPHVDD-RBUKOAKNSA-N 1 1 372.513 2.303 20 70 FEIDMO CC(C)N(C)C(=O)C1CCN(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)CC1 ZINC000160777620 546071451 /nfs/dbraw/zinc/07/14/51/546071451.db2.gz OVNLHJRQRGYGMB-QGZVFWFLSA-N 1 1 364.534 2.292 20 70 FEIDMO Cc1conc1NC(=O)C(=O)NC[C@@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000160812384 546074374 /nfs/dbraw/zinc/07/43/74/546074374.db2.gz QTQONQAGCASUDJ-INIZCTEOSA-N 1 1 356.426 2.092 20 70 FEIDMO COC(=O)c1ccc2[nH]cc(C(=O)C[N@@H+]3CCC[C@H](CCC(N)=O)C3)c2c1 ZINC000160850138 546077524 /nfs/dbraw/zinc/07/75/24/546077524.db2.gz QYTGSWLWJDKDBZ-CYBMUJFWSA-N 1 1 371.437 2.115 20 70 FEIDMO COC(=O)c1ccc2[nH]cc(C(=O)C[N@H+]3CCC[C@H](CCC(N)=O)C3)c2c1 ZINC000160850138 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FEIDMO CCN(C(=O)NCCCC(=O)N(C)C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000159609689 545967270 /nfs/dbraw/zinc/96/72/70/545967270.db2.gz VBCYSBDYRXQAKZ-GOSISDBHSA-N 1 1 360.502 2.161 20 70 FEIDMO CC[C@H](COC)NC(=O)NCC1CC[NH+](Cc2csc(C)n2)CC1 ZINC000159645162 545969370 /nfs/dbraw/zinc/96/93/70/545969370.db2.gz OTJCFAIOKIGRSR-OAHLLOKOSA-N 1 1 354.520 2.388 20 70 FEIDMO CCCCNC(=O)c1ccc(CNC(=O)N2CCC[N@@H+](CC)CC2)cc1 ZINC000159686836 545972940 /nfs/dbraw/zinc/97/29/40/545972940.db2.gz IVSSRVQQKPYCEE-UHFFFAOYSA-N 1 1 360.502 2.454 20 70 FEIDMO CN(CCOc1ccc(Cl)cc1)C(=O)C[N@@H+](C)C[C@H]1CCC[C@@H]1O ZINC000159724871 545975393 /nfs/dbraw/zinc/97/53/93/545975393.db2.gz YXJYQRCZDGCLSY-PBHICJAKSA-N 1 1 354.878 2.270 20 70 FEIDMO CN(CCOc1ccc(Cl)cc1)C(=O)C[N@@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000159724703 545975644 /nfs/dbraw/zinc/97/56/44/545975644.db2.gz YXJYQRCZDGCLSY-YOEHRIQHSA-N 1 1 354.878 2.270 20 70 FEIDMO Cc1cnn([C@H]2CC[N@@H+](Cc3ccccc3)C2)c1NC(=O)c1cn[nH]n1 ZINC000159750397 545977612 /nfs/dbraw/zinc/97/76/12/545977612.db2.gz BLTGMKAEFHNGKY-HNNXBMFYSA-N 1 1 351.414 2.009 20 70 FEIDMO CN(C)c1cccc(C[N@H+](C)CC(=O)NC(=O)NCc2ccccc2)c1 ZINC000159813710 545983082 /nfs/dbraw/zinc/98/30/82/545983082.db2.gz WECZHFBCNAFFDZ-UHFFFAOYSA-N 1 1 354.454 2.210 20 70 FEIDMO CN(C)c1cccc(C[N@@H+](C)CC(=O)NC(=O)NCc2ccccc2)c1 ZINC000159813710 545983085 /nfs/dbraw/zinc/98/30/85/545983085.db2.gz WECZHFBCNAFFDZ-UHFFFAOYSA-N 