smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC1CC(NC2CC[NH+](C(C)(C)CC(C)(C)C)CC2)C1 ZINC000449172055 260271088 /nfs/dbraw/zinc/27/10/88/260271088.db2.gz BGQXGOBTNQIJGJ-UHFFFAOYSA-N 1 3 280.500 4.054 20 0 CIADHO CC1CC([NH2+]C2CCN(C(C)(C)CC(C)(C)C)CC2)C1 ZINC000449172055 260271090 /nfs/dbraw/zinc/27/10/90/260271090.db2.gz BGQXGOBTNQIJGJ-UHFFFAOYSA-N 1 3 280.500 4.054 20 0 CIADHO CCC[C@@H](C)[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000390767702 262338691 /nfs/dbraw/zinc/33/86/91/262338691.db2.gz JDVPBGDSEOZYTE-IEBWSBKVSA-N 1 3 288.479 4.067 20 0 CIADHO [NH3+]CCC[C@H](NCc1cc2ccccc2o1)c1ccccc1 ZINC000415057201 263258579 /nfs/dbraw/zinc/25/85/79/263258579.db2.gz RISORGPBTZPUNM-SFHVURJKSA-N 1 3 294.398 4.003 20 0 CIADHO CCC(C)(C)CC[NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000583408400 327349507 /nfs/dbraw/zinc/34/95/07/327349507.db2.gz WARZNRGFNKJLLM-HZPDHXFCSA-N 1 3 280.500 4.055 20 0 CIADHO C[C@H](CCC1CC1)[NH2+]C1CCN([C@H]2CCC[C@@H](C)C2)CC1 ZINC000469810010 329251500 /nfs/dbraw/zinc/25/15/00/329251500.db2.gz VKTLVSBBJZTWDM-MDZRGWNJSA-N 1 3 292.511 4.198 20 0 CIADHO CCCC[C@H](C)[C@H](C)[NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000582928633 329286077 /nfs/dbraw/zinc/28/60/77/329286077.db2.gz PBVFFUQFFRAZFK-WNRNVDISSA-N 1 3 294.527 4.444 20 0 CIADHO CCCC[C@H](C)[C@H](C)[NH2+][C@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000582928632 329286245 /nfs/dbraw/zinc/28/62/45/329286245.db2.gz PBVFFUQFFRAZFK-FJIDUMEYSA-N 1 3 294.527 4.444 20 0 CIADHO C[C@H](CCCC[NH3+])N[C@@H](C)c1cccc(Cl)c1Cl ZINC000422754007 330153749 /nfs/dbraw/zinc/15/37/49/330153749.db2.gz FRCIGCVXRRRYEL-MNOVXSKESA-N 1 3 289.250 4.162 20 0 CIADHO CC(C)(C)C[C@@H](N[C@H]1CCC[NH2+]CC1)c1ccc(F)cc1 ZINC000422903495 330162319 /nfs/dbraw/zinc/16/23/19/330162319.db2.gz WGDHNCVDMSSDSC-DLBZAZTESA-N 1 3 292.442 4.035 20 0 CIADHO [NH3+][C@H]1C[C@@H](N[C@@H]2CCC[C@H]2c2ccccc2)c2ccccc21 ZINC000422963676 330164416 /nfs/dbraw/zinc/16/44/16/330164416.db2.gz GJCGVCGOODGFGC-KCUHQSDYSA-N 1 3 292.426 4.057 20 0 CIADHO C[C@H](NC[C@@H]1CCC[NH2+]C1)c1cccc(-c2ccccc2)c1 ZINC000423207822 330177374 /nfs/dbraw/zinc/17/73/74/330177374.db2.gz HHHDEYJBLDSIBP-DLBZAZTESA-N 1 3 294.442 4.004 20 0 CIADHO CC[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccc(F)cc1 ZINC000423291414 330186995 /nfs/dbraw/zinc/18/69/95/330186995.db2.gz IFQRWTMZBMIDGQ-ACJLOTCBSA-N 1 3 286.394 4.086 20 0 CIADHO Cc1ccc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c(C)c1 ZINC000423291336 330187197 /nfs/dbraw/zinc/18/71/97/330187197.db2.gz HWRQHFYYHZDGQD-HOTGVXAUSA-N 1 3 282.431 4.174 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2cccc(C3CC3)c2)cc1 ZINC000423291069 330187230 /nfs/dbraw/zinc/18/72/30/330187230.db2.gz GOIIKZZBROPYTL-HUUCEWRRSA-N 1 3 294.442 4.435 20 0 CIADHO Cc1cc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c(C)s1 ZINC000423292357 330187486 /nfs/dbraw/zinc/18/74/86/330187486.db2.gz MSMRSLAINXSNDT-STQMWFEESA-N 1 3 288.460 4.235 20 0 CIADHO Cc1cc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c(C)s1 ZINC000423292355 330187499 /nfs/dbraw/zinc/18/74/99/330187499.db2.gz MSMRSLAINXSNDT-OLZOCXBDSA-N 1 3 288.460 4.235 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2cccc(Cl)c2)cc1 ZINC000423292760 330187630 /nfs/dbraw/zinc/18/76/30/330187630.db2.gz OICCLYZUPIWHIL-CHWSQXEVSA-N 1 3 288.822 4.211 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2cc3ccccc3o2)cc1 ZINC000423294765 330187896 /nfs/dbraw/zinc/18/78/96/330187896.db2.gz VGHHKEAENIMXSR-KBPBESRZSA-N 1 3 294.398 4.303 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CC(C)(C)c3ccccc32)cc1 ZINC000423295303 330188331 /nfs/dbraw/zinc/18/83/31/330188331.db2.gz WKMRGFIXRFRDJQ-IFXJQAMLSA-N 1 3 294.442 4.219 20 0 CIADHO C[C@H]([NH2+][C@H]1CCNC[C@@H]1C)c1cccc(-c2ccccc2)c1 ZINC000423363233 330194077 /nfs/dbraw/zinc/19/40/77/330194077.db2.gz BPRXFOKNWKQSCQ-FTRWYGJKSA-N 1 3 294.442 4.002 20 0 CIADHO C[C@@H]1C[C@H]([NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)CCN1 ZINC000423403591 330196234 /nfs/dbraw/zinc/19/62/34/330196234.db2.gz YPOXTXRJEHLTNW-KBRIMQKVSA-N 1 3 292.442 4.033 20 0 CIADHO Cc1cccc2c1CC[C@@H]2N[C@@H](CCC[NH3+])c1ccccc1 ZINC000423500128 330208119 /nfs/dbraw/zinc/20/81/19/330208119.db2.gz KDMWDMBZYFUIDW-PMACEKPBSA-N 1 3 294.442 4.052 20 0 CIADHO Cc1cccc2c1CC[C@H]2N[C@@H](CCC[NH3+])c1ccccc1 ZINC000423500131 330208206 /nfs/dbraw/zinc/20/82/06/330208206.db2.gz KDMWDMBZYFUIDW-VQTJNVASSA-N 1 3 294.442 4.052 20 0 CIADHO C[C@@H]1C[C@@H](N[C@@H](CCC[NH3+])c2ccccc2)c2ccccc21 ZINC000423510222 330209115 /nfs/dbraw/zinc/20/91/15/330209115.db2.gz MIEMXZXXCLPAOM-UIAACRFSSA-N 1 3 294.442 4.305 20 0 CIADHO Cc1ccc2c(c1)[C@H](N[C@@H](CCC[NH3+])c1ccccc1)CC2 ZINC000423510113 330209203 /nfs/dbraw/zinc/20/92/03/330209203.db2.gz SBRVBGKMWOIYTM-VQTJNVASSA-N 1 3 294.442 4.052 20 0 CIADHO Cc1cccc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000423518696 330209762 /nfs/dbraw/zinc/20/97/62/330209762.db2.gz ZQAXLHHQBZXVKG-QFBILLFUSA-N 1 3 282.431 4.126 20 0 CIADHO Cc1ccc([C@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)C2CCC2)cc1 ZINC000453349797 331120469 /nfs/dbraw/zinc/12/04/69/331120469.db2.gz LYMKVHSQXOAWOS-RAFMOHDBSA-N 1 3 298.474 4.051 20 0 CIADHO Cc1ccc([C@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C2CCC2)cc1 ZINC000453349797 331120470 /nfs/dbraw/zinc/12/04/70/331120470.db2.gz LYMKVHSQXOAWOS-RAFMOHDBSA-N 1 3 298.474 4.051 20 0 CIADHO C[C@@H]([NH2+]C1CC(C(C)(C)C)C1)[C@@H]1CCCN(C2CCC2)C1 ZINC000459468474 331283152 /nfs/dbraw/zinc/28/31/52/331283152.db2.gz QTAVZFCWFZLAPX-NUWOQIAWSA-N 1 3 292.511 4.054 20 0 CIADHO CC[C@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1cccc(F)c1 ZINC000166528414 331307524 /nfs/dbraw/zinc/30/75/24/331307524.db2.gz DADNOSDNHSIOFW-KRWDZBQOSA-N 1 3 292.442 4.129 20 0 CIADHO C[C@@H]1CCC[C@@H]1C[NH2+]C1CCN([C@@H]2CCCC[C@@H]2C)CC1 ZINC000467452254 331420180 /nfs/dbraw/zinc/42/01/80/331420180.db2.gz DHJZKIKHNHBUCR-SFNKJDCFSA-N 1 3 292.511 4.055 20 0 CIADHO CC(C)N(CCC[NH2+][C@H]1CCC[C@H]1CCCF)C(C)C ZINC000510701631 332912526 /nfs/dbraw/zinc/91/25/26/332912526.db2.gz LAAFSDZMJBPSLV-IRXDYDNUSA-N 1 3 286.479 4.003 20 0 CIADHO CC1CCC(C[NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000484552139 331901660 /nfs/dbraw/zinc/90/16/60/331901660.db2.gz OICMHIVMBLICDT-UHFFFAOYSA-N 1 3 292.511 4.199 20 0 CIADHO CC[C@@H](C)C[C@@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000513023401 332999307 /nfs/dbraw/zinc/99/93/07/332999307.db2.gz HSXPCUHERXMFGO-HZPDHXFCSA-N 1 3 280.500 4.198 20 0 CIADHO C[C@@H]([NH2+][C@@H](CCN(C)C)C(C)(C)C)c1ccccc1Cl ZINC000523851274 333347791 /nfs/dbraw/zinc/34/77/91/333347791.db2.gz NAVWKPSPAWEAPW-CJNGLKHVSA-N 1 3 296.886 4.357 20 0 CIADHO C[C@H]1C[C@H]([NH2+]Cc2ccc(CN(C)C)cc2)CC(C)(C)C1 ZINC000524679847 333371149 /nfs/dbraw/zinc/37/11/49/333371149.db2.gz IOKLPPZVCKNISZ-YJBOKZPZSA-N 1 3 288.479 4.053 20 0 CIADHO CC(C)(C)C(C)(C)C[NH2+]C1CCN(C2CCCC2)CC1 ZINC000550847849 334230122 /nfs/dbraw/zinc/23/01/22/334230122.db2.gz NUXPDWDVMQSHIK-UHFFFAOYSA-N 1 3 280.500 4.055 20 0 CIADHO Cc1ccccc1[C@@H](C)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000247042423 334274514 /nfs/dbraw/zinc/27/45/14/334274514.db2.gz REGZCUOJBDZGCQ-QZTJIDSGSA-N 1 3 286.463 4.006 20 0 CIADHO CCCC1(C[NH2+]C2CCN(C3CCCCC3)CC2)CCC1 ZINC000552580175 334337589 /nfs/dbraw/zinc/33/75/89/334337589.db2.gz SFCLVCCNTYQAJE-UHFFFAOYSA-N 1 3 292.511 4.344 20 0 CIADHO CC(C)(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCN3CCC[C@H]3C2)CC1 ZINC000250689938 334348706 /nfs/dbraw/zinc/34/87/06/334348706.db2.gz IYAYCZXMBMJFAW-OWSLCNJRSA-N 1 3 292.511 4.198 20 0 CIADHO CC[C@H]([NH2+]CCCN1CCCC[C@H]1C)c1cccs1 ZINC000252367696 334378456 /nfs/dbraw/zinc/37/84/56/334378456.db2.gz BPURHOFCJHXMOS-CABCVRRESA-N 1 3 280.481 4.053 20 0 CIADHO CC(C)(C)[C@H]1CC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000574185156 334999122 /nfs/dbraw/zinc/99/91/22/334999122.db2.gz OQVMMQUJTCUSDN-ROUUACIJSA-N 1 3 292.511 4.198 20 0 CIADHO CC[NH+](CC)CCC[C@H](C)N[C@@H](C)c1ccc(F)cc1F ZINC000019915156 262178104 /nfs/dbraw/zinc/17/81/04/262178104.db2.gz GUFJJSPOXOFFGX-KBPBESRZSA-N 1 3 298.421 4.126 20 0 CIADHO CCC[C@H](C)[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000390767700 262338497 /nfs/dbraw/zinc/33/84/97/262338497.db2.gz JDVPBGDSEOZYTE-HKUYNNGSSA-N 1 3 288.479 4.067 20 0 CIADHO CCC[C@H](C)[NH2+]C[C@H]1CCCCN(Cc2ccccc2)C1 ZINC000390767706 262338584 /nfs/dbraw/zinc/33/85/84/262338584.db2.gz JDVPBGDSEOZYTE-PKOBYXMFSA-N 1 3 288.479 4.067 20 0 CIADHO CC(C)[C@H]1C[C@@H](NCc2ccc(C[NH3+])cc2)c2ccccc21 ZINC000571284523 328097647 /nfs/dbraw/zinc/09/76/47/328097647.db2.gz ALYSORLYSZZPLL-WOJBJXKFSA-N 1 3 294.442 4.120 20 0 CIADHO CC(C)[C@H]1C[C@H](NCc2ccc(C[NH3+])cc2)c2ccccc21 ZINC000571284521 328097719 /nfs/dbraw/zinc/09/77/19/328097719.db2.gz ALYSORLYSZZPLL-UXHICEINSA-N 1 3 294.442 4.120 20 0 CIADHO CCC[C@@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1ccsc1 ZINC000187768655 328302109 /nfs/dbraw/zinc/30/21/09/328302109.db2.gz QFFSOKSQJQOOEE-MRXNPFEDSA-N 1 3 294.508 4.442 20 0 CIADHO Cc1cc([C@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c(C)s1 ZINC000088163893 327016751 /nfs/dbraw/zinc/01/67/51/327016751.db2.gz DZKPDSFFRODJLC-WWTUQBGBSA-N 1 3 292.492 4.031 20 0 CIADHO Cc1cc([C@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c(C)s1 ZINC000088163893 327016752 /nfs/dbraw/zinc/01/67/52/327016752.db2.gz DZKPDSFFRODJLC-WWTUQBGBSA-N 1 3 292.492 4.031 20 0 CIADHO C[C@@H]([NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1)c1ccsc1 ZINC000183184093 329245173 /nfs/dbraw/zinc/24/51/73/329245173.db2.gz UHDQSROERUAYHE-RBSFLKMASA-N 1 3 292.492 4.052 20 0 CIADHO Cc1ccccc1[C@H]([NH2+][C@H]1C[C@@H](N)c2ccccc21)C(C)C ZINC000422719769 330152095 /nfs/dbraw/zinc/15/20/95/330152095.db2.gz ZFOWSWVOAYGFLP-HSALFYBXSA-N 1 3 294.442 4.427 20 0 CIADHO CCCC[C@H](CCC)C[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000422865199 330158219 /nfs/dbraw/zinc/15/82/19/330158219.db2.gz OKQRMKRCCAECDI-HOCLYGCPSA-N 1 3 291.483 4.106 20 0 CIADHO CC(C)(C)C[C@@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(F)cc1 ZINC000422903496 330162229 /nfs/dbraw/zinc/16/22/29/330162229.db2.gz