1 1 354.454 2.210 20 70 FEIDMO CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc(NC(=O)C2CC2)cc1 ZINC000159908662 545990100 /nfs/dbraw/zinc/99/01/00/545990100.db2.gz PTTMILGYZBMFGO-UHFFFAOYSA-N 1 1 373.497 2.466 20 70 FEIDMO Cc1nn(CC(C)C)c(Cl)c1[C@H]1CCC[N@H+]1CCC(=O)NC(N)=O ZINC000160123856 546008752 /nfs/dbraw/zinc/00/87/52/546008752.db2.gz RSSLTCWUNQNJGN-GFCCVEGCSA-N 1 1 355.870 2.223 20 70 FEIDMO CCCCn1ncc(NC(=O)NC2CC[NH+](CCN(C)C)CC2)c1C ZINC000160124864 546010015 /nfs/dbraw/zinc/01/00/15/546010015.db2.gz RMOBKXCMUBVFNY-UHFFFAOYSA-N 1 1 350.511 2.139 20 70 FEIDMO CCC[C@@H]1CN(C(=O)NCc2ccc(C[NH+]3CCN(C)CC3)cc2)CCO1 ZINC000160143197 546011006 /nfs/dbraw/zinc/01/10/06/546011006.db2.gz FBHZCLKWVOKBIJ-HXUWFJFHSA-N 1 1 374.529 2.145 20 70 FEIDMO CCC[C@@H]1CN(C(=O)NCCc2cccc(OC)c2)CC[N@H+]1CCOC ZINC000160199284 546016529 /nfs/dbraw/zinc/01/65/29/546016529.db2.gz JFSWNNTVTQHDLJ-GOSISDBHSA-N 1 1 363.502 2.380 20 70 FEIDMO CCC[C@@H]1CN(C(=O)Nc2nnc(C(F)F)s2)CC[N@H+]1CCOC ZINC000160225055 546019290 /nfs/dbraw/zinc/01/92/90/546019290.db2.gz WRZDHKWVEBOULF-SNVBAGLBSA-N 1 1 363.434 2.440 20 70 FEIDMO Cc1nc(-c2cccc(CNC(=O)NCC[N@@H+]3CCC[C@H](C)C3)c2)n[nH]1 ZINC000160219591 546019537 /nfs/dbraw/zinc/01/95/37/546019537.db2.gz LJWKXKKPJUGSOU-AWEZNQCLSA-N 1 1 356.474 2.311 20 70 FEIDMO CCC[C@H]1CN(C(=O)NCCCNc2ccccn2)CC[N@H+]1CCOC ZINC000160434876 546041194 /nfs/dbraw/zinc/04/11/94/546041194.db2.gz NZGGZOGGHJKJJC-KRWDZBQOSA-N 1 1 363.506 2.026 20 70 FEIDMO CN(C(=O)[C@H]1C[N@H+](Cc2ccccc2)CCO1)c1ccc2c(c1)OCO2 ZINC000160519746 546047949 /nfs/dbraw/zinc/04/79/49/546047949.db2.gz DELDQLXXAQVFLS-LJQANCHMSA-N 1 1 354.406 2.279 20 70 FEIDMO CN(C(=O)[C@H]1C[N@@H+](Cc2ccccc2)CCO1)c1ccc2c(c1)OCO2 ZINC000160519746 546047956 /nfs/dbraw/zinc/04/79/56/546047956.db2.gz DELDQLXXAQVFLS-LJQANCHMSA-N 1 1 354.406 2.279 20 70 FEIDMO O=C(C[N@H+]1CC[C@@H]2CCCC[C@@H]21)NCc1ccccc1CN1CCOCC1 ZINC000160543936 546050419 /nfs/dbraw/zinc/05/04/19/546050419.db2.gz IEKVHKPWCXBNOP-RXVVDRJESA-N 1 1 371.525 2.400 20 70 FEIDMO CCNC(=O)C(C)(C)CNC(=O)N(CC)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000160858880 546079052 /nfs/dbraw/zinc/07/90/52/546079052.db2.gz HAGMYOWCMAKTBO-SFHVURJKSA-N 1 1 374.529 2.455 20 70 FEIDMO Cc1nc(C)n(C[C@H]2CCCN(C(=O)N[C@H]3CC[N@H+](C4CCCC4)C3)C2)n1 ZINC000160891000 546082229 /nfs/dbraw/zinc/08/22/29/546082229.db2.gz IUVLETKHTNULLS-ROUUACIJSA-N 1 1 374.533 2.333 20 70 FEIDMO CC(C)c1csc(CNC(=O)NC[C@H](C(C)C)N2CC[NH+](C)CC2)n1 ZINC000160908139 546082986 /nfs/dbraw/zinc/08/29/86/546082986.db2.gz DZSXDPKHFHMYAY-MRXNPFEDSA-N 1 1 367.563 2.338 20 70 FEIDMO COc1cccc2c1OCC(C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)=C2 ZINC000160274164 326960032 /nfs/dbraw/zinc/96/00/32/326960032.db2.gz KOWYYLSQMUTYBT-UHFFFAOYSA-N 1 1 374.481 2.288 20 70 FEIDMO CS(=O)(=O)NCC[C@H]1CCCC[N@H+]1Cc1c[nH]nc1-c1cccs1 ZINC000159398071 545950179 /nfs/dbraw/zinc/95/01/79/545950179.db2.gz GSQVIOQIOBKMOT-CQSZACIVSA-N 1 1 368.528 2.432 20 70 FEIDMO C[C@@H]1C[N@H+](CC2CCN(C(=O)NCCc3cscn3)CC2)C[C@H](C)O1 ZINC000159571577 545963593 /nfs/dbraw/zinc/96/35/93/545963593.db2.gz PQSCJEUJINGLOR-GASCZTMLSA-N 1 1 366.531 2.216 20 70 FEIDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)N[C@@H]1CCN(c2ncccc2Cl)C1 ZINC000159611619 545967299 /nfs/dbraw/zinc/96/72/99/545967299.db2.gz BNVDMYFFQYVJFL-GDBMZVCRSA-N 1 1 365.909 2.295 20 70 FEIDMO CCc1cc(C(=O)N[C@H](CC)[C@@H]2C[N@H+](Cc3ccccc3)CCO2)[nH]n1 ZINC000159650496 545969903 /nfs/dbraw/zinc/96/99/03/545969903.db2.gz VSBCBQQILZRJGT-MJGOQNOKSA-N 1 1 356.470 2.382 20 70 FEIDMO CCc1cc(C(=O)N[C@H](CC)[C@@H]2C[N@@H+](Cc3ccccc3)CCO2)[nH]n1 ZINC000159650496 545969911 /nfs/dbraw/zinc/96/99/11/545969911.db2.gz VSBCBQQILZRJGT-MJGOQNOKSA-N 1 1 356.470 2.382 20 70 FEIDMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)Nc1ccnn1C[C@H]1CCOC1 ZINC000159683257 545973413 /nfs/dbraw/zinc/97/34/13/545973413.db2.gz MFLNBEITCVAWBE-HZPDHXFCSA-N 1 1 358.446 2.121 20 70 FEIDMO CC[N@H+]1CCCN(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCOCC2)CC1 ZINC000159713320 545975418 /nfs/dbraw/zinc/97/54/18/545975418.db2.gz UDYCOTDVDKDDCN-FQEVSTJZSA-N 1 1 374.529 2.106 20 70 FEIDMO C[C@H](NC(=O)[C@H](C)[N@@H+](C)C[C@@H]1CCC[C@@H]1O)c1ccc2c(c1)OCCO2 ZINC000159714103 545975441 /nfs/dbraw/zinc/97/54/41/545975441.db2.gz UUIAVEAJTLTLNF-OTRWWLKZSA-N 1 1 362.470 2.116 20 70 FEIDMO CC[N@@H+]1CCc2nc(NC(=O)[C@@H]3CCCN3C(=O)NC(C)C)sc2C1 ZINC000159746226 545977412 /nfs/dbraw/zinc/97/74/12/545977412.db2.gz HHFMDMNYEGHAST-ZDUSSCGKSA-N 1 1 365.503 2.042 20 70 FEIDMO CC[N@H+]1CCc2nc(NC(=O)[C@@H]3CCCN3C(=O)NC(C)C)sc2C1 ZINC000159746226 545977414 /nfs/dbraw/zinc/97/74/14/545977414.db2.gz HHFMDMNYEGHAST-ZDUSSCGKSA-N 1 1 365.503 2.042 20 70 FEIDMO C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)NCCCO[C@H]1CCOC1 ZINC000159762205 545978404 /nfs/dbraw/zinc/97/84/04/545978404.db2.gz SKMYXKLAWLFDOJ-SFHVURJKSA-N 1 1 363.502 2.392 20 70 FEIDMO CC(C)CNC(=O)c1ccccc1NC(=O)C[N@@H+](C)C[C@@H]1CCC[C@@H]1O ZINC000159803300 545982012 /nfs/dbraw/zinc/98/20/12/545982012.db2.gz PQMBWUKHWXTNRM-YJBOKZPZSA-N 1 1 361.486 2.104 20 70 FEIDMO C[N@H+](CC(=O)NCc1ccc(OC(F)(F)F)cc1)C[C@H]1CCC[C@@H]1O ZINC000159857644 545986465 /nfs/dbraw/zinc/98/64/65/545986465.db2.gz SHPAPJPNBSXGPR-HIFRSBDPSA-N 1 1 360.376 2.294 20 70 FEIDMO Cc1nc(C[NH+]2CCC(C(=O)N[C@H]3c4ccccc4C[C@@H]3O)CC2)cs1 ZINC000159866653 545986750 /nfs/dbraw/zinc/98/67/50/545986750.db2.gz XRQHUBZTCNQXBI-OALUTQOASA-N 1 1 371.506 2.438 20 70 FEIDMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)NCCc1nnc(-c2ccccc2)o1 ZINC000159934628 545993676 /nfs/dbraw/zinc/99/36/76/545993676.db2.gz SYSGAVLBMYZGRX-MRXNPFEDSA-N 1 1 357.458 2.261 20 70 FEIDMO CC(C)c1cc(C(=O)Nc2cccc(CC(=O)N3CC[NH+](C)CC3)c2)no1 ZINC000159980027 545997333 /nfs/dbraw/zinc/99/73/33/545997333.db2.gz GGMNLBUWDLXGCD-UHFFFAOYSA-N 1 1 370.453 2.367 20 70 FEIDMO COc1cccc(C2(NC(=O)NC3CC[NH+](CCN(C)C)CC3)CC2)c1 ZINC000160012059 545999747 /nfs/dbraw/zinc/99/97/47/545999747.db2.gz DFPRYIJXRQSOOM-UHFFFAOYSA-N 1 1 360.502 2.010 20 70 FEIDMO Cc1conc1NC(=O)C(=O)NCc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000160147519 546011277 /nfs/dbraw/zinc/01/12/77/546011277.db2.gz BCEGEBCXHZBHFF-CQSZACIVSA-N 1 1 370.453 2.470 20 70 FEIDMO Cc1conc1NC(=O)C(=O)NCc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000160147656 546011357 /nfs/dbraw/zinc/01/13/57/546011357.db2.gz JEFNNJJPLKZASO-AWEZNQCLSA-N 1 1 370.453 2.470 20 70 FEIDMO CSc1cc(C(=O)NCCC[N@H+]2CCC[C@H]2C(=O)N(C)C)ccc1F ZINC000160246609 546021282 /nfs/dbraw/zinc/02/12/82/546021282.db2.gz XJLVUPOLGHYCSB-HNNXBMFYSA-N 1 1 367.490 2.220 20 70 FEIDMO C[C@@H]1C[C@H](NC(=O)N2CC[C@](O)(C(F)(F)F)C2)C[N@H+]1Cc1ccccc1 