WGDHNCVDMSSDSC-IAGOWNOFSA-N 1 3 292.442 4.035 20 0 CIADHO C[C@H](N)C[C@H](C)[NH2+][C@H]1CCC[C@@H](c2cccc(Cl)c2)C1 ZINC000423165408 330174008 /nfs/dbraw/zinc/17/40/08/330174008.db2.gz PYGWPTXVTVZPPT-LBEHMCEESA-N 1 3 294.870 4.082 20 0 CIADHO C[C@@H](NCCC[NH3+])c1ccc(-c2ccccc2Cl)s1 ZINC000423178927 330175183 /nfs/dbraw/zinc/17/51/83/330175183.db2.gz LHYUJEWOHUOYJE-LLVKDONJSA-N 1 3 294.851 4.068 20 0 CIADHO C[C@H](NC[C@H]1CCC[NH2+]C1)c1cccc(-c2ccccc2)c1 ZINC000423207827 330177498 /nfs/dbraw/zinc/17/74/98/330177498.db2.gz HHHDEYJBLDSIBP-IRXDYDNUSA-N 1 3 294.442 4.004 20 0 CIADHO Cc1cc(C)c([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)cc1C ZINC000423291182 330187030 /nfs/dbraw/zinc/18/70/30/330187030.db2.gz HDYLUTZOTIWIAK-SJORKVTESA-N 1 3 296.458 4.482 20 0 CIADHO Cc1ccc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)cc1C ZINC000423291497 330187224 /nfs/dbraw/zinc/18/72/24/330187224.db2.gz INSXSJBMABSALO-HZPDHXFCSA-N 1 3 282.431 4.174 20 0 CIADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccc(Cl)s1 ZINC000423291001 330187236 /nfs/dbraw/zinc/18/72/36/330187236.db2.gz GGMBMEWNXAURIP-WDEREUQCSA-N 1 3 294.851 4.272 20 0 CIADHO Cc1ccc2c(c1)[C@H](NCc1ccc([C@H](C)[NH3+])cc1)[C@@H](C)C2 ZINC000423292301 330187388 /nfs/dbraw/zinc/18/73/88/330187388.db2.gz MLIUNOYPJVAKQJ-AUSJPIAWSA-N 1 3 294.442 4.038 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2ccc3c(c2)CCC3)cc1 ZINC000423292328 330187518 /nfs/dbraw/zinc/18/75/18/330187518.db2.gz MNECGGLFGJNZDN-HUUCEWRRSA-N 1 3 294.442 4.046 20 0 CIADHO Cc1cccc2c1[C@H](C)C[C@H]2NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000423292361 330187531 /nfs/dbraw/zinc/18/75/31/330187531.db2.gz MSUMSHUEMOJBNT-SPYBWZPUSA-N 1 3 294.442 4.353 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2cccc(Cl)c2)cc1 ZINC000423292763 330187637 /nfs/dbraw/zinc/18/76/37/330187637.db2.gz OICCLYZUPIWHIL-STQMWFEESA-N 1 3 288.822 4.211 20 0 CIADHO Cc1cccc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c1C ZINC000423295998 330188299 /nfs/dbraw/zinc/18/82/99/330188299.db2.gz YEPLDGCMUASNAV-HOTGVXAUSA-N 1 3 282.431 4.174 20 0 CIADHO Cc1cc(C)cc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000423295188 330188347 /nfs/dbraw/zinc/18/83/47/330188347.db2.gz WJTXSFNJDGMWEI-CVEARBPZSA-N 1 3 282.431 4.174 20 0 CIADHO CCC[C@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccsc1 ZINC000423295308 330188352 /nfs/dbraw/zinc/18/83/52/330188352.db2.gz WKPFHUYWROJURP-GUYCJALGSA-N 1 3 288.460 4.399 20 0 CIADHO C[C@@H](CCCC[NH3+])N[C@@H](C)c1cc(Cl)sc1Cl ZINC000423429341 330198418 /nfs/dbraw/zinc/19/84/18/330198418.db2.gz KFQBHBWQJPGERJ-IUCAKERBSA-N 1 3 295.279 4.223 20 0 CIADHO CCc1ccc([C@H](CC)NCc2ccc3c(c2)C[NH2+]C3)cc1 ZINC000423386043 330199749 /nfs/dbraw/zinc/19/97/49/330199749.db2.gz LUHWDCZTEUNNMZ-FQEVSTJZSA-N 1 3 294.442 4.093 20 0 CIADHO CC[C@@H](NCCC[C@@H]1CCC[NH2+]1)c1cccc(Cl)c1F ZINC000423476357 330205568 /nfs/dbraw/zinc/20/55/68/330205568.db2.gz IZYGCRGMRLWFHC-SWLSCSKDSA-N 1 3 298.833 4.052 20 0 CIADHO Cc1ccc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)c(C)c1 ZINC000423497389 330207912 /nfs/dbraw/zinc/20/79/12/330207912.db2.gz GWBWRHGYDYJCSA-FXAWDEMLSA-N 1 3 296.458 4.434 20 0 CIADHO Cc1cccc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c1C ZINC000423502533 330208428 /nfs/dbraw/zinc/20/84/28/330208428.db2.gz MAUHMAZFUMAUBY-XLIONFOSSA-N 1 3 296.458 4.434 20 0 CIADHO C[C@@H]1C[C@H](N[C@H](CCC[NH3+])c2ccccc2)c2ccccc21 ZINC000423510224 330209042 /nfs/dbraw/zinc/20/90/42/330209042.db2.gz MIEMXZXXCLPAOM-YSGRDPCXSA-N 1 3 294.442 4.305 20 0 CIADHO Cc1ccc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)cc1C ZINC000423513122 330209283 /nfs/dbraw/zinc/20/92/83/330209283.db2.gz VFDLPUAKJJSDNA-FXAWDEMLSA-N 1 3 296.458 4.434 20 0 CIADHO CCC[C@@H](NC[C@H]1CCC[N@H+](C)C1)c1ccc(Cl)cc1 ZINC000044534219 330329696 /nfs/dbraw/zinc/32/96/96/330329696.db2.gz CKEZPZSIECDXFF-RHSMWYFYSA-N 1 3 294.870 4.113 20 0 CIADHO CCC[C@@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1 ZINC000044534219 330329697 /nfs/dbraw/zinc/32/96/97/330329697.db2.gz CKEZPZSIECDXFF-RHSMWYFYSA-N 1 3 294.870 4.113 20 0 CIADHO CC(C)[C@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)c1ccccc1 ZINC000536998892 330375387 /nfs/dbraw/zinc/37/53/87/330375387.db2.gz PGMMGDAUSKUUCW-HKUYNNGSSA-N 1 3 288.479 4.094 20 0 CIADHO CC(C)[C@H](NC[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1 ZINC000536998892 330375388 /nfs/dbraw/zinc/37/53/88/330375388.db2.gz PGMMGDAUSKUUCW-HKUYNNGSSA-N 1 3 288.479 4.094 20 0 CIADHO CC(C)[C@H](NC[C@@H]1CCC[N@H+](C(C)C)C1)c1ccccc1 ZINC000536998892 330375389 /nfs/dbraw/zinc/37/53/89/330375389.db2.gz PGMMGDAUSKUUCW-HKUYNNGSSA-N 1 3 288.479 4.094 20 0 CIADHO CC(C)[C@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)c1ccccc1 ZINC000536998894 330375469 /nfs/dbraw/zinc/37/54/69/330375469.db2.gz PGMMGDAUSKUUCW-MJGOQNOKSA-N 1 3 288.479 4.094 20 0 CIADHO CC(C)[C@H](NC[C@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1 ZINC000536998894 330375470 /nfs/dbraw/zinc/37/54/70/330375470.db2.gz PGMMGDAUSKUUCW-MJGOQNOKSA-N 1 3 288.479 4.094 20 0 CIADHO CC(C)[C@H](NC[C@H]1CCC[N@H+](C(C)C)C1)c1ccccc1 ZINC000536998894 330375471 /nfs/dbraw/zinc/37/54/71/330375471.db2.gz PGMMGDAUSKUUCW-MJGOQNOKSA-N 1 3 288.479 4.094 20 0 CIADHO CCC(C)(C)C[NH2+]C1CCN([C@H]2CCC[C@@H](C)C2)CC1 ZINC000429434720 330546517 /nfs/dbraw/zinc/54/65/17/330546517.db2.gz IIAOBQVAGIUZAN-WBVHZDCISA-N 1 3 280.500 4.055 20 0 CIADHO C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000434779975 330645150 /nfs/dbraw/zinc/64/51/50/330645150.db2.gz WRFZOQJKAHTDOW-CRAIPNDOSA-N 1 3 292.511 4.055 20 0 CIADHO CCC[N@@H+]1CC[C@H](CN[C@H]2CC[C@@H](C)c3ccsc32)C1 ZINC000453097108 331088892 /nfs/dbraw/zinc/08/88/92/331088892.db2.gz OMZNYFKFYYWIJV-FMKPAKJESA-N 1 3 292.492 4.008 20 0 CIADHO CCC[N@H+]1CC[C@H](CN[C@H]2CC[C@@H](C)c3ccsc32)C1 ZINC000453097108 331088893 /nfs/dbraw/zinc/08/88/93/331088893.db2.gz OMZNYFKFYYWIJV-FMKPAKJESA-N 1 3 292.492 4.008 20 0 CIADHO CCCN1CC[C@H](C[NH2+][C@H]2CC[C@@H](C)c3ccsc32)C1 ZINC000453097108 331088894 /nfs/dbraw/zinc/08/88/94/331088894.db2.gz OMZNYFKFYYWIJV-FMKPAKJESA-N 1 3 292.492 4.008 20 0 CIADHO C[C@@H]1CC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)[C@H](C)C1 ZINC000482965225 331854553 /nfs/dbraw/zinc/85/45/53/331854553.db2.gz TWSPHLVCDLWXRM-MDZRGWNJSA-N 1 3 292.511 4.198 20 0 CIADHO CC[NH+](CC)CCC[C@@H](C)N[C@@H](C)c1cc(C)c(C)o1 ZINC000502687409 332669045 /nfs/dbraw/zinc/66/90/45/332669045.db2.gz PRBLJNSAPSQYPJ-CABCVRRESA-N 1 3 280.456 4.058 20 0 CIADHO CC1(C)CCCC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000513341106 333014698 /nfs/dbraw/zinc/01/46/98/333014698.db2.gz QKXGGYVJUBRRNA-SFHVURJKSA-N 1 3 292.511 4.342 20 0 CIADHO CC[NH+](CC)CCC[C@H](C)Nc1ccnc2ccccc21 ZINC000006382155 333082505 /nfs/dbraw/zinc/08/25/05/333082505.db2.gz CAUPTGHSTDHRCZ-HNNXBMFYSA-N 1 3 285.435 4.157 20 0 CIADHO C[NH+](C)CC[C@@H](NCc1ccc2ccccc2c1)C(C)(C)C ZINC000523863931 333348629 /nfs/dbraw/zinc/34/86/29/333348629.db2.gz CZWWFVWIVSWXDS-LJQANCHMSA-N 1 3 298.474 4.296 20 0 CIADHO CCCCN1CCC([NH2+]Cc2ccc3ccccc3c2)CC1 ZINC000236767439 333375470 /nfs/dbraw/zinc/37/54/70/333375470.db2.gz YUUWBTCNTGWMDD-UHFFFAOYSA-N 1 3 296.458 4.194 20 0 CIADHO CCC1(C[NH2+]C2CCN(C(C)(C)C)CC2)CCCCC1 ZINC000547283204 334075848 /nfs/dbraw/zinc/07/58/48/334075848.db2.gz BXSZWVUASBCZQY-UHFFFAOYSA-N 1 3 280.500 4.199 20 0 CIADHO CC(C)(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCN3CCC[C@H]3C2)CC1 ZINC000250689946 334348772 /nfs/dbraw/zinc/34/87/72/334348772.db2.gz IYAYCZXMBMJFAW-XDNAFOTISA-N 1 3 292.511 4.198 20 0 CIADHO C[C@@H](c1cccc2ccccc21)[N@@H+]1CCC[C@H](N(C)C)CC1 ZINC000576416290 335201345 /nfs/dbraw/zinc/20/13/45/335201345.db2.gz YYRGKVGTUGGNLL-WMZOPIPTSA-N 1 3 296.458 4.317 20 0 CIADHO C[C@@H](c1cccc2ccccc21)[N@H+]1CCC[C@H](N(C)C)CC1 ZINC000576416290 335201346 /nfs/dbraw/zinc/20/13/46/335201346.db2.gz YYRGKVGTUGGNLL-WMZOPIPTSA-N 1 3 296.458 4.317 20 0 CIADHO C[C@@H](c1cccc2ccccc21)N1CCC[C@H]([NH+](C)C)CC1 ZINC000576416290 335201347 /nfs/dbraw/zinc/20/13/47/335201347.db2.gz YYRGKVGTUGGNLL-WMZOPIPTSA-N 1 3 296.458 4.317 20 0 CIADHO CC(C)Cc1cccc([C@@H](C)NCc2ccc(C[NH3+])cc2)c1 ZINC000577178481 335317054 /nfs/dbraw/zinc/31/70/54/335317054.db2.gz ZYEMPUMXBFKVBT-MRXNPFEDSA-N 1 3 296.458 4.195 20 0 CIADHO CC[C@H]([NH2+]CCCN1CCCC[C@H]1C)c1ccsc1 ZINC000382129481 336082170 /nfs/dbraw/zinc/08/21/70/336082170.db2.gz OJFOXQUNPGGOQS-ZBFHGGJFSA-N 1 3 280.481 4.053 20 0 CIADHO CC(C)CC[C@H](NCC1(C)CC[NH+](C)CC1)c1ccoc1 ZINC000353683912 527845634 /nfs/dbraw/zinc/84/56/34/527845634.db2.gz GMFHGNRCFNUOOV-KRWDZBQOSA-N 1 3 292.467 4.078 20 0 CIADHO CC[NH+](CC)CCC[C@@H](C)NCc1ccsc1Cl ZINC000312589045 260163324 /nfs/dbraw/zinc/16/33/24/260163324.db2.gz UUMQXTPANJPDJE-GFCCVEGCSA-N 1 3 288.888 4.002 20 0 CIADHO CCC[NH+]1CCC(N[C@H]2CC[C@H](C)c3ccccc32)CC1 ZINC000126469536 260353272 /nfs/dbraw/zinc/35/32/72/260353272.db2.gz GTUZDPBCNLXQNR-KXBFYZLASA-N 1 3 286.463 4.089 20 0 CIADHO CCC[C@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)c1ccsc1 ZINC000187701417 263266155 /nfs/dbraw/zinc/26/61/55/263266155.db2.gz JPFUMZGKONDXOP-RDJZCZTQSA-N 1 3 294.508 4.299 20 0 CIADHO CCC[C@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)c1ccsc1 ZINC000187701456 263266680 /nfs/dbraw/zinc/26/66/80/263266680.db2.gz JPFUMZGKONDXOP-WBVHZDCISA-N 1 3 294.508 4.299 20 0 CIADHO Cc1cccc(CNCc2cccc(C[N@@H+](C)C(C)C)c2)c1 ZINC000065976627 265007535 /nfs/dbraw/zinc/00/75/35/265007535.db2.gz QPNYCRLCZFLLFI-UHFFFAOYSA-N 1 3 296.458 4.125 20 0 CIADHO Cc1cccc(CNCc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000065976627 265007537 /nfs/dbraw/zinc/00/75/37/265007537.db2.gz QPNYCRLCZFLLFI-UHFFFAOYSA-N 1 3 296.458 4.125 20 0 CIADHO C[C@H]([NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1)c1ccsc1 ZINC000183184044 329245240 /nfs/dbraw/zinc/24/52/40/329245240.db2.gz UHDQSROERUAYHE-SOUVJXGZSA-N 1 3 292.492 4.052 20 0 CIADHO C[C@@H](N[C@@H](C)CCCC[NH3+])c1cccc(Cl)c1Cl ZINC000422754009 330153541 /nfs/dbraw/zinc/15/35/41/330153541.db2.gz FRCIGCVXRRRYEL-WDEREUQCSA-N 1 3 289.250 4.162 20 0 CIADHO c1ccc([C@@H](CC2CCCC2)NC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000423002954 330167525 /nfs/dbraw/zinc/16/75/25/330167525.db2.gz KIHFHNBGWNBKFC-JIRNRHONSA-N 1 3 298.474 4.181 20 0 CIADHO CCc1ccc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423290045 330186361 /nfs/dbraw/zinc/18/63/61/330186361.db2.gz CCNBDWJCTTXUMH-CABCVRRESA-N 1 3 282.431 4.120 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CC[C@@H](C)c3ccccc32)cc1 ZINC000423290283 330186914 /nfs/dbraw/zinc/18/69/14/330186914.db2.gz CQGVAPPZUCMJJD-QEEYODRMSA-N 1 3 294.442 4.435 20 0 CIADHO CC[C@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccc(C)c1 ZINC000423290545 330186943 /nfs/dbraw/zinc/18/69/43/330186943.db2.gz DKYKCQUFHXSKTN-KXBFYZLASA-N 1 3 282.431 4.256 20 0 CIADHO CCC[C@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccccc1 ZINC000423291599 330186987 /nfs/dbraw/zinc/18/69/87/330186987.db2.gz IXNIPMBBFBMUQX-KXBFYZLASA-N 1 3 282.431 4.337 20 0 CIADHO CCC[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccccc1 ZINC000423291597 330187041 /nfs/dbraw/zinc/18/70/41/330187041.db2.gz IXNIPMBBFBMUQX-DNVCBOLYSA-N 1 3 282.431 4.337 20 0 CIADHO CC(C)[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccccc1 ZINC000423292105 330187395 /nfs/dbraw/zinc/18/73/95/330187395.db2.gz LJHZFWQXPNIWPZ-DNVCBOLYSA-N 1 3 282.431 4.193 20 0 CIADHO Cc1cccc2c1[C@H](C)C[C@@H]2NCc1ccc([C@H](C)[NH3+])cc1 ZINC000423292362 330187542 /nfs/dbraw/zinc/18/75/42/330187542.db2.gz MSUMSHUEMOJBNT-VCBZYWHSSA-N 1 3 294.442 4.353 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc(Cl)cc2)cc1 ZINC000423292526 330187604 /nfs/dbraw/zinc/18/76/04/330187604.db2.gz NGMAEMUGJCPEIM-OLZOCXBDSA-N 1 3 288.822 4.211 20 0 CIADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccc(Cl)c1 ZINC000423292762 330187778 /nfs/dbraw/zinc/18/77/78/330187778.db2.gz OICCLYZUPIWHIL-QWHCGFSZSA-N 1 3 288.822 4.211 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@@H]2CC(C)(C)c3ccccc32)cc1 ZINC000423295202 330188329 /nfs/dbraw/zinc/18/83/29/330188329.db2.gz WKMRGFIXRFRDJQ-AUUYWEPGSA-N 1 3 294.442 4.219 20 0 CIADHO CCc1ccc([C@@H](CC)NCc2ccc3c(c2)C[NH2+]C3)cc1 ZINC000423386044 330199527 /nfs/dbraw/zinc/19/95/27/330199527.db2.gz LUHWDCZTEUNNMZ-HXUWFJFHSA-N 1 3 294.442 4.093 20 0 CIADHO CCCC[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccccc1 ZINC000423388287 330200139 /nfs/dbraw/zinc/20/01/39/330200139.db2.gz NJPXTGGRDDJWCH-HXUWFJFHSA-N 1 3 294.442 4.311 20 0 CIADHO C[C@@H]([NH2+][C@@H](C)c1ccc(SC2CCCC2)cc1)[C@H](C)N ZINC000423442238 330201926 /nfs/dbraw/zinc/20/19/26/330201926.db2.gz JSBVVOBVMXPUJC-MJBXVCDLSA-N 1 3 292.492 4.108 20 0 CIADHO Cc1cc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c(C)o1 ZINC000423510109 330209088 /nfs/dbraw/zinc/20/90/88/330209088.db2.gz SBRFCQITVZSPNA-KSSFIOAISA-N 1 3 286.419 4.027 20 0 CIADHO Cc1cc(C)cc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000423510870 330209132 /nfs/dbraw/zinc/20/91/32/330209132.db2.gz SOOWQQAPWGMFIX-PXNSSMCTSA-N 1 3 296.458 4.434 20 0 CIADHO Cc1ccsc1[C@@H](C)N[C@@H](CCC[NH3+])c1ccccc1 ZINC000423514297 330209397 /nfs/dbraw/zinc/20/93/97/330209397.db2.gz WESXLHNOVVFWLJ-ZBFHGGJFSA-N 1 3 288.460 4.187 20 0 CIADHO CC[C@@H](N[C@@H](CCC[NH3+])c1ccccc1)c1cccs1 ZINC000423513917 330209493 /nfs/dbraw/zinc/20/94/93/330209493.db2.gz VUIFCTYQUKCOSW-CVEARBPZSA-N 1 3 288.460 4.269 20 0 CIADHO Cc1cccc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000423518694 330209621 /nfs/dbraw/zinc/20/96/21/330209621.db2.gz ZQAXLHHQBZXVKG-APWZRJJASA-N 1 3 282.431 4.126 20 0 CIADHO Cc1cccc([C@@H](NC2CC[NH+](C(C)C)CC2)C(C)C)c1 ZINC000527866422 330285762 /nfs/dbraw/zinc/28/57/62/330285762.db2.gz PHYSYOBWPJUJBF-IBGZPJMESA-N 1 3 288.479 4.155 20 0 CIADHO CCCCc1ccc([C@H](C)NC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000044534286 330329681 /nfs/dbraw/zinc/32/96/81/330329681.db2.gz FQQMNYQITMFVMH-WMZOPIPTSA-N 1 3 288.479 4.022 20 0 CIADHO CCCCc1ccc([C@H](C)NC[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000044534286 330329682 /nfs/dbraw/zinc/32/96/82/330329682.db2.gz FQQMNYQITMFVMH-WMZOPIPTSA-N 1 3 288.479 4.022 20 0 CIADHO Cc1cc(C)cc([C@@H](C)NCc2ccc(C[NH+](C)C)cc2)c1 ZINC000107320060 330348924 /nfs/dbraw/zinc/34/89/24/330348924.db2.gz OGARLHXMOPZQGK-QGZVFWFLSA-N 1 3 296.458 4.216 20 0 CIADHO CC[NH+](CC)Cc1ccccc1CN[C@H](C)c1ccccc1 ZINC000120893765 330393855 /nfs/dbraw/zinc/39/38/55/330393855.db2.gz UREUHRQQRBNOGI-QGZVFWFLSA-N 1 3 296.458 4.379 20 0 CIADHO CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000430711942 330571094 /nfs/dbraw/zinc/57/10/94/330571094.db2.gz GGRNNNBVTJTRHO-FCEWJHQRSA-N 1 3 292.511 4.198 20 0 CIADHO CCC[N@@H+]1CC[C@H](CN[C@H]2CC[C@H](C)c3ccsc32)C1 ZINC000453097110 331088839 /nfs/dbraw/zinc/08/88/39/331088839.db2.gz OMZNYFKFYYWIJV-LZWOXQAQSA-N 1 3 292.492 4.008 20 0 CIADHO CCC[N@H+]1CC[C@H](CN[C@H]2CC[C@H](C)c3ccsc32)C1 ZINC000453097110 331088840 /nfs/dbraw/zinc/08/88/40/331088840.db2.gz OMZNYFKFYYWIJV-LZWOXQAQSA-N 1 3 292.492 4.008 20 0 CIADHO CCCN1CC[C@H](C[NH2+][C@H]2CC[C@H](C)c3ccsc32)C1 ZINC000453097110 331088841 /nfs/dbraw/zinc/08/88/41/331088841.db2.gz OMZNYFKFYYWIJV-LZWOXQAQSA-N 1 3 292.492 4.008 20 0 CIADHO CC(C)C1CCC([NH2+]Cc2ccc(CN(C)C)cc2)CC1 ZINC000462673889 331324975 /nfs/dbraw/zinc/32/49/75/331324975.db2.gz GRQHIJMNZXLGAB-UHFFFAOYSA-N 1 3 288.479 4.053 20 0 CIADHO C[C@@H]1CCC[C@@H]1C[NH2+]C1CCN([C@H]2CCCC[C@@H]2C)CC1 ZINC000467452253 331420227 /nfs/dbraw/zinc/42/02/27/331420227.db2.gz DHJZKIKHNHBUCR-NTDBWNAOSA-N 1 3 292.511 4.055 20 0 CIADHO C[C@@H]1CC[C@H](C[NH2+]C2CCN([C@@H]3CCC[C@H](C)C3)CC2)C1 ZINC000475555218 331636661 /nfs/dbraw/zinc/63/66/61/331636661.db2.gz PKLBSMMUCJKVRZ-MJQMVNBJSA-N 1 3 292.511 4.055 20 0 CIADHO CC[C@H](C)C[C@@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000513023402 332999457 /nfs/dbraw/zinc/99/94/57/332999457.db2.gz HSXPCUHERXMFGO-JKSUJKDBSA-N 1 3 280.500 4.198 20 0 CIADHO CCCCc1ccc([C@H](C)N[C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000224107152 333216915 /nfs/dbraw/zinc/21/69/15/333216915.db2.gz NOYOPTSKXFZMEH-BXWFABGCSA-N 1 3 288.479 4.163 20 0 CIADHO CCCCc1ccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000224107152 333216916 /nfs/dbraw/zinc/21/69/16/333216916.db2.gz NOYOPTSKXFZMEH-BXWFABGCSA-N 1 3 288.479 4.163 20 0 CIADHO CC(C)N(C)CCC[NH2+][C@H](C)c1ccc2ccccc2c1 ZINC000226312823 333256383 /nfs/dbraw/zinc/25/63/83/333256383.db2.gz XRSQNWYDGNQVOC-MRXNPFEDSA-N 1 3 284.447 4.221 20 0 CIADHO C[C@H](N[C@@H](CC[NH+](C)C)C(C)(C)C)c1cccc(Cl)c1 ZINC000522546429 333289523 /nfs/dbraw/zinc/28/95/23/333289523.db2.gz MCYYDWVQDVKBCG-BBRMVZONSA-N 1 3 296.886 4.357 20 0 CIADHO Cc1cc(C)cc([C@@H](C)NCc2cccc(C[NH+](C)C)c2)c1 ZINC000123583283 333548667 /nfs/dbraw/zinc/54/86/67/333548667.db2.gz VABUEPXCWHOWHD-QGZVFWFLSA-N 1 3 296.458 4.216 20 0 CIADHO CC(C)C[C@H](NCc1ccc(C[NH3+])cc1)c1ccccc1 ZINC000566244962 334638186 /nfs/dbraw/zinc/63/81/86/334638186.db2.gz PQAPKIUVNLAERQ-IBGZPJMESA-N 1 3 282.431 4.022 20 0 CIADHO CC(C)c1ccc([C@@H](C)NCc2ccc(C[NH3+])cc2)cc1 ZINC000568395035 334822682 /nfs/dbraw/zinc/82/26/82/334822682.db2.gz MHTQAHPTFIGHSN-OAHLLOKOSA-N 1 3 282.431 4.120 20 0 CIADHO CC(C)N1CC[C@H](C[NH2+]C2CCC3(CCCCC3)CC2)C1 ZINC000577661947 335386977 /nfs/dbraw/zinc/38/69/77/335386977.db2.gz FDXJIBQRGDDOEK-QGZVFWFLSA-N 1 3 292.511 4.199 20 0 CIADHO CCCCN1CCC([NH2+][C@@H](CC)c2ccsc2)CC1 ZINC000382195457 336084454 /nfs/dbraw/zinc/08/44/54/336084454.db2.gz ZSVAWIVCLDMMQT-INIZCTEOSA-N 1 3 280.481 4.053 20 0 CIADHO C[C@H](CNCc1cccc2ccccc21)C[NH+]1CCCCC1 ZINC000386938482 336182891 /nfs/dbraw/zinc/18/28/91/336182891.db2.gz QHOGLBIHPKXZQH-QGZVFWFLSA-N 1 3 296.458 4.051 20 0 CIADHO C[C@H](C[NH2+]Cc1cccc2ccccc21)CN1CCCCC1 ZINC000386938482 336182892 /nfs/dbraw/zinc/18/28/92/336182892.db2.gz QHOGLBIHPKXZQH-QGZVFWFLSA-N 1 3 296.458 4.051 20 0 CIADHO CC(C)(C)[C@@H]1CC[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000574185154 334999072 /nfs/dbraw/zinc/99/90/72/334999072.db2.gz OQVMMQUJTCUSDN-MSOLQXFVSA-N 1 3 292.511 4.198 20 0 CIADHO CC(C)(C)[C@H]1CC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000574185157 334999217 /nfs/dbraw/zinc/99/92/17/334999217.db2.gz OQVMMQUJTCUSDN-ZWKOTPCHSA-N 1 3 292.511 4.198 20 0 CIADHO CCC[NH+]1CCC(N[C@@H]2CC[C@@H](C)c3ccccc32)CC1 ZINC000126469750 260353398 /nfs/dbraw/zinc/35/33/98/260353398.db2.gz GTUZDPBCNLXQNR-DNVCBOLYSA-N 1 3 286.463 4.089 20 0 CIADHO CC[NH+]1CCC(N[C@@H](C)c2cccc(CC(C)C)c2)CC1 ZINC000514082260 261198871 /nfs/dbraw/zinc/19/88/71/261198871.db2.gz GIPLGHIBTXAFBJ-INIZCTEOSA-N 1 3 288.479 4.020 20 0 CIADHO CC[C@H]([NH2+]CCCN1CCCC[C@@H]1C)c1cccs1 ZINC000021511647 262389492 /nfs/dbraw/zinc/38/94/92/262389492.db2.gz BPURHOFCJHXMOS-GJZGRUSLSA-N 1 3 280.481 4.053 20 0 CIADHO Cc1oc2ccccc2c1CNCc1ccc([C@@H](C)[NH3+])cc1 ZINC000414815436 263053922 /nfs/dbraw/zinc/05/39/22/263053922.db2.gz XOSQVQMDJYYSNE-CYBMUJFWSA-N 1 3 294.398 4.051 20 0 CIADHO Cc1cc(C)c(CN[C@H](CCC[NH3+])c2ccccc2)cc1C ZINC000415059180 263258759 /nfs/dbraw/zinc/25/87/59/263258759.db2.gz UPHOBBWCAROTLC-HXUWFJFHSA-N 1 3 296.458 4.182 20 0 CIADHO C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(CCC2CCCC2)C1 ZINC000303944196 328370821 /nfs/dbraw/zinc/37/08/21/328370821.db2.gz UEUMRYSRNMIHGJ-MJGOQNOKSA-N 1 3 292.511 4.153 20 0 CIADHO C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(CCC2CCCC2)C1 ZINC000303944196 328370823 /nfs/dbraw/zinc/37/08/23/328370823.db2.gz UEUMRYSRNMIHGJ-MJGOQNOKSA-N 1 3 292.511 4.153 20 0 CIADHO C[C@@H]1CCCCN1C[C@H]1CCC[N@H+](CCC2CCCC2)C1 ZINC000303944196 328370825 /nfs/dbraw/zinc/37/08/25/328370825.db2.gz UEUMRYSRNMIHGJ-MJGOQNOKSA-N 1 3 292.511 4.153 20 0 CIADHO C[C@@H]1CCCCN1C[C@H]1CCC[N@@H+](CCC2CCCC2)C1 ZINC000303944196 328370826 /nfs/dbraw/zinc/37/08/26/328370826.db2.gz UEUMRYSRNMIHGJ-MJGOQNOKSA-N 1 3 292.511 4.153 20 0 CIADHO CC(C)(C)CCC[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000557267589 326999075 /nfs/dbraw/zinc/99/90/75/326999075.db2.gz GZSIQAPEEUQFBD-UHFFFAOYSA-N 1 3 280.500 4.199 20 0 CIADHO [NH3+][C@@H]1C[C@H](N[C@@H]2CCC[C@@H]2c2ccccc2)c2ccccc21 ZINC000422702893 330151158 /nfs/dbraw/zinc/15/11/58/330151158.db2.gz GJCGVCGOODGFGC-XLNTUCKNSA-N 1 3 292.426 4.057 20 0 CIADHO Cc1ccccc1[C@H]([NH2+][C@@H]1C[C@@H](N)c2ccccc21)C(C)C ZINC000422719900 330152030 /nfs/dbraw/zinc/15/20/30/330152030.db2.gz