ZINC000160367751 546034091 /nfs/dbraw/zinc/03/40/91/546034091.db2.gz ZHDBCQOMUBOCEH-UKPHBRMFSA-N 1 1 371.403 2.358 20 70 FEIDMO C[NH+]1CCN(CCCCNC(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)CC1 ZINC000160407886 546037863 /nfs/dbraw/zinc/03/78/63/546037863.db2.gz YSFDOBBMIOBHHA-NVXWUHKLSA-N 1 1 351.441 2.212 20 70 FEIDMO CC(C)(C)C(=O)N1CCC(C[N@@H+]2CCNC(=O)[C@H]2c2ccccc2)CC1 ZINC000160595094 546054817 /nfs/dbraw/zinc/05/48/17/546054817.db2.gz OWYSPJCHCYUXPQ-GOSISDBHSA-N 1 1 357.498 2.444 20 70 FEIDMO CC(C)(C)C(=O)N1CCC(C[N@H+]2CCNC(=O)[C@H]2c2ccccc2)CC1 ZINC000160595094 546054824 /nfs/dbraw/zinc/05/48/24/546054824.db2.gz OWYSPJCHCYUXPQ-GOSISDBHSA-N 1 1 357.498 2.444 20 70 FEIDMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)CN1c2ccccc2O[C@H](C)C1=O ZINC000160587806 546054882 /nfs/dbraw/zinc/05/48/82/546054882.db2.gz ZSJHYOXVRNOJFJ-HZPDHXFCSA-N 1 1 359.470 2.037 20 70 FEIDMO CC[N@@H+](C)C[C@@H]1CCN([C@H](C(N)=O)c2cccc(Br)c2)C1 ZINC000160680554 546062704 /nfs/dbraw/zinc/06/27/04/546062704.db2.gz KCOGYUOITZNBBT-WFASDCNBSA-N 1 1 354.292 2.249 20 70 FEIDMO Cn1cnc(-c2ccc(NC(=O)N3CC[C@H]4[C@H](CCC[N@H+]4C)C3)cc2)n1 ZINC000160786310 546072220 /nfs/dbraw/zinc/07/22/20/546072220.db2.gz LVLCVLVWFCAELH-WBVHZDCISA-N 1 1 354.458 2.430 20 70 FEIDMO CN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)N[C@H]1CC[N@H+](C2CCCC2)C1 ZINC000160829989 546076967 /nfs/dbraw/zinc/07/69/67/546076967.db2.gz QVVWEELAHDKSAV-PKOBYXMFSA-N 1 1 372.513 2.002 20 70 FEIDMO COCC[N@@H+](C)CCCNC(=O)Nc1ccc2c(c1)CCCN2C(C)=O ZINC000160856826 546078890 /nfs/dbraw/zinc/07/88/90/546078890.db2.gz XUWPUWQTHPJXAC-UHFFFAOYSA-N 1 1 362.474 2.076 20 70 FEIDMO Cc1conc1NC(=O)C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000160902258 546083599 /nfs/dbraw/zinc/08/35/99/546083599.db2.gz GSYBQMZVKINHKF-ZDUSSCGKSA-N 1 1 362.455 2.011 20 70 FEIDMO C[C@@H](Oc1cccc(CO)c1)C(=O)N1CC[NH+](CCc2ccccc2)CC1 ZINC000161194104 546107857 /nfs/dbraw/zinc/10/78/57/546107857.db2.gz YVWQTSQVXILTPU-GOSISDBHSA-N 1 1 368.477 2.333 20 70 FEIDMO CCc1c(C(=O)NC[C@@H](C)[N@@H+]2CCc3sccc3C2)[nH]c(C)c1C(N)=O ZINC000161246265 546113230 /nfs/dbraw/zinc/11/32/30/546113230.db2.gz BXAQIWFCRNXAAS-LLVKDONJSA-N 1 1 374.510 2.223 20 70 FEIDMO CCc1c(C(=O)NC[C@@H](C)[N@H+]2CCc3sccc3C2)[nH]c(C)c1C(N)=O ZINC000161246265 546113236 /nfs/dbraw/zinc/11/32/36/546113236.db2.gz BXAQIWFCRNXAAS-LLVKDONJSA-N 1 1 374.510 2.223 20 70 FEIDMO CC[N@@H+](CCNC(=O)C(=O)Nc1cc(C)ccc1-n1cc(C)cn1)C(C)C ZINC000161260474 546114172 /nfs/dbraw/zinc/11/41/72/546114172.db2.gz JLPNPYJDVCJDMJ-UHFFFAOYSA-N 1 1 371.485 2.274 20 70 FEIDMO CCc1c(C(=O)N[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)[nH]c(C)c1C(N)=O ZINC000161376887 546124637 /nfs/dbraw/zinc/12/46/37/546124637.db2.gz IKENLVFOLSLPSD-MRXNPFEDSA-N 1 1 368.481 2.379 20 70 FEIDMO Cc1cc2c(cc1C)O[C@@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)C2 ZINC000160170582 326955840 /nfs/dbraw/zinc/95/58/40/326955840.db2.gz UNEOZLYSYPRASX-LJQANCHMSA-N 1 1 360.498 2.424 20 70 FEIDMO O=C(Nc1ccccc1)c1ccc(N2CCC[C@@H]2C[NH+]2CCOCC2)nn1 ZINC000160394766 326964256 /nfs/dbraw/zinc/96/42/56/326964256.db2.gz UESNZDRSNJFQOE-QGZVFWFLSA-N 1 1 367.453 2.030 20 70 FEIDMO CCO[C@@H]1C[C@H](N(C)C(=O)NC[C@@H](C(C)C)[NH+]2CCOCC2)C12CCC2 ZINC000160891347 326981067 /nfs/dbraw/zinc/98/10/67/326981067.db2.gz XFUSKJAYRIYBOV-OKZBNKHCSA-N 1 1 367.534 2.332 20 70 FEIDMO C[NH+](C)[C@H](CNC(=O)N1CCC(OC2CCOCC2)CC1)c1ccco1 ZINC000160902804 326981448 /nfs/dbraw/zinc/98/14/48/326981448.db2.gz OOIBXSGLJBKRNJ-QGZVFWFLSA-N 1 1 365.474 2.252 20 70 FEIDMO CC(C)OCC[NH+]1CCN(C(=O)Nc2ccn(CC(F)(F)F)n2)CC1 ZINC000160905675 326981659 /nfs/dbraw/zinc/98/16/59/326981659.db2.gz VEOYUWLWAXSSBC-UHFFFAOYSA-N 1 1 363.384 2.020 20 70 FEIDMO NC(=O)[C@H]1CCC[N@H+]1C1CCN(CCSc2ccccc2F)CC1 ZINC000159406402 545951142 /nfs/dbraw/zinc/95/11/42/545951142.db2.gz JLDQWVAHBXLKMX-MRXNPFEDSA-N 1 1 351.491 2.332 20 70 FEIDMO NC(=O)[C@H]1CCCN1C1CC[NH+](CCSc2ccccc2F)CC1 ZINC000159406402 545951145 /nfs/dbraw/zinc/95/11/45/545951145.db2.gz JLDQWVAHBXLKMX-MRXNPFEDSA-N 1 1 351.491 2.332 20 70 FEIDMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)N1CCN(Cc2ccccn2)CC1 ZINC000159585261 545965141 /nfs/dbraw/zinc/96/51/41/545965141.db2.gz UBWIIMDXJXRXSB-ZWKOTPCHSA-N 1 1 359.518 2.029 20 70 FEIDMO CC[C@@H](C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCC[N@H+](C)C2)cc1)N(C)C ZINC000159593989 545965225 /nfs/dbraw/zinc/96/52/25/545965225.db2.gz NWTBNSIFWHLACS-ROUUACIJSA-N 1 1 360.502 2.132 20 70 FEIDMO CC[C@@H](C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)cc1)N(C)C ZINC000159593989 545965226 /nfs/dbraw/zinc/96/52/26/545965226.db2.gz NWTBNSIFWHLACS-ROUUACIJSA-N 1 1 360.502 2.132 20 70 FEIDMO CC[N@H+]1CCCN(C(=O)NC[C@H](c2ccc(C)cc2)N2CCOCC2)CC1 ZINC000159713419 545975540 /nfs/dbraw/zinc/97/55/40/545975540.db2.gz UDYCOTDVDKDDCN-HXUWFJFHSA-N 1 1 374.529 2.106 20 70 FEIDMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)C(=O)Nc1ccn(CCC(C)C)n1 ZINC000159755304 545977285 /nfs/dbraw/zinc/97/72/85/545977285.db2.gz XIDYAMCMVFTGAI-MRXNPFEDSA-N 1 1 363.506 2.248 20 70 FEIDMO COC(=O)C[C@H](C)[NH+]1CCN(C(=O)Nc2ccnc(C)c2Cl)CC1 ZINC000159746297 545977643 /nfs/dbraw/zinc/97/76/43/545977643.db2.gz KEOOTGOOZRGEEX-NSHDSACASA-N 1 1 354.838 2.145 20 70 FEIDMO Cc1nc(C[NH+]2CCC(C(=O)N[C@@H]3c4ccccc4C[C@@H]3O)CC2)cs1 ZINC000159866500 545986828 /nfs/dbraw/zinc/98/68/28/545986828.db2.gz XRQHUBZTCNQXBI-RBUKOAKNSA-N 1 1 371.506 2.438 20 70 FEIDMO CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NC[C@@H](C)[N@@H+](C)C1CC1 ZINC000159858913 545987153 /nfs/dbraw/zinc/98/71/53/545987153.db2.gz XGGPZNXUOKWBMO-HUUCEWRRSA-N 1 1 367.515 2.021 20 70 FEIDMO C[C@@H](CNC(=O)N[C@@H]1CCc2n[nH]cc2C1)[N@@H+]1CCc2sccc2C1 ZINC000159863803 545987301 /nfs/dbraw/zinc/98/73/01/545987301.db2.gz SCKSCPDJEHUBHJ-SWLSCSKDSA-N 1 1 359.499 2.075 20 70 FEIDMO C[C@@H](CNC(=O)N[C@@H]1CCc2n[nH]cc2C1)[N@H+]1CCc2sccc2C1 ZINC000159863803 545987306 /nfs/dbraw/zinc/98/73/06/545987306.db2.gz SCKSCPDJEHUBHJ-SWLSCSKDSA-N 1 1 359.499 2.075 20 70 FEIDMO CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NC[C@@H](C)[N@@H+](C)C1CC1 ZINC000159858777 545987566 /nfs/dbraw/zinc/98/75/66/545987566.db2.gz XGGPZNXUOKWBMO-CABCVRRESA-N 1 1 367.515 2.021 20 70 FEIDMO CCOC(=O)c1sc([C@@H](C)NC(=O)N2CCC[N@@H+](CC)CC2)nc1C ZINC000159972349 545996263 /nfs/dbraw/zinc/99/62/63/545996263.db2.gz LFFKZDYCKJUEBD-CYBMUJFWSA-N 1 1 368.503 2.426 20 70 FEIDMO CCc1noc(C)c1NC(=O)C(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000159976848 545997035 /nfs/dbraw/zinc/99/70/35/545997035.db2.gz NNFIEGHZVGDOJS-AWEZNQCLSA-N 1 1 360.414 2.030 20 70 FEIDMO CCn1cnnc1C1CC[NH+]([C@@H]2CCCN(CC(F)(F)F)C2=O)CC1 ZINC000160018091 546001383 /nfs/dbraw/zinc/00/13/83/546001383.db2.gz XYNGEXCOVWKJDW-CYBMUJFWSA-N 1 1 359.396 2.031 20 70 FEIDMO C[C@@H]1CCC[N@@H+](CCCCNC(=O)N2CCCN(CC(F)F)CC2)C1 ZINC000160358923 546033163 /nfs/dbraw/zinc/03/31/63/546033163.db2.gz RVEFBCZHCJYISN-MRXNPFEDSA-N 1 1 360.493 2.481 20 70 FEIDMO Nc1cc(N)[nH+]c(S[C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)n1 ZINC000160433851 546040654 /nfs/dbraw/zinc/04/06/54/546040654.db2.gz SGTVSGKUVXRNBM-JTQLQIEISA-N 1 1 353.810 2.331 20 70 FEIDMO CNC(=O)c1cccc(CCC(=O)NCC[N@@H+]2CCc3sccc3C2)c1 ZINC000160634006 546058124 /nfs/dbraw/zinc/05/81/24/546058124.db2.gz RFBNBVHXGSNIBY-UHFFFAOYSA-N 1 1 371.506 2.215 20 70 FEIDMO CNC(=O)c1cccc(CCC(=O)NCC[N@H+]2CCc3sccc3C2)c1 ZINC000160634006 546058131 /nfs/dbraw/zinc/05/81/31/546058131.db2.gz RFBNBVHXGSNIBY-UHFFFAOYSA-N 1 1 371.506 2.215 20 70 FEIDMO C[C@@H]1CCO[C@H]1C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000160669575 546061538 /nfs/dbraw/zinc/06/15/38/546061538.db2.gz INESMFSYHFCJJM-ZTFGCOKTSA-N 1 1 359.470 2.216 20 70 FEIDMO C[C@H](C(=O)Nc1ccc2c(c1)OCCO2)[N@H+]1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000160788553 546072320 /nfs/dbraw/zinc/07/23/20/546072320.db2.gz OFXLBASQEUSYIL-STXHMFSFSA-N 1 1 360.454 2.412 20 70 FEIDMO COCc1cc(N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)n2ncnc2n1 ZINC000160909745 546084170 /nfs/dbraw/zinc/08/41/70/546084170.db2.gz KCLFPFKSIOZCJS-GOEBONIOSA-N 1 1 352.442 2.346 20 70 FEIDMO Cc1nc(-c2ccccc2)ncc1C(=O)N1CC[C@@H](C[NH+]2CCOCC2)C1 ZINC000160954178 546088208 /nfs/dbraw/zinc/08/82/08/546088208.db2.gz UIZHMZHSJFHXIA-KRWDZBQOSA-N 1 1 366.465 2.246 20 70 FEIDMO CC(=O)NC[C@H]1CCCN(C(=O)NC[C@H]2CCCC[N@@H+]2CC(C)C)C1 ZINC000161022707 546094081 /nfs/dbraw/zinc/09/40/81/546094081.db2.gz AOJMNPDKDOVINF-QZTJIDSGSA-N 1 1 352.523 2.055 20 70 FEIDMO CC(=O)NC1CCC([NH2+]CCCN2CCN(C)C[C@@H]2c2ccccc2)CC1 ZINC000161275148 546115932 /nfs/dbraw/zinc/11/59/32/546115932.db2.gz HACUVEFODAVYEK-LZBANZJXSA-N 1 1 372.557 2.402 20 70 FEIDMO Cc1ccc(S(N)(=O)=O)cc1NC(=O)C[N@H+](C)[C@H]1CCCC[C@@H]1C ZINC000161371074 546124340 /nfs/dbraw/zinc/12/43/40/546124340.db2.gz QLMKYBUOQNREAI-BBRMVZONSA-N 1 1 353.488 2.091 20 70 FEIDMO