ZFOWSWVOAYGFLP-VAMGGRTRSA-N 1 3 294.442 4.427 20 0 CIADHO CC[C@H](C)[C@H](N[C@@H](C)[C@@H]1CC[NH2+]C1)c1ccc(Cl)cc1 ZINC000422789482 330157551 /nfs/dbraw/zinc/15/75/51/330157551.db2.gz WWWFCKKZUQDVRN-LBEHMCEESA-N 1 3 294.870 4.015 20 0 CIADHO CC(C)(C)C[C@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1 ZINC000422871344 330158258 /nfs/dbraw/zinc/15/82/58/330158258.db2.gz ZWDVIBJGWPVPKK-WFFDWFOESA-N 1 3 286.463 4.037 20 0 CIADHO CC(C)(C)C[C@H](N[C@H]1CCC[NH2+]CC1)c1ccc(F)cc1 ZINC000422903497 330162358 /nfs/dbraw/zinc/16/23/58/330162358.db2.gz WGDHNCVDMSSDSC-IRXDYDNUSA-N 1 3 292.442 4.035 20 0 CIADHO C[C@@H](NC[C@H]1CCC[NH2+]C1)c1cccc(-c2ccccc2)c1 ZINC000423207830 330177391 /nfs/dbraw/zinc/17/73/91/330177391.db2.gz HHHDEYJBLDSIBP-SJORKVTESA-N 1 3 294.442 4.004 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CCCc3ccc(F)cc32)cc1 ZINC000423289900 330186338 /nfs/dbraw/zinc/18/63/38/330186338.db2.gz BYNXORFZFNBPNJ-DJJJIMSYSA-N 1 3 298.405 4.013 20 0 CIADHO CC[C@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccs1 ZINC000423289833 330186413 /nfs/dbraw/zinc/18/64/13/330186413.db2.gz BQXLVBVATZLDRF-WFASDCNBSA-N 1 3 274.433 4.009 20 0 CIADHO Cc1ccc2c(c1)[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)CCC2 ZINC000423290901 330186979 /nfs/dbraw/zinc/18/69/79/330186979.db2.gz FWQWGZGCMLFDHM-QRWLVFNGSA-N 1 3 294.442 4.182 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@@H]2CC(C)(C)Cc3occc32)cc1 ZINC000423291367 330187034 /nfs/dbraw/zinc/18/70/34/330187034.db2.gz HZUQGKUOZJLLLE-CXAGYDPISA-N 1 3 298.430 4.103 20 0 CIADHO Cc1ccc2c(c1)[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)CCC2 ZINC000423290902 330187114 /nfs/dbraw/zinc/18/71/14/330187114.db2.gz FWQWGZGCMLFDHM-YWZLYKJASA-N 1 3 294.442 4.182 20 0 CIADHO CC[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccc(F)cc1 ZINC000423291415 330187226 /nfs/dbraw/zinc/18/72/26/330187226.db2.gz IFQRWTMZBMIDGQ-FZKQIMNGSA-N 1 3 286.394 4.086 20 0 CIADHO Cc1cc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c(C)s1 ZINC000423292356 330187376 /nfs/dbraw/zinc/18/73/76/330187376.db2.gz MSMRSLAINXSNDT-QWHCGFSZSA-N 1 3 288.460 4.235 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc3c(c2)CCC3)cc1 ZINC000423292326 330187507 /nfs/dbraw/zinc/18/75/07/330187507.db2.gz MNECGGLFGJNZDN-CABCVRRESA-N 1 3 294.442 4.046 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CCSc3ccccc32)cc1 ZINC000423292562 330187678 /nfs/dbraw/zinc/18/76/78/330187678.db2.gz NIHWZYRRIONHMR-GUYCJALGSA-N 1 3 298.455 4.033 20 0 CIADHO CC[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccsc1 ZINC000423292885 330187788 /nfs/dbraw/zinc/18/77/88/330187788.db2.gz OVADJWSYIYXNEL-MLGOLLRUSA-N 1 3 274.433 4.009 20 0 CIADHO Cc1cc(C)cc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000423295191 330188250 /nfs/dbraw/zinc/18/82/50/330188250.db2.gz WJTXSFNJDGMWEI-JKSUJKDBSA-N 1 3 282.431 4.174 20 0 CIADHO CC(C)Sc1ccc([C@H](C)N[C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000423398995 330195933 /nfs/dbraw/zinc/19/59/33/330195933.db2.gz UMNQGQKLTOSGCA-BPUTZDHNSA-N 1 3 292.492 4.108 20 0 CIADHO C[C@H]1CC[C@@H](NCc2ccc3c(c2)C[NH2+]C3)c2sccc21 ZINC000423398977 330195959 /nfs/dbraw/zinc/19/59/59/330195959.db2.gz ULGGVQGYSBQVBC-YVEFUNNKSA-N 1 3 298.455 4.080 20 0 CIADHO Cc1ccc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c(C)c1 ZINC000423497392 330207767 /nfs/dbraw/zinc/20/77/67/330207767.db2.gz GWBWRHGYDYJCSA-XLIONFOSSA-N 1 3 296.458 4.434 20 0 CIADHO Cc1cc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)c(C)o1 ZINC000423510104 330209014 /nfs/dbraw/zinc/20/90/14/330209014.db2.gz SBRFCQITVZSPNA-KBXCAEBGSA-N 1 3 286.419 4.027 20 0 CIADHO Cc1ccc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)s1 ZINC000423514833 330209321 /nfs/dbraw/zinc/20/93/21/330209321.db2.gz WTXMMDYVPZFRFS-HOCLYGCPSA-N 1 3 288.460 4.187 20 0 CIADHO Cc1ccc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)s1 ZINC000423514832 330209423 /nfs/dbraw/zinc/20/94/23/330209423.db2.gz WTXMMDYVPZFRFS-GOEBONIOSA-N 1 3 288.460 4.187 20 0 CIADHO CC[C@@H](N[C@H](CCC[NH3+])c1ccccc1)c1cccs1 ZINC000423513919 330209453 /nfs/dbraw/zinc/20/94/53/330209453.db2.gz VUIFCTYQUKCOSW-HZPDHXFCSA-N 1 3 288.460 4.269 20 0 CIADHO Cc1ccccc1[C@H](C)N[C@H](CCC[NH3+])c1ccccc1 ZINC000423518607 330209627 /nfs/dbraw/zinc/20/96/27/330209627.db2.gz ZKHVRICSJJRORO-QFBILLFUSA-N 1 3 282.431 4.126 20 0 CIADHO Cc1cc(C)cc([C@H](C)NCc2ccc(C[NH+](C)C)cc2)c1 ZINC000107320062 330348975 /nfs/dbraw/zinc/34/89/75/330348975.db2.gz OGARLHXMOPZQGK-KRWDZBQOSA-N 1 3 296.458 4.216 20 0 CIADHO CCC[NH+]1CCC(N[C@H]2CC[C@@H](C)c3ccsc32)CC1 ZINC000453076380 331086933 /nfs/dbraw/zinc/08/69/33/331086933.db2.gz HQFHKHOORXHNFT-CJNGLKHVSA-N 1 3 292.492 4.151 20 0 CIADHO CC[C@@H](NCc1ccc(C[NH+](C)C)cc1)c1ccsc1 ZINC000453098564 331088991 /nfs/dbraw/zinc/08/89/91/331088991.db2.gz VCNUZJSPZLBWBP-QGZVFWFLSA-N 1 3 288.460 4.051 20 0 CIADHO Cc1cc([C@H](C)[NH2+]C2CCN(C3CCCC3)CC2)cs1 ZINC000453120262 331091235 /nfs/dbraw/zinc/09/12/35/331091235.db2.gz CDVHSUCGLROZET-AWEZNQCLSA-N 1 3 292.492 4.114 20 0 CIADHO CC(C)C[C@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccs1 ZINC000453335916 331118402 /nfs/dbraw/zinc/11/84/02/331118402.db2.gz FCUUNTMOELBDQI-UYTSQGDYSA-N 1 3 292.492 4.050 20 0 CIADHO CC(C)C[C@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccs1 ZINC000453335916 331118403 /nfs/dbraw/zinc/11/84/03/331118403.db2.gz FCUUNTMOELBDQI-UYTSQGDYSA-N 1 3 292.492 4.050 20 0 CIADHO CC(C)[C@@H]1C[C@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc21 ZINC000453375640 331124725 /nfs/dbraw/zinc/12/47/25/331124725.db2.gz XYVTXAJVYATIPA-OUQUZMNPSA-N 1 3 298.474 4.086 20 0 CIADHO CC(C)[C@@H]1C[C@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc21 ZINC000453375640 331124726 /nfs/dbraw/zinc/12/47/26/331124726.db2.gz XYVTXAJVYATIPA-OUQUZMNPSA-N 1 3 298.474 4.086 20 0 CIADHO C[C@@H](NCCCC[N@@H+](C)C1CC1)c1ccc(F)cc1Cl ZINC000453397515 331128121 /nfs/dbraw/zinc/12/81/21/331128121.db2.gz JNWZAAMGYVCBAL-GFCCVEGCSA-N 1 3 298.833 4.004 20 0 CIADHO C[C@@H](NCCCC[N@H+](C)C1CC1)c1ccc(F)cc1Cl ZINC000453397515 331128120 /nfs/dbraw/zinc/12/81/20/331128120.db2.gz JNWZAAMGYVCBAL-GFCCVEGCSA-N 1 3 298.833 4.004 20 0 CIADHO C[C@H]1CCCC[C@H]1CC[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000513208094 333008660 /nfs/dbraw/zinc/00/86/60/333008660.db2.gz MNVRPEOEOLEWRG-HOTGVXAUSA-N 1 3 280.500 4.055 20 0 CIADHO CC(C)[N@H+](C)Cc1cccc(CN[C@@H](C)c2ccccc2)c1 ZINC000173358323 335132399 /nfs/dbraw/zinc/13/23/99/335132399.db2.gz AUBHJPHQEZPPDP-KRWDZBQOSA-N 1 3 296.458 4.378 20 0 CIADHO CC(C)[N@@H+](C)Cc1cccc(CN[C@@H](C)c2ccccc2)c1 ZINC000173358323 335132401 /nfs/dbraw/zinc/13/24/01/335132401.db2.gz AUBHJPHQEZPPDP-KRWDZBQOSA-N 1 3 296.458 4.378 20 0 CIADHO C[C@H]([NH2+][C@H](CCN(C)C)C(C)(C)C)c1ccccc1Cl ZINC000523851276 333347976 /nfs/dbraw/zinc/34/79/76/333347976.db2.gz NAVWKPSPAWEAPW-XJKSGUPXSA-N 1 3 296.886 4.357 20 0 CIADHO CC[NH+](CC)CCCC1CCN(Cc2ccsc2)CC1 ZINC000541246140 333767682 /nfs/dbraw/zinc/76/76/82/333767682.db2.gz GRUCFNUPCMKPKA-UHFFFAOYSA-N 1 3 294.508 4.082 20 0 CIADHO CC(C)=CCC[C@H](C)[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000543072522 333855556 /nfs/dbraw/zinc/85/55/56/333855556.db2.gz QMAWNGJYLKZQRN-KRWDZBQOSA-N 1 3 292.511 4.366 20 0 CIADHO Cc1ccccc1[C@@H](C)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000137569456 334175099 /nfs/dbraw/zinc/17/50/99/334175099.db2.gz REGZCUOJBDZGCQ-MSOLQXFVSA-N 1 3 286.463 4.006 20 0 CIADHO CC(C)Cc1cccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000552245096 334307567 /nfs/dbraw/zinc/30/75/67/334307567.db2.gz QSTXOTYWNCXCPJ-TXPKVOOTSA-N 1 3 288.479 4.018 20 0 CIADHO CC(C)Cc1cccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000552245096 334307569 /nfs/dbraw/zinc/30/75/69/334307569.db2.gz QSTXOTYWNCXCPJ-TXPKVOOTSA-N 1 3 288.479 4.018 20 0 CIADHO CC(C)C[C@@H](C)C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000572763327 334876468 /nfs/dbraw/zinc/87/64/68/334876468.db2.gz JJWSTEYOZFRMNT-MRXNPFEDSA-N 1 3 280.500 4.055 20 0 CIADHO CCCC[C@@H](C)[C@H](C)[NH2+]C1CCN(C2CCCC2)CC1 ZINC000573011749 334900460 /nfs/dbraw/zinc/90/04/60/334900460.db2.gz LCYNKXOZIOQDEV-CVEARBPZSA-N 1 3 280.500 4.198 20 0 CIADHO CC[C@@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1ccc(F)cc1 ZINC000037786224 260118276 /nfs/dbraw/zinc/11/82/76/260118276.db2.gz RFOJFGWNYGZYSW-QGZVFWFLSA-N 1 3 292.442 4.129 20 0 CIADHO CCC[NH+]1CCC(N[C@H]2CC[C@@H](C)c3ccccc32)CC1 ZINC000126469964 260353091 /nfs/dbraw/zinc/35/30/91/260353091.db2.gz GTUZDPBCNLXQNR-BEFAXECRSA-N 1 3 286.463 4.089 20 0 CIADHO CC[NH+](CC)CCC[C@@H](C)N[C@H](C)c1ccc(F)cc1F ZINC000019915158 262177974 /nfs/dbraw/zinc/17/79/74/262177974.db2.gz GUFJJSPOXOFFGX-ZIAGYGMSSA-N 1 3 298.421 4.126 20 0 CIADHO Cc1cc(C)c([C@H](C)NC2CC[NH+](C(C)C)CC2)cc1C ZINC000020548619 262249348 /nfs/dbraw/zinc/24/93/48/262249348.db2.gz LEUVQNLANVJXTM-KRWDZBQOSA-N 1 3 288.479 4.135 20 0 CIADHO CC(C)c1ccc(CNCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000414806151 263051935 /nfs/dbraw/zinc/05/19/35/263051935.db2.gz HHRAALILZNTZBI-HNNXBMFYSA-N 1 3 282.431 4.120 20 0 CIADHO CC(C)c1ccc(CN[C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000415044842 263257723 /nfs/dbraw/zinc/25/77/23/263257723.db2.gz BEZUQXKHUMQGFM-HXUWFJFHSA-N 1 3 296.458 4.380 20 0 CIADHO [NH3+]CCC[C@H](NCc1ccc(C2CC2)cc1)c1ccccc1 ZINC000415047638 263258020 /nfs/dbraw/zinc/25/80/20/263258020.db2.gz FGAXTKFGFUJGOI-FQEVSTJZSA-N 1 3 294.442 4.134 20 0 CIADHO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(CCC2CCCC2)C1 ZINC000303944201 328370949 /nfs/dbraw/zinc/37/09/49/328370949.db2.gz UEUMRYSRNMIHGJ-PKOBYXMFSA-N 1 3 292.511 4.153 20 0 CIADHO C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(CCC2CCCC2)C1 ZINC000303944201 328370950 /nfs/dbraw/zinc/37/09/50/328370950.db2.gz UEUMRYSRNMIHGJ-PKOBYXMFSA-N 1 3 292.511 4.153 20 0 CIADHO C[C@H]1CCCCN1C[C@@H]1CCC[N@H+](CCC2CCCC2)C1 ZINC000303944201 328370951 /nfs/dbraw/zinc/37/09/51/328370951.db2.gz UEUMRYSRNMIHGJ-PKOBYXMFSA-N 1 3 292.511 4.153 20 0 CIADHO C[C@H]1CCCCN1C[C@@H]1CCC[N@@H+](CCC2CCCC2)C1 ZINC000303944201 328370952 /nfs/dbraw/zinc/37/09/52/328370952.db2.gz UEUMRYSRNMIHGJ-PKOBYXMFSA-N 1 3 292.511 4.153 20 0 CIADHO C[C@H](CCCC[NH3+])N[C@H](C)c1ccc(Cl)cc1Cl ZINC000381242393 327171415 /nfs/dbraw/zinc/17/14/15/327171415.db2.gz KOTUAPIASKRVKZ-GHMZBOCLSA-N 1 3 289.250 4.162 20 0 CIADHO CC(C)N1CCC[C@@H](C[NH2+][C@H]2CCCCC23CCCC3)C1 ZINC000559751805 327259768 /nfs/dbraw/zinc/25/97/68/327259768.db2.gz BUUOVJIWUHTCLX-ROUUACIJSA-N 1 3 292.511 4.199 20 0 CIADHO CCCCN1CCC([NH2+]Cc2cc(C)cc(Cl)c2)CC1 ZINC000395143463 329280099 /nfs/dbraw/zinc/28/00/99/329280099.db2.gz KHFFVOOMANMMJO-UHFFFAOYSA-N 1 3 294.870 4.003 20 0 CIADHO CCCC[C@H](C)[C@H](C)[NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000582928635 329286069 /nfs/dbraw/zinc/28/60/69/329286069.db2.gz PBVFFUQFFRAZFK-XSLAGTTESA-N 1 3 294.527 4.444 20 0 CIADHO N[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2)C2CCC2)c2ccccc21 ZINC000422708376 330151554 /nfs/dbraw/zinc/15/15/54/330151554.db2.gz BVYTUDKJKPSITI-AABGKKOBSA-N 1 3 292.426 4.262 20 0 CIADHO [NH3+][C@H]1C[C@H](N[C@@H]2CCC[C@H]2c2ccccc2)c2ccccc21 ZINC000422963677 330164507 /nfs/dbraw/zinc/16/45/07/330164507.db2.gz GJCGVCGOODGFGC-QLIIJSOBSA-N 1 3 292.426 4.057 20 0 CIADHO C[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@@H]1C[C@H](N)c2ccccc21 ZINC000423030834 330166236 /nfs/dbraw/zinc/16/62/36/330166236.db2.gz WLULZHHJDYKRSY-ZNYHDOEXSA-N 1 3 292.426 4.044 20 0 CIADHO CC[C@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccc(C)cc1 ZINC000423288997 330186490 /nfs/dbraw/zinc/18/64/90/330186490.db2.gz AHQCCOKQPOLPKV-KXBFYZLASA-N 1 3 282.431 4.256 20 0 CIADHO Cc1ccc([C@@H](NCc2ccc([C@H](C)[NH3+])cc2)C2CCC2)o1 ZINC000423291242 330186975 /nfs/dbraw/zinc/18/69/75/330186975.db2.gz HMRCYWFHTUOAJO-LIRRHRJNSA-N 1 3 298.430 4.239 20 0 CIADHO Cc1ccc([C@H](NCc2ccc([C@H](C)[NH3+])cc2)C2CCC2)o1 ZINC000423291240 330187107 /nfs/dbraw/zinc/18/71/07/330187107.db2.gz HMRCYWFHTUOAJO-IFXJQAMLSA-N 1 3 298.430 4.239 20 0 CIADHO CCC[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccccc1 ZINC000423291596 330187176 /nfs/dbraw/zinc/18/71/76/330187176.db2.gz IXNIPMBBFBMUQX-BEFAXECRSA-N 1 3 282.431 4.337 20 0 CIADHO Cc1cc(C)c([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)cc1C ZINC000423291180 330187210 /nfs/dbraw/zinc/18/72/10/330187210.db2.gz HDYLUTZOTIWIAK-IAGOWNOFSA-N 1 3 296.458 4.482 20 0 CIADHO Cc1cccc2c1[C@H](C)C[C@H]2NCc1ccc([C@H](C)[NH3+])cc1 ZINC000423292363 330187411 /nfs/dbraw/zinc/18/74/11/330187411.db2.gz MSUMSHUEMOJBNT-ZRGWGRIASA-N 1 3 294.442 4.353 20 0 CIADHO Cc1cccc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c1C ZINC000423295997 330188235 /nfs/dbraw/zinc/18/82/35/330188235.db2.gz YEPLDGCMUASNAV-CVEARBPZSA-N 1 3 282.431 4.174 20 0 CIADHO CCC[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccsc1 ZINC000423295307 330188242 /nfs/dbraw/zinc/18/82/42/330188242.db2.gz WKPFHUYWROJURP-DYVFJYSZSA-N 1 3 288.460 4.399 20 0 CIADHO Cc1cccc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c1C ZINC000423296000 330188288 /nfs/dbraw/zinc/18/82/88/330188288.db2.gz YEPLDGCMUASNAV-JKSUJKDBSA-N 1 3 282.431 4.174 20 0 CIADHO CC(C)(C)[C@H](NCC1=CC[NH2+]CC1)c1cc2ccccc2o1 ZINC000423331142 330191155 /nfs/dbraw/zinc/19/11/55/330191155.db2.gz CIGJJNOBEIJTDW-GOSISDBHSA-N 1 3 298.430 4.029 20 0 CIADHO CC(C)c1ccc([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)cc1 ZINC000423357081 330193292 /nfs/dbraw/zinc/19/32/92/330193292.db2.gz LJBAYTHUHQDHQL-OAHLLOKOSA-N 1 3 294.442 4.264 20 0 CIADHO C[C@H]1CC[C@@H](NCc2ccc3c(c2)C[NH2+]C3)c2ccccc21 ZINC000423370911 330195066 /nfs/dbraw/zinc/19/50/66/330195066.db2.gz GBAIFFJJFMMDFV-VBKZILBWSA-N 1 3 292.426 4.018 20 0 CIADHO C[C@@H]1C[C@H]([NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)CCN1 ZINC000423403593 330196222 /nfs/dbraw/zinc/19/62/22/330196222.db2.gz YPOXTXRJEHLTNW-XYPHTWIQSA-N 1 3 292.442 4.033 20 0 CIADHO C[C@@H]1C[C@@H]([NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)CCN1 ZINC000423403592 330196357 /nfs/dbraw/zinc/19/63/57/330196357.db2.gz YPOXTXRJEHLTNW-XOKHGSTOSA-N 1 3 292.442 4.033 20 0 CIADHO CC[C@H](NCCC[C@@H]1CCC[NH2+]1)c1cccc(Cl)c1F ZINC000423476359 330205644 /nfs/dbraw/zinc/20/56/44/330205644.db2.gz IZYGCRGMRLWFHC-WFASDCNBSA-N 1 3 298.833 4.052 20 0 CIADHO Cc1ccc(C)c([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000423496844 330207900 /nfs/dbraw/zinc/20/79/00/330207900.db2.gz FNDHRBYPFYJPQQ-XLIONFOSSA-N 1 3 296.458 4.434 20 0 CIADHO Cc1ccc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423498184 330208222 /nfs/dbraw/zinc/20/82/22/330208222.db2.gz HRYNUDRNXHRYRE-LPHOPBHVSA-N 1 3 282.431 4.126 20 0 CIADHO CC[C@H](N[C@@H](CCC[NH3+])c1ccccc1)c1ccsc1 ZINC000423501459 330208460 /nfs/dbraw/zinc/20/84/60/330208460.db2.gz CUHDJEJEOKSQGN-IRXDYDNUSA-N 1 3 288.460 4.269 20 0 CIADHO Cc1cc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)oc1C ZINC000423519773 330209664 /nfs/dbraw/zinc/20/96/64/330209664.db2.gz QMOULYXDNABKKM-RHSMWYFYSA-N 1 3 286.419 4.027 20 0 CIADHO Cc1cccc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000423518697 330209750 /nfs/dbraw/zinc/20/97/50/330209750.db2.gz ZQAXLHHQBZXVKG-VQIMIIECSA-N 1 3 282.431 4.126 20 0 CIADHO CCCCc1ccc([C@@H](C)NC[C@H]2CCC[N@H+](C)C2)cc1 ZINC000044534288 330329793 /nfs/dbraw/zinc/32/97/93/330329793.db2.gz FQQMNYQITMFVMH-SJLPKXTDSA-N 1 3 288.479 4.022 20 0 CIADHO CCCCc1ccc([C@@H](C)NC[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000044534288 330329794 /nfs/dbraw/zinc/32/97/94/330329794.db2.gz FQQMNYQITMFVMH-SJLPKXTDSA-N 1 3 288.479 4.022 20 0 CIADHO CC(C)(C)CC(C)(C)N1CCC([NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000424347911 330344936 /nfs/dbraw/zinc/34/49/36/330344936.db2.gz KJZBIHNLMPBZCO-SCAQPMJSSA-N 1 3 292.511 4.054 20 0 CIADHO CCC[NH+]1CCC(N[C@@H]2CC[C@H](C)c3ccsc32)CC1 ZINC000453076385 331086903 /nfs/dbraw/zinc/08/69/03/331086903.db2.gz HQFHKHOORXHNFT-XJKSGUPXSA-N 1 3 292.492 4.151 20 0 CIADHO CC(C)[NH+]1CCC(N[C@H]2CC[C@@H](C)c3ccsc32)CC1 ZINC000453143495 331093793 /nfs/dbraw/zinc/09/37/93/331093793.db2.gz FSUTWOPZPIXGNP-CJNGLKHVSA-N 1 3 292.492 4.149 20 0 CIADHO CC[C@@H]([NH2+]C1CCN(C2CCCC2)CC1)c1ccsc1 ZINC000453146649 331094152 /nfs/dbraw/zinc/09/41/52/331094152.db2.gz XOEIBIZYJZVIAU-QGZVFWFLSA-N 1 3 292.492 4.196 20 0 CIADHO CC(C)[C@@H]1C[C@@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc21 ZINC000453375631 331124717 /nfs/dbraw/zinc/12/47/17/331124717.db2.gz XYVTXAJVYATIPA-CUJSOJNGSA-N 1 3 298.474 4.086 20 0 CIADHO CC(C)[C@@H]1C[C@@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc21 ZINC000453375631 331124718 /nfs/dbraw/zinc/12/47/18/331124718.db2.gz XYVTXAJVYATIPA-CUJSOJNGSA-N 1 3 298.474 4.086 20 0 CIADHO CC[NH+](CC)CCC[C@H](C)N[C@H](C)c1cc(C)c(C)o1 ZINC000502687412 332668993 /nfs/dbraw/zinc/66/89/93/332668993.db2.gz PRBLJNSAPSQYPJ-LSDHHAIUSA-N 1 3 280.456 4.058 20 0 CIADHO C[C@@H]1CCCC[C@@H]1CC[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000513208095 333008615 /nfs/dbraw/zinc/00/86/15/333008615.db2.gz MNVRPEOEOLEWRG-HZPDHXFCSA-N 1 3 280.500 4.055 20 0 CIADHO C[C@@H]([NH2+][C@@H](C)c1cccs1)[C@@H]1CCCN(C2CCC2)C1 ZINC000183197978 333119444 /nfs/dbraw/zinc/11/94/44/333119444.db2.gz VHEYGJHGGATSIR-QLFBSQMISA-N 1 3 292.492 4.052 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](CC2CC2)c2ccccc2)cc1 ZINC000521607230 333179832 /nfs/dbraw/zinc/17/98/32/333179832.db2.gz KCNQIRJPOUUJAU-QRWLVFNGSA-N 1 3 294.442 4.337 20 0 CIADHO CC(C)N(C)CCC[NH2+][C@H](C)c1cccc2ccccc21 ZINC000226312803 333256336 /nfs/dbraw/zinc/25/63/36/333256336.db2.gz HMPWWWQZWPMFED-MRXNPFEDSA-N 1 3 284.447 4.221 20 0 CIADHO C[C@@H](N[C@H](CC[NH+](C)C)C(C)(C)C)c1ccc(Cl)cc1 ZINC000523853875 333348175 /nfs/dbraw/zinc/34/81/75/333348175.db2.gz YIVRHEMBZFCURH-CZUORRHYSA-N 1 3 296.886 4.357 20 0 CIADHO C[C@H](N[C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc(Cl)cc1 ZINC000523853873 333348271 /nfs/dbraw/zinc/34/82/71/333348271.db2.gz YIVRHEMBZFCURH-BBRMVZONSA-N 1 3 296.886 4.357 20 0 CIADHO CCN(CC)C[C@@H]1CC[N@H+](Cc2cccc3ccccc32)C1 ZINC000524766252 333387283 /nfs/dbraw/zinc/38/72/83/333387283.db2.gz JUKXEJDJWLOXTJ-KRWDZBQOSA-N 1 3 296.458 4.004 20 0 CIADHO CCN(CC)C[C@@H]1CC[N@@H+](Cc2cccc3ccccc32)C1 ZINC000524766252 333387284 /nfs/dbraw/zinc/38/72/84/333387284.db2.gz JUKXEJDJWLOXTJ-KRWDZBQOSA-N 1 3 296.458 4.004 20 0 CIADHO CC(C)(C)C1CCC(C[NH2+][C@@H]2CCN3CCC[C@@H]3C2)CC1 ZINC000135691644 334136560 /nfs/dbraw/zinc/13/65/60/334136560.db2.gz IUDHIJFGSJNLFH-OPQOLIRYSA-N 1 3 292.511 4.055 20 0 CIADHO c1ccc2c(c1)CCC[C@H]2N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000246963464 334272901 /nfs/dbraw/zinc/27/29/01/334272901.db2.gz GHUCHLCGHUWOCM-UYAOXDASSA-N 1 3 298.474 4.014 20 0 CIADHO C1CCC(N2CCC([NH2+][C@H]3CCCC34CCCC4)CC2)C1 ZINC000550678776 334226658 /nfs/dbraw/zinc/22/66/58/334226658.db2.gz SXLIKVJMFGXSPG-SFHVURJKSA-N 1 3 290.495 4.096 20 0 CIADHO Cc1ccccc1[C@H](C)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000247042443 334274371 /nfs/dbraw/zinc/27/43/71/334274371.db2.gz REGZCUOJBDZGCQ-ZWKOTPCHSA-N 1 3 286.463 4.006 20 0 CIADHO C[C@H]([NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1)c1cccs1 ZINC000248408250 334300565 /nfs/dbraw/zinc/30/05/65/334300565.db2.gz VHEYGJHGGATSIR-KKUMJFAQSA-N 1 3 292.492 4.052 20 0 CIADHO CC[C@@H]([NH2+]CCCN1CCCC[C@H]1C)c1cccs1 ZINC000252367697 334378480 /nfs/dbraw/zinc/37/84/80/334378480.db2.gz BPURHOFCJHXMOS-HUUCEWRRSA-N 1 3 280.481 4.053 20 0 CIADHO CC1(C)CCC[C@@H]1C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000556260484 334504615 /nfs/dbraw/zinc/50/46/15/334504615.db2.gz NDSGKONVBKYVIV-MRXNPFEDSA-N 1 3 292.511 4.199 20 0 CIADHO Cc1c2ccccc2oc1[C@H](C)NCc1ccc(C[NH3+])cc1 ZINC000566244848 334638140 /nfs/dbraw/zinc/63/81/40/334638140.db2.gz ATBQPRRLMWRQGZ-AWEZNQCLSA-N 1 3 294.398 4.051 20 0 CIADHO CC(C)N1CC[C@H](C[NH2+][C@@H](C)CCC2CCCCC2)C1 ZINC000581634740 336115241 /nfs/dbraw/zinc/11/52/41/336115241.db2.gz CIRFTSJVWZTLAD-FUHWJXTLSA-N 1 3 280.500 4.055 20 0 CIADHO c1ccc2c(c1)nccc2NCCCCC[NH+]1CCCCC1 ZINC000013472662 170553347 /nfs/dbraw/zinc/55/33/47/170553347.db2.gz YCYKTSCPZUNWHV-UHFFFAOYSA-N 1 3 297.446 4.303 20 0 CIADHO CC[NH+](CC)CCC[C@H](C)N[C@@H](C)c1cc(F)ccc1F ZINC000019915172 262206606 /nfs/dbraw/zinc/20/66/06/262206606.db2.gz WUJWEHJAZOVHBS-KBPBESRZSA-N 1 3 298.421 4.126 20 0 CIADHO [NH3+]CCC[C@@H](NCc1coc2ccccc12)c1ccccc1 ZINC000415055840 263258683 /nfs/dbraw/zinc/25/86/83/263258683.db2.gz OZHOXPVHWXUEFU-GOSISDBHSA-N 1 3 294.398 4.003 20 0 CIADHO CC(C)Sc1ccc([C@@H](C)[NH2+]C[C@H](C)CN(C)C)cc1 ZINC000425951886 264070965 /nfs/dbraw/zinc/07/09/65/264070965.db2.gz REDDCAKUARVEJS-LSDHHAIUSA-N 1 3 294.508 4.035 20 0 CIADHO Cc1ccccc1CNCc1cccc(C[N@@H+](C)C(C)C)c1 ZINC000065976621 265007772 /nfs/dbraw/zinc/00/77/72/265007772.db2.gz HWOBKNARIPQLFQ-UHFFFAOYSA-N 1 3 296.458 4.125 20 0 CIADHO Cc1ccccc1CNCc1cccc(C[N@H+](C)C(C)C)c1 ZINC000065976621 265007774 /nfs/dbraw/zinc/00/77/74/265007774.db2.gz HWOBKNARIPQLFQ-UHFFFAOYSA-N 1 3 296.458 4.125 20 0 CIADHO CC(C)N1CCC[C@H](C[NH2+][C@H](C)c2ccc(Cl)cc2)C1 ZINC000531703066 328026293 /nfs/dbraw/zinc/02/62/93/328026293.db2.gz ARCAFWXPMRKQOM-HUUCEWRRSA-N 1 3 294.870 4.111 20 0 CIADHO CC(C)Cc1ccc(CNCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000414802906 328231498 /nfs/dbraw/zinc/23/14/98/328231498.db2.gz BZGLYDGLMSSNFE-MRXNPFEDSA-N 1 3 296.458 4.195 20 0 CIADHO CC(C)N1CCC[C@H](C[NH2+][C@H]2CCCCC23CCCC3)C1 ZINC000559751800 327259573 /nfs/dbraw/zinc/25/95/73/327259573.db2.gz BUUOVJIWUHTCLX-MSOLQXFVSA-N 1 3 292.511 4.199 20 0 CIADHO C[C@@H]([NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1)c1ccsc1 ZINC000183184057 329245061 /nfs/dbraw/zinc/24/50/61/329245061.db2.gz UHDQSROERUAYHE-RRFJBIMHSA-N 1 3 292.492 4.052 20 0 CIADHO CCCC[C@H](C)[C@H](C)[NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000582928634 329286210 /nfs/dbraw/zinc/28/62/10/329286210.db2.gz PBVFFUQFFRAZFK-XLAORIBOSA-N 1 3 294.527 4.444 20 0 CIADHO N[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2)C2CCC2)c2ccccc21 ZINC000422708379 330151580 /nfs/dbraw/zinc/15/15/80/330151580.db2.gz BVYTUDKJKPSITI-VAMGGRTRSA-N 1 3 292.426 4.262 20 0 CIADHO CCC(CC)[C@@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1 ZINC000422720507 330152119 /nfs/dbraw/zinc/15/21/19/330152119.db2.gz SNTRRWQDNQJZQL-ZZJWQFMZSA-N 1 3 286.463 4.037 20 0 CIADHO CC[C@H](C)[C@H](N[C@@H](C)[C@H]1CC[NH2+]C1)c1ccc(Cl)cc1 ZINC000422789481 330157362 /nfs/dbraw/zinc/15/73/62/330157362.db2.gz WWWFCKKZUQDVRN-HPZZRFSDSA-N 1 3 294.870 4.015 20 0 CIADHO [NH3+][C@@H]1C[C@@H](N[C@@H]2CCC[C@H]2c2ccccc2)c2ccccc21 ZINC000422963678 330164511 /nfs/dbraw/zinc/16/45/11/330164511.db2.gz GJCGVCGOODGFGC-YGWPLHOASA-N 1 3 292.426 4.057 20 0 CIADHO C[C@H]([NH3+])CCN[C@@H](C)c1ccc(SC2CCCC2)cc1 ZINC000423222823 330179584 /nfs/dbraw/zinc/17/95/84/330179584.db2.gz CVWBKZIIOQMPBE-KBPBESRZSA-N 1 3 292.492 4.109 20 0 CIADHO CCc1ccc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423290047 330186807 /nfs/dbraw/zinc/18/68/07/330186807.db2.gz CCNBDWJCTTXUMH-HUUCEWRRSA-N 1 3 282.431 4.120 20 0 CIADHO CCc1ccc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423290048 330186847 /nfs/dbraw/zinc/18/68/47/330186847.db2.gz CCNBDWJCTTXUMH-LSDHHAIUSA-N 1 3 282.431 4.120 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@H]2CCCc3cc(F)ccc32)cc1 ZINC000423290483 330186863 /nfs/dbraw/zinc/18/68/63/330186863.db2.gz DDNZULDMTBKVSF-YJYMSZOUSA-N 1 3 298.405 4.013 20 0 CIADHO Cc1ccc2c(c1)[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)CCC2 ZINC000423290899 330187006 /nfs/dbraw/zinc/18/70/06/330187006.db2.gz FWQWGZGCMLFDHM-FOIQADDNSA-N 1 3 294.442 4.182 20 0 CIADHO CC[C@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccc(F)cc1 ZINC000423291417 330187016 /nfs/dbraw/zinc/18/70/16/330187016.db2.gz IFQRWTMZBMIDGQ-UGSOOPFHSA-N 1 3 286.394 4.086 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@H]2CC(C)(C)Cc3occc32)cc1 ZINC000423291368 330187070 /nfs/dbraw/zinc/18/70/70/330187070.db2.gz HZUQGKUOZJLLLE-DYVFJYSZSA-N 1 3 298.430 4.103 20 0 CIADHO Cc1ccc([C@H](NCc2ccc([C@@H](C)[NH3+])cc2)C2CC2)cc1 ZINC000423291475 330187143 /nfs/dbraw/zinc/18/71/43/330187143.db2.gz ILCMXYCUDUQYJF-QRWLVFNGSA-N 1 3 294.442 4.256 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2cccc(C3CC3)c2)cc1 ZINC000423291068 330187238 /nfs/dbraw/zinc/18/72/38/330187238.db2.gz GOIIKZZBROPYTL-GJZGRUSLSA-N 1 3 294.442 4.435 20 0 CIADHO Cc1ccc2c(c1)[C@H](NCc1ccc([C@H](C)[NH3+])cc1)CCC2 ZINC000423290900 330187250 /nfs/dbraw/zinc/18/72/50/330187250.db2.gz FWQWGZGCMLFDHM-MGPUTAFESA-N 1 3 294.442 4.182 20 0 CIADHO CCc1ccc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)s1 ZINC000423291516 330187252 /nfs/dbraw/zinc/18/72/52/330187252.db2.gz IRYIDMCSZWEYLE-QWHCGFSZSA-N 1 3 288.460 4.181 20 0 CIADHO Cc1ccc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c(C)c1 ZINC000423291335 330187260 /nfs/dbraw/zinc/18/72/60/330187260.db2.gz HWRQHFYYHZDGQD-CVEARBPZSA-N 1 3 282.431 4.174 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@H](c2ccc(F)cc2)C2CC2)cc1 ZINC000423292195 330187368 /nfs/dbraw/zinc/18/73/68/330187368.db2.gz LXZCDJWCAUKRDV-DJJJIMSYSA-N 1 3 298.405 4.086 20 0 CIADHO CCC([NH3+])(CC)CN[C@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423292448 330187384 /nfs/dbraw/zinc/18/73/84/330187384.db2.gz NBRTVJHTVMZGOD-ZBFHGGJFSA-N 1 3 294.870 4.083 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2cccc(Cl)c2)cc1 ZINC000423292761 330187647 /nfs/dbraw/zinc/18/76/47/330187647.db2.gz OICCLYZUPIWHIL-OLZOCXBDSA-N 1 3 288.822 4.211 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2cc3ccccc3o2)cc1 ZINC000423294766 330188100 /nfs/dbraw/zinc/18/81/00/330188100.db2.gz VGHHKEAENIMXSR-KGLIPLIRSA-N 1 3 294.398 4.303 20 0 CIADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cc2ccccc2o1 ZINC000423294767 330188115 /nfs/dbraw/zinc/18/81/15/330188115.db2.gz VGHHKEAENIMXSR-UONOGXRCSA-N 1 3 294.398 4.303 20 0 CIADHO CCC[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccsc1 ZINC000423295309 330188271 /nfs/dbraw/zinc/18/82/71/330188271.db2.gz WKPFHUYWROJURP-SUMWQHHRSA-N 1 3 288.460 4.399 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CC(C)(C)c3ccccc32)cc1 ZINC000423295305 330188405 /nfs/dbraw/zinc/18/84/05/330188405.db2.gz WKMRGFIXRFRDJQ-LIRRHRJNSA-N 1 3 294.442 4.219 20 0 CIADHO Cc1ccc2c(c1)[C@@H](N[C@H](CCC[NH3+])c1ccccc1)CC2 ZINC000423510112 330209111 /nfs/dbraw/zinc/20/91/11/330209111.db2.gz SBRVBGKMWOIYTM-UXHICEINSA-N 1 3 294.442 4.052 20 0 CIADHO C[C@@H]1C[C@@H](N[C@H](CCC[NH3+])c2ccccc2)c2ccccc21 ZINC000423510219 330209161 /nfs/dbraw/zinc/20/91/61/330209161.db2.gz MIEMXZXXCLPAOM-CDHQVMDDSA-N 1 3 294.442 4.305 20 0 CIADHO CC[C@H](N[C@@H](CCC[NH3+])c1ccccc1)c1cccs1 ZINC000423513918 330209295 /nfs/dbraw/zinc/20/92/95/330209295.db2.gz VUIFCTYQUKCOSW-HOTGVXAUSA-N 1 3 288.460 4.269 20 0 CIADHO Cc1ccc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)cc1C ZINC000423513124 330209341 /nfs/dbraw/zinc/20/93/41/330209341.db2.gz VFDLPUAKJJSDNA-PXNSSMCTSA-N 1 3 296.458 4.434 20 0 CIADHO Cc1ccsc1[C@H](C)N[C@H](CCC[NH3+])c1ccccc1 ZINC000423514295 330209496 /nfs/dbraw/zinc/20/94/96/330209496.db2.gz WESXLHNOVVFWLJ-GOEBONIOSA-N 1 3 288.460 4.187 20 0 CIADHO CCC[C@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccc(Cl)cc1 ZINC000044534213 330329843 /nfs/dbraw/zinc/32/98/43/330329843.db2.gz CKEZPZSIECDXFF-YOEHRIQHSA-N 1 3 294.870 4.113 20 0 CIADHO CCC[C@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1 ZINC000044534213 330329844 /nfs/dbraw/zinc/32/98/44/330329844.db2.gz CKEZPZSIECDXFF-YOEHRIQHSA-N 1 3 294.870 4.113 20 0 CIADHO CC[C@@H]1C[C@@H](C)CC[C@H]1[NH2+]C1CCN(C2CCCC2)CC1 ZINC000537645042 330450728 /nfs/dbraw/zinc/45/07/28/330450728.db2.gz XTHBUDNDLACWTR-FRQCXROJSA-N 1 3 292.511 4.198 20 0 CIADHO C[C@H](CCC1CC1)[NH2+]C1CCN([C@@H]2CCCC[C@H]2C)CC1 ZINC000469810398 331461709 /nfs/dbraw/zinc/46/17/09/331461709.db2.gz WWIOVRMUPGYZEV-GPMSIDNRSA-N 1 3 292.511 4.198 20 0 CIADHO CC(C)N(CCC[NH2+][C@@H]1CCC[C@@H]1CCCF)C(C)C ZINC000510701630 332912576 /nfs/dbraw/zinc/91/25/76/332912576.db2.gz LAAFSDZMJBPSLV-IAGOWNOFSA-N 1 3 286.479 4.003 20 0 CIADHO C[C@@H]1CC[C@H](C[NH2+]C2CCN([C@@H]3CCC[C@@H](C)C3)CC2)C1 ZINC000475555219 331636591 /nfs/dbraw/zinc/63/65/91/331636591.db2.gz PKLBSMMUCJKVRZ-VXIBKDFQSA-N 1 3 292.511 4.055 20 0 CIADHO CC(C)[NH+]1CCC(N(C)Cc2cccc3ccccc32)CC1 ZINC000514003073 333059170 /nfs/dbraw/zinc/05/91/70/333059170.db2.gz GTFLJZOXGMPVIA-UHFFFAOYSA-N 1 3 296.458 4.144 20 0 CIADHO CC[NH+](CC)CCC[C@@H](C)Nc1ccnc2ccccc21 ZINC000006382086 333082509 /nfs/dbraw/zinc/08/25/09/333082509.db2.gz CAUPTGHSTDHRCZ-OAHLLOKOSA-N 1 3 285.435 4.157 20 0 CIADHO C[C@H]([NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1)c1cccs1 ZINC000183197944 333119337 /nfs/dbraw/zinc/11/93/37/333119337.db2.gz VHEYGJHGGATSIR-SOUVJXGZSA-N 1 3 292.492 4.052 20 0 CIADHO CC(C)N(C)CCC[NH2+][C@H](C)c1cc2ccccc2s1 ZINC000219092178 333141362 /nfs/dbraw/zinc/14/13/62/333141362.db2.gz ZPYIKTQICURCCJ-CQSZACIVSA-N 1 3 290.476 4.282 20 0 CIADHO C[NH+](C)CC[C@H](NCc1ccc2ccccc2c1)C(C)(C)C ZINC000523863930 333348497 /nfs/dbraw/zinc/34/84/97/333348497.db2.gz CZWWFVWIVSWXDS-IBGZPJMESA-N 1 3 298.474 4.296 20 0 CIADHO C[C@H]1C[C@@H]([NH2+]Cc2ccc(CN(C)C)cc2)CC(C)(C)C1 ZINC000524679845 333371070 /nfs/dbraw/zinc/37/10/70/333371070.db2.gz IOKLPPZVCKNISZ-MAUKXSAKSA-N 1 3 288.479 4.053 20 0 CIADHO C[C@@H]([NH2+]C1CCN(C2CCCCC2)CC1)C1CCCCC1 ZINC000237408333 333379261 /nfs/dbraw/zinc/37/92/61/333379261.db2.gz AXIDKLPKYLTVOI-MRXNPFEDSA-N 1 3 292.511 4.342 20 0 CIADHO CCN1CC[C@H](C[NH2+][C@H](CC(C)(C)C)c2ccccc2)C1 ZINC000252438359 334380101 /nfs/dbraw/zinc/38/01/01/334380101.db2.gz AHGLZHDQJWTWQL-SJLPKXTDSA-N 1 3 288.479 4.095 20 0 CIADHO CC[N@@H+]1CC[C@H](CN[C@H](CC(C)(C)C)c2ccccc2)C1 ZINC000252438359 334380103 /nfs/dbraw/zinc/38/01/03/334380103.db2.gz AHGLZHDQJWTWQL-SJLPKXTDSA-N 1 3 288.479 4.095 20 0 CIADHO CC[N@H+]1CC[C@H](CN[C@H](CC(C)(C)C)c2ccccc2)C1 ZINC000252438359 334380105 /nfs/dbraw/zinc/38/01/05/334380105.db2.gz AHGLZHDQJWTWQL-SJLPKXTDSA-N 1 3 288.479 4.095 20 0 CIADHO CC(C)Cc1cccc([C@H](C)NCc2ccc(C[NH3+])cc2)c1 ZINC000577178466 335317040 /nfs/dbraw/zinc/31/70/40/335317040.db2.gz ZYEMPUMXBFKVBT-INIZCTEOSA-N 1 3 296.458 4.195 20 0 CIADHO CC(C)(C)N1CCC([NH2+]Cc2ccc3ccccc3c2)CC1 ZINC000119859700 518708921 /nfs/dbraw/zinc/70/89/21/518708921.db2.gz YAGKQMPCXMPQNU-UHFFFAOYSA-N 1 3 296.458 4.192 20 0 CIADHO Cc1ccc([C@H](C)NCc2ccc(C[NH+](C)C)cc2)cc1C ZINC000171133312 335056237 /nfs/dbraw/zinc/05/62/37/335056237.db2.gz DVOIBMMZBUILMN-KRWDZBQOSA-N 1 3 296.458 4.216 20 0 CIADHO CCc1ccc([C@@H](C)NCc2ccc(C[NH+](C)C)cc2)cc1 ZINC000171126501 260936314 /nfs/dbraw/zinc/93/63/14/260936314.db2.gz HRSBBACZWGEZKI-MRXNPFEDSA-N 1 3 296.458 4.161 20 0 CIADHO CC[NH+]1CCC(N[C@H](C)c2cccc(CC(C)C)c2)CC1 ZINC000514082262 261198823 /nfs/dbraw/zinc/19/88/23/261198823.db2.gz GIPLGHIBTXAFBJ-MRXNPFEDSA-N 1 3 288.479 4.020 20 0 CIADHO CC[NH+](CC)CCC[C@H](C)N[C@H](C)c1cc(F)ccc1F ZINC000019915176 262178315 /nfs/dbraw/zinc/17/83/15/262178315.db2.gz WUJWEHJAZOVHBS-UONOGXRCSA-N 1 3 298.421 4.126 20 0 CIADHO CC[NH+](CC)CCC[C@H](C)N[C@H](C)c1ccc(F)cc1F ZINC000019915160 262206497 /nfs/dbraw/zinc/20/64/97/262206497.db2.gz GUFJJSPOXOFFGX-UONOGXRCSA-N 1 3 298.421 4.126 20 0 CIADHO CC[NH+](CC)CCC[C@@H](C)N[C@@H](C)c1cc(F)ccc1F ZINC000019915170 262206543 /nfs/dbraw/zinc/20/65/43/262206543.db2.gz WUJWEHJAZOVHBS-KGLIPLIRSA-N 1 3 298.421 4.126 20 0 CIADHO CC(C)CN1CCC([NH2+][C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000221716238 262292483 /nfs/dbraw/zinc/29/24/83/262292483.db2.gz PZWJDVFAVMRNGO-AWEZNQCLSA-N 1 3 294.870 4.111 20 0 CIADHO [NH3+]CCC[C@@H](NCc1ccc(C2CC2)cc1)c1ccccc1 ZINC000415047639 263258089 /nfs/dbraw/zinc/25/80/89/263258089.db2.gz FGAXTKFGFUJGOI-HXUWFJFHSA-N 1 3 294.442 4.134 20 0 CIADHO CCc1ccc([C@H](C)[NH2+]C[C@H]2CCCN(C(C)C)C2)s1 ZINC000125991137 328040386 /nfs/dbraw/zinc/04/03/86/328040386.db2.gz YHDAFDKRVAPXBF-LSDHHAIUSA-N 1 3 294.508 4.082 20 0 CIADHO C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(CCC2CCCC2)C1 ZINC000303944156 328370904 /nfs/dbraw/zinc/37/09/04/328370904.db2.gz UEUMRYSRNMIHGJ-HKUYNNGSSA-N 1 3 292.511 4.153 20 0 CIADHO C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(CCC2CCCC2)C1 ZINC000303944156 328370905 /nfs/dbraw/zinc/37/09/05/328370905.db2.gz UEUMRYSRNMIHGJ-HKUYNNGSSA-N 1 3 292.511 4.153 20 0 CIADHO C[C@H]1CCCCN1C[C@H]1CCC[N@H+](CCC2CCCC2)C1 ZINC000303944156 328370906 /nfs/dbraw/zinc/37/09/06/328370906.db2.gz UEUMRYSRNMIHGJ-HKUYNNGSSA-N 1 3 292.511 4.153 20 0 CIADHO C[C@H]1CCCCN1C[C@H]1CCC[N@@H+](CCC2CCCC2)C1 ZINC000303944156 328370907 /nfs/dbraw/zinc/37/09/07/328370907.db2.gz UEUMRYSRNMIHGJ-HKUYNNGSSA-N 1 3 292.511 4.153 20 0 CIADHO Cc1ccc([C@H](C)NCc2cccc(C[NH+](C)C)c2)c(C)c1 ZINC000123681239 327203346 /nfs/dbraw/zinc/20/33/46/327203346.db2.gz BUFPVJBGVNGMPM-KRWDZBQOSA-N 1 3 296.458 4.216 20 0 CIADHO C[C@H]([NH2+]C1CCN(CC2CCCC2)CC1)c1cccs1 ZINC000178158414 329196866 /nfs/dbraw/zinc/19/68/66/329196866.db2.gz LZAZPJYTVYBYOM-AWEZNQCLSA-N 1 3 292.492 4.053 20 0 CIADHO C[C@@H](NCc1ccc(C[NH3+])cc1)c1ccc(C(C)(C)C)cc1 ZINC000582786770 329198234 /nfs/dbraw/zinc/19/82/34/329198234.db2.gz DIFKITFTVZYBRZ-OAHLLOKOSA-N 1 3 296.458 4.294 20 0 CIADHO C[C@@H]([NH2+][C@@H](C)c1ccsc1)[C@@H]1CCCN(C2CCC2)C1 ZINC000183184075 329245039 /nfs/dbraw/zinc/24/50/39/329245039.db2.gz UHDQSROERUAYHE-QLFBSQMISA-N 1 3 292.492 4.052 20 0 CIADHO CCC[C@H](NCc1cccc(C[NH+](C)C)c1)c1ccccc1 ZINC000123580631 329560276 /nfs/dbraw/zinc/56/02/76/329560276.db2.gz FEKPBFCBRZCYCQ-FQEVSTJZSA-N 1 3 296.458 4.379 20 0 CIADHO Cc1ccccc1[C@H]([NH2+][C@H]1C[C@H](N)c2ccccc21)C(C)C ZINC000422719774 330152049 /nfs/dbraw/zinc/15/20/49/330152049.db2.gz ZFOWSWVOAYGFLP-SLFFLAALSA-N 1 3 294.442 4.427 20 0 CIADHO C[C@@H](CCCC[NH3+])N[C@@H](C)c1cccc(Cl)c1Cl ZINC000422754008 330153723 /nfs/dbraw/zinc/15/37/23/330153723.db2.gz FRCIGCVXRRRYEL-QWRGUYRKSA-N 1 3 289.250 4.162 20 0 CIADHO C[C@H](CCCC[NH3+])N[C@@H](C)c1cc(Cl)ccc1Cl ZINC000422789939 330157412 /nfs/dbraw/zinc/15/74/12/330157412.db2.gz XFGBMDIYPPMPOG-MNOVXSKESA-N 1 3 289.250 4.162 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@H]2CCCc3ccc(F)cc32)cc1 ZINC000423289902 330186568 /nfs/dbraw/zinc/18/65/68/330186568.db2.gz BYNXORFZFNBPNJ-YJYMSZOUSA-N 1 3 298.405 4.013 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2ccc(Cl)s2)cc1 ZINC000423290998 330187147 /nfs/dbraw/zinc/18/71/47/330187147.db2.gz GGMBMEWNXAURIP-GHMZBOCLSA-N 1 3 294.851 4.272 20 0 CIADHO Cc1ccc([C@@H](NCc2ccc([C@@H](C)[NH3+])cc2)C2CC2)cc1 ZINC000423291473 330187216 /nfs/dbraw/zinc/18/72/16/330187216.db2.gz ILCMXYCUDUQYJF-FOIQADDNSA-N 1 3 294.442 4.256 20 0 CIADHO CCC[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccccc1 ZINC000423291598 330187271 /nfs/dbraw/zinc/18/72/71/330187271.db2.gz IXNIPMBBFBMUQX-HNAYVOBHSA-N 1 3 282.431 4.337 20 0 CIADHO Cc1ccc2c(c1)[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)[C@H](C)C2 ZINC000423292304 330187361 /nfs/dbraw/zinc/18/73/61/330187361.db2.gz MLIUNOYPJVAKQJ-STXHMFSFSA-N 1 3 294.442 4.038 20 0 CIADHO Cc1ccc2c(c1)[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)[C@@H](C)C2 ZINC000423292302 330187451 /nfs/dbraw/zinc/18/74/51/330187451.db2.gz MLIUNOYPJVAKQJ-BXTJHSDWSA-N 1 3 294.442 4.038 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@H]2C[C@H](C)c3ccccc32)cc1 ZINC000423291966 330187490 /nfs/dbraw/zinc/18/74/90/330187490.db2.gz KUENKSBVUJCYOC-NJSLBKSFSA-N 1 3 280.415 4.044 20 0 CIADHO Cc1ccc(C)c([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000423294963 330187877 /nfs/dbraw/zinc/18/78/77/330187877.db2.gz VVZQALHXBUVVEO-CVEARBPZSA-N 1 3 282.431 4.174 20 0 CIADHO Cc1cccc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c1C ZINC000423295999 330188364 /nfs/dbraw/zinc/18/83/64/330188364.db2.gz YEPLDGCMUASNAV-HZPDHXFCSA-N 1 3 282.431 4.174 20 0 CIADHO CCC([NH3+])(CC)CN[C@@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000423296434 330188578 /nfs/dbraw/zinc/18/85/78/330188578.db2.gz ZFSXVXRRFYCOEF-GDBMZVCRSA-N 1 3 294.870 4.083 20 0 CIADHO CCC([NH3+])(CC)CN[C@@H]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000423296435 330188630 /nfs/dbraw/zinc/18/86/30/330188630.db2.gz ZFSXVXRRFYCOEF-GOEBONIOSA-N 1 3 294.870 4.083 20 0 CIADHO C[C@@H]1CC[C@H](NCc2ccc3c(c2)C[NH2+]C3)c2sccc21 ZINC000423398957 330195895 /nfs/dbraw/zinc/19/58/95/330195895.db2.gz ULGGVQGYSBQVBC-PXAZEXFGSA-N 1 3 298.455 4.080 20 0 CIADHO C[C@H]([NH2+][C@@H]1CCNC[C@H]1C)c1ccc(-c2ccccc2)cc1 ZINC000423392741 330200495 /nfs/dbraw/zinc/20/04/95/330200495.db2.gz LYYMGMHCZSJKLB-GQIGUUNPSA-N 1 3 294.442 4.002 20 0 CIADHO Cc1cccc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c1C ZINC000423502532 330208503 /nfs/dbraw/zinc/20/85/03/330208503.db2.gz MAUHMAZFUMAUBY-PXNSSMCTSA-N 1 3 296.458 4.434 20 0 CIADHO Cc1cc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)c(C)o1 ZINC000423510110 330209011 /nfs/dbraw/zinc/20/90/11/330209011.db2.gz SBRFCQITVZSPNA-RDTXWAMCSA-N 1 3 286.419 4.027 20 0 CIADHO Cc1cc(C)cc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000423510869 330209068 /nfs/dbraw/zinc/20/90/68/330209068.db2.gz SOOWQQAPWGMFIX-FXAWDEMLSA-N 1 3 296.458 4.434 20 0 CIADHO Cc1cc(C)cc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000423510871 330209071 /nfs/dbraw/zinc/20/90/71/330209071.db2.gz SOOWQQAPWGMFIX-XLIONFOSSA-N 1 3 296.458 4.434 20 0 CIADHO Cc1cc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c(C)o1 ZINC000423510107 330209187 /nfs/dbraw/zinc/20/91/87/330209187.db2.gz SBRFCQITVZSPNA-KDOFPFPSSA-N 1 3 286.419 4.027 20 0 CIADHO Cc1ccsc1[C@@H](C)N[C@H](CCC[NH3+])c1ccccc1 ZINC000423514294 330209290 /nfs/dbraw/zinc/20/92/90/330209290.db2.gz WESXLHNOVVFWLJ-GDBMZVCRSA-N 1 3 288.460 4.187 20 0 CIADHO Cc1ccc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)cc1C ZINC000423513127 330209335 /nfs/dbraw/zinc/20/93/35/330209335.db2.gz VFDLPUAKJJSDNA-YLJYHZDGSA-N 1 3 296.458 4.434 20 0 CIADHO CC[C@H](N[C@H](CCC[NH3+])c1ccccc1)c1cccs1 ZINC000423513920 330209463 /nfs/dbraw/zinc/20/94/63/330209463.db2.gz VUIFCTYQUKCOSW-JKSUJKDBSA-N 1 3 288.460 4.269 20 0 CIADHO C[C@@H]([NH2+]CCCN1CCCCC1)c1ccc(Cl)c(F)c1 ZINC000212767440 330367313 /nfs/dbraw/zinc/36/73/13/330367313.db2.gz KDVUHAJRFSLAAP-CYBMUJFWSA-N 1 3 298.833 4.006 20 0 CIADHO C[C@H]1CC(C)(C)C[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000434771667 330644707 /nfs/dbraw/zinc/64/47/07/330644707.db2.gz AOMVQMFFKWPQMX-YJBOKZPZSA-N 1 3 292.511 4.198 20 0 CIADHO C[C@H](CCCC(F)(F)F)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000163231214 331004936 /nfs/dbraw/zinc/00/49/36/331004936.db2.gz WRSCRCTWALTCGW-LLVKDONJSA-N 1 3 294.405 4.006 20 0 CIADHO CC(C)[NH+]1CCC(N[C@H]2CC[C@H](C)c3ccsc32)CC1 ZINC000453143494 331093760 /nfs/dbraw/zinc/09/37/60/331093760.db2.gz FSUTWOPZPIXGNP-BBRMVZONSA-N 1 3 292.492 4.149 20 0 CIADHO CCC[C@@H](C)[C@@H](CC)[NH2+]C1CCN(C2CCCC2)CC1 ZINC000484488966 331899863 /nfs/dbraw/zinc/89/98/63/331899863.db2.gz VVGVQSNVKNIUKN-CRAIPNDOSA-N 1 3 280.500 4.198 20 0 CIADHO CC(C)N(C)CCC[NH2+][C@H](c1ccc(Cl)cc1)C1CC1 ZINC000223024947 333203402 /nfs/dbraw/zinc/20/34/02/333203402.db2.gz WOIBNJOWASMXCW-KRWDZBQOSA-N 1 3 294.870 4.111 20 0 CIADHO CCC[C@H](N[C@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000224110026 333216894 /nfs/dbraw/zinc/21/68/94/333216894.db2.gz NHWOKXOWSXSTJU-JQFCIGGWSA-N 1 3 294.870 4.254 20 0 CIADHO CCC[C@H](N[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000224110026 333216895 /nfs/dbraw/zinc/21/68/95/333216895.db2.gz NHWOKXOWSXSTJU-JQFCIGGWSA-N 1 3 294.870 4.254 20 0 CIADHO Cc1c[nH+]ccc1NC1CCN([C@@H](C)c2ccccc2)CC1 ZINC000192600657 333236917 /nfs/dbraw/zinc/23/69/17/333236917.db2.gz WOHKYSMOIUORJB-INIZCTEOSA-N 1 3 295.430 4.028 20 0 CIADHO C[C@@H]([NH2+][C@H](CCN(C)C)C(C)(C)C)c1ccccc1Cl ZINC000523851275 333347965 /nfs/dbraw/zinc/34/79/65/333347965.db2.gz NAVWKPSPAWEAPW-CZUORRHYSA-N 1 3 296.886 4.357 20 0 CIADHO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(CN(C)C)cc2)CC(C)(C)C1 ZINC000524679844 333371090 /nfs/dbraw/zinc/37/10/90/333371090.db2.gz IOKLPPZVCKNISZ-CRAIPNDOSA-N 1 3 288.479 4.053 20 0 CIADHO CN1CCCC[C@H]1CC[N@H+](C)Cc1ccc2ccccc2c1 ZINC000524755513 333386589 /nfs/dbraw/zinc/38/65/89/333386589.db2.gz DILYHGZDZUAZGH-FQEVSTJZSA-N 1 3 296.458 4.146 20 0 CIADHO CN1CCCC[C@H]1CC[N@@H+](C)Cc1ccc2ccccc2c1 ZINC000524755513 333386591 /nfs/dbraw/zinc/38/65/91/333386591.db2.gz DILYHGZDZUAZGH-FQEVSTJZSA-N 1 3 296.458 4.146 20 0 CIADHO CCN(CC)C[C@H]1CC[N@H+](Cc2cccc3ccccc32)C1 ZINC000524766253 333387243 /nfs/dbraw/zinc/38/72/43/333387243.db2.gz JUKXEJDJWLOXTJ-QGZVFWFLSA-N 1 3 296.458 4.004 20 0 CIADHO CCN(CC)C[C@H]1CC[N@@H+](Cc2cccc3ccccc32)C1 ZINC000524766253 333387244 /nfs/dbraw/zinc/38/72/44/333387244.db2.gz JUKXEJDJWLOXTJ-QGZVFWFLSA-N 1 3 296.458 4.004 20 0 CIADHO CCC1(C[NH2+]C2CCN(C3CCCC3)CC2)CCCCC1 ZINC000545865245 334003111 /nfs/dbraw/zinc/00/31/11/334003111.db2.gz KDFLGGALNFHIEH-UHFFFAOYSA-N 1 3 292.511 4.344 20 0 CIADHO C1C[C@H]2C[C@@H]([NH2+]C3CCC4(CCCCC4)CC3)CCN2C1 ZINC000248889421 334320905 /nfs/dbraw/zinc/32/09/05/334320905.db2.gz YMMDGHJLLUXYTI-ROUUACIJSA-N 1 3 290.495 4.096 20 0 CIADHO CN1CC=C(C[NH2+][C@H](CC(C)(C)C)c2ccccc2)CC1 ZINC000344285640 335245649 /nfs/dbraw/zinc/24/56/49/335245649.db2.gz HNHMYICOJYQOEH-GOSISDBHSA-N 1 3 286.463 4.015 20 0 CIADHO C/C(=C\c1ccccc1)C[NH2+]C1CCN(C2CCCC2)CC1 ZINC000176992907 335352424 /nfs/dbraw/zinc/35/24/24/335352424.db2.gz JQLIFQYRLRXGEH-BMRADRMJSA-N 1 3 298.474 4.087 20 0 CIADHO C[C@@H](NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Cl)cc1 ZINC000088163874 525405401 /nfs/dbraw/zinc/40/54/01/525405401.db2.gz SSYVNTBRKOGEES-FCLXEUQJSA-N 1 3 292.854 4.006 20 0 CIADHO C[C@@H](NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1 ZINC000088163874 525405406 /nfs/dbraw/zinc/40/54/06/525405406.db2.gz SSYVNTBRKOGEES-FCLXEUQJSA-N 1 3 292.854 4.006 20 0 CIADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(Cl)cc2)C1 ZINC000531703063 328026328 /nfs/dbraw/zinc/02/63/28/328026328.db2.gz ARCAFWXPMRKQOM-GJZGRUSLSA-N 1 3 294.870 4.111 20 0 CIADHO CC(C)Cc1ccc(CNCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000414802904 328231479 /nfs/dbraw/zinc/23/14/79/328231479.db2.gz BZGLYDGLMSSNFE-INIZCTEOSA-N 1 3 296.458 4.195 20 0 CIADHO C[C@H](NCCCC[N@@H+]1CCCC[C@H]1C)c1ccsc1 ZINC000178097803 329192525 /nfs/dbraw/zinc/19/25/25/329192525.db2.gz YBQVCGQZGXVCNL-CABCVRRESA-N 1 3 280.481 4.053 20 0 CIADHO C[C@H](NCCCC[N@H+]1CCCC[C@H]1C)c1ccsc1 ZINC000178097803 329192527 /nfs/dbraw/zinc/19/25/27/329192527.db2.gz YBQVCGQZGXVCNL-CABCVRRESA-N 1 3 280.481 4.053 20 0 CIADHO C[C@H](NCCCC[N@@H+]1CCCC[C@@H]1C)c1ccsc1 ZINC000178097813 329192622 /nfs/dbraw/zinc/19/26/22/329192622.db2.gz YBQVCGQZGXVCNL-GJZGRUSLSA-N 1 3 280.481 4.053 20 0 CIADHO C[C@H](NCCCC[N@H+]1CCCC[C@@H]1C)c1ccsc1 ZINC000178097813 329192624 /nfs/dbraw/zinc/19/26/24/329192624.db2.gz YBQVCGQZGXVCNL-GJZGRUSLSA-N 1 3 280.481 4.053 20 0 CIADHO CC(C)(C)C[C@@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1 ZINC000422871343 330158429 /nfs/dbraw/zinc/15/84/29/330158429.db2.gz ZWDVIBJGWPVPKK-UJJTZGENSA-N 1 3 286.463 4.037 20 0 CIADHO c1ccc([C@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C2CCCCC2)cc1 ZINC000422933059 330161210 /nfs/dbraw/zinc/16/12/10/330161210.db2.gz DCWXGDAILFWCQK-XNMUZJSGSA-N 1 3 298.474 4.181 20 0 CIADHO C[C@H](N)C[C@H](C)[NH2+][C@@H]1CCC[C@H](c2cccc(Cl)c2)C1 ZINC000423165406 330173995 /nfs/dbraw/zinc/17/39/95/330173995.db2.gz PYGWPTXVTVZPPT-GZIXRCOHSA-N 1 3 294.870 4.082 20 0 CIADHO Cc1ccc([C@@H](NCc2ccc([C@@H](C)[NH3+])cc2)C2CCC2)o1 ZINC000423291241 330187023 /nfs/dbraw/zinc/18/70/23/330187023.db2.gz HMRCYWFHTUOAJO-KUHUBIRLSA-N 1 3 298.430 4.239 20 0 CIADHO Cc1cc(C)c([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)cc1C ZINC000423291181 330187099 /nfs/dbraw/zinc/18/70/99/330187099.db2.gz HDYLUTZOTIWIAK-IRXDYDNUSA-N 1 3 296.458 4.482 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CC(C)(C)Cc3occc32)cc1 ZINC000423291369 330187244 /nfs/dbraw/zinc/18/72/44/330187244.db2.gz HZUQGKUOZJLLLE-GUYCJALGSA-N 1 3 298.430 4.103 20 0 CIADHO CC[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1cccc(F)c1 ZINC000423292264 330187408 /nfs/dbraw/zinc/18/74/08/330187408.db2.gz MGLDIQKZWUONEC-FZKQIMNGSA-N 1 3 286.394 4.086 20 0 CIADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccc2c(c1)CCC2 ZINC000423292329 330187540 /nfs/dbraw/zinc/18/75/40/330187540.db2.gz MNECGGLFGJNZDN-LSDHHAIUSA-N 1 3 294.442 4.046 20 0 CIADHO C[C@@H]([NH2+][C@H]1CCN[C@H](C)C1)c1cccc(-c2ccccc2)c1 ZINC000423401754 330196332 /nfs/dbraw/zinc/19/63/32/330196332.db2.gz XGVLOWSCBQYABR-QINHECLXSA-N 1 3 294.442 4.145 20 0 CIADHO C[C@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1cccc(-c2ccccc2)c1 ZINC000423401751 330196459 /nfs/dbraw/zinc/19/64/59/330196459.db2.gz XGVLOWSCBQYABR-GQIGUUNPSA-N 1 3 294.442 4.145 20 0 CIADHO C[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1cccc(C2CC2)c1 ZINC000423407313 330196906 /nfs/dbraw/zinc/19/69/06/330196906.db2.gz ZUUJWODEXOCECE-AWEZNQCLSA-N 1 3 292.426 4.018 20 0 CIADHO C[C@@H](N[C@@H](C)CCCC[NH3+])c1cc(Cl)sc1Cl ZINC000423429340 330198415 /nfs/dbraw/zinc/19/84/15/330198415.db2.gz KFQBHBWQJPGERJ-DTWKUNHWSA-N 1 3 295.279 4.223 20 0 CIADHO CC(C)C[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccccc1 ZINC000423381925 330199187 /nfs/dbraw/zinc/19/91/87/330199187.db2.gz JPSMUCLAHCDTEK-HXUWFJFHSA-N 1 3 294.442 4.167 20 0 CIADHO Cc1ccc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)c(C)c1 ZINC000423497393 330207937 /nfs/dbraw/zinc/20/79/37/330207937.db2.gz GWBWRHGYDYJCSA-YLJYHZDGSA-N 1 3 296.458 4.434 20 0 CIADHO Cc1ccc(C)c([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000423496845 330207966 /nfs/dbraw/zinc/20/79/66/330207966.db2.gz FNDHRBYPFYJPQQ-YLJYHZDGSA-N 1 3 296.458 4.434 20 0 CIADHO Cc1ccc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423498185 330208066 /nfs/dbraw/zinc/20/80/66/330208066.db2.gz HRYNUDRNXHRYRE-QFBILLFUSA-N 1 3 282.431 4.126 20 0 CIADHO Cc1ccc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423498186 330208282 /nfs/dbraw/zinc/20/82/82/330208282.db2.gz HRYNUDRNXHRYRE-VQIMIIECSA-N 1 3 282.431 4.126 20 0 CIADHO Cc1ccccc1[C@@H](C)N[C@@H](CCC[NH3+])c1ccccc1 ZINC000423518601 330209584 /nfs/dbraw/zinc/20/95/84/330209584.db2.gz ZKHVRICSJJRORO-APWZRJJASA-N 1 3 282.431 4.126 20 0 CIADHO Cc1ccccc1[C@H](C)N[C@@H](CCC[NH3+])c1ccccc1 ZINC000423518604 330209759 /nfs/dbraw/zinc/20/97/59/330209759.db2.gz ZKHVRICSJJRORO-LPHOPBHVSA-N 1 3 282.431 4.126 20 0 CIADHO CCC[C@H](NC[C@H]1CCC[N@H+](C)C1)c1ccc(Cl)cc1 ZINC000044534217 330329830 /nfs/dbraw/zinc/32/98/30/330329830.db2.gz CKEZPZSIECDXFF-PBHICJAKSA-N 1 3 294.870 4.113 20 0 CIADHO CCC[C@H](NC[C@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1 ZINC000044534217 330329831 /nfs/dbraw/zinc/32/98/31/330329831.db2.gz CKEZPZSIECDXFF-PBHICJAKSA-N 1 3 294.870 4.113 20 0 CIADHO CC(C)[C@@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)c1ccccc1 ZINC000536998893 330375438 /nfs/dbraw/zinc/37/54/38/330375438.db2.gz PGMMGDAUSKUUCW-IEBWSBKVSA-N 1 3 288.479 4.094 20 0 CIADHO CC(C)[C@@H](NC[C@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1 ZINC000536998893 330375439 /nfs/dbraw/zinc/37/54/39/330375439.db2.gz PGMMGDAUSKUUCW-IEBWSBKVSA-N 1 3 288.479 4.094 20 0 CIADHO CC(C)[C@@H](NC[C@H]1CCC[N@H+](C(C)C)C1)c1ccccc1 ZINC000536998893 330375440 /nfs/dbraw/zinc/37/54/40/330375440.db2.gz PGMMGDAUSKUUCW-IEBWSBKVSA-N 1 3 288.479 4.094 20 0 CIADHO CCC1(NC2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CC1 ZINC000453301280 331113149 /nfs/dbraw/zinc/11/31/49/331113149.db2.gz XMKNZUOXNDNEGK-UHFFFAOYSA-N 1 3 280.500 4.198 20 0 CIADHO CCC1([NH2+]C2CCN(C(C)(C)CC(C)(C)C)CC2)CC1 ZINC000453301280 331113150 /nfs/dbraw/zinc/11/31/50/331113150.db2.gz XMKNZUOXNDNEGK-UHFFFAOYSA-N 1 3 280.500 4.198 20 0 CIADHO Cc1ccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)C2CCC2)cc1 ZINC000453349782 331120523 /nfs/dbraw/zinc/12/05/23/331120523.db2.gz LYMKVHSQXOAWOS-NXEWRWPSSA-N 1 3 298.474 4.051 20 0 CIADHO Cc1ccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)C2CCC2)cc1 ZINC000453349782 331120524 /nfs/dbraw/zinc/12/05/24/331120524.db2.gz LYMKVHSQXOAWOS-NXEWRWPSSA-N 1 3 298.474 4.051 20 0 CIADHO CC[C@@H](C)C[C@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000513023399 332999338 /nfs/dbraw/zinc/99/93/38/332999338.db2.gz HSXPCUHERXMFGO-CVEARBPZSA-N 1 3 280.500 4.198 20 0 CIADHO C[C@H](N[C@H](CC[NH+](C)C)C(C)(C)C)c1cccc(Cl)c1 ZINC000522546432 333289577 /nfs/dbraw/zinc/28/95/77/333289577.db2.gz MCYYDWVQDVKBCG-XJKSGUPXSA-N 1 3 296.886 4.357 20 0 CIADHO CC(C)(C)C(C)(C)C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000551228360 334241588 /nfs/dbraw/zinc/24/15/88/334241588.db2.gz ICDDTNBEKNKVDB-UHFFFAOYSA-N 1 3 294.527 4.445 20 0 CIADHO CC(C)C(C[NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1)C(C)C ZINC000551804551 334262172 /nfs/dbraw/zinc/26/21/72/334262172.db2.gz ACOLOHZAZQFNGW-IRXDYDNUSA-N 1 3 294.527 4.157 20 0 CIADHO CC(C)C(C[NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1)C(C)C ZINC000551804549 334262319 /nfs/dbraw/zinc/26/23/19/334262319.db2.gz ACOLOHZAZQFNGW-DLBZAZTESA-N 1 3 294.527 4.157 20 0 CIADHO CC[C@@H]([NH2+]C[C@H]1CCCN(CC(C)C)C1)c1cccs1 ZINC000090585215 334364014 /nfs/dbraw/zinc/36/40/14/334364014.db2.gz CSEDRMSEVWGWDZ-HZPDHXFCSA-N 1 3 294.508 4.157 20 0 CIADHO CC(C)[C@@H]([NH2+]Cc1cccc(CN(C)C)c1)c1ccccc1 ZINC000091281247 334375088 /nfs/dbraw/zinc/37/50/88/334375088.db2.gz GQJBVDOQWZYFKM-HXUWFJFHSA-N 1 3 296.458 4.235 20 0 CIADHO CCN1CC[C@@H](C[NH2+][C@H](CC(C)(C)C)c2ccccc2)C1 ZINC000252438358 334380141 /nfs/dbraw/zinc/38/01/41/334380141.db2.gz AHGLZHDQJWTWQL-FUHWJXTLSA-N 1 3 288.479 4.095 20 0 CIADHO CC[N@@H+]1CC[C@@H](CN[C@H](CC(C)(C)C)c2ccccc2)C1 ZINC000252438358 334380143 /nfs/dbraw/zinc/38/01/43/334380143.db2.gz AHGLZHDQJWTWQL-FUHWJXTLSA-N 1 3 288.479 4.095 20 0 CIADHO CC[N@H+]1CC[C@@H](CN[C@H](CC(C)(C)C)c2ccccc2)C1 ZINC000252438358 334380145 /nfs/dbraw/zinc/38/01/45/334380145.db2.gz AHGLZHDQJWTWQL-FUHWJXTLSA-N 1 3 288.479 4.095 20 0 CIADHO C[C@@H]1CC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)C[C@H]1C ZINC000568142337 334795703 /nfs/dbraw/zinc/79/57/03/334795703.db2.gz GQECUVRIQPHVQN-JFIYKMOQSA-N 1 3 292.511 4.198 20 0 CIADHO CN1CC=C(C[NH2+][C@@H](CC(C)(C)C)c2ccccc2)CC1 ZINC000344285643 335245832 /nfs/dbraw/zinc/24/58/32/335245832.db2.gz HNHMYICOJYQOEH-SFHVURJKSA-N 1 3 286.463 4.015 20 0 CIADHO CC(C)N1CC[C@@H](C[NH2+][C@H](C)CCC2CCCCC2)C1 ZINC000581634739 336115291 /nfs/dbraw/zinc/11/52/91/336115291.db2.gz CIRFTSJVWZTLAD-AEFFLSMTSA-N 1 3 280.500 4.055 20 0 CIADHO CC(C)N1CC[C@@H](C[NH2+][C@@H](C)CCC2CCCCC2)C1 ZINC000581634742 336115294 /nfs/dbraw/zinc/11/52/94/336115294.db2.gz CIRFTSJVWZTLAD-WMZOPIPTSA-N 1 3 280.500 4.055 20 0 CIADHO CC(C)[C@H]([NH2+][C@H]1C[C@@H](N)c2ccccc21)c1ccccc1 ZINC000227536957 519821524 /nfs/dbraw/zinc/82/15/24/519821524.db2.gz FJNGKWZGZCHZOH-QYZOEREBSA-N 1 3 280.415 4.118 20 0 CIADHO CC(C)[C@H]([NH2+][C@@H]1C[C@@H](N)c2ccccc21)c1ccccc1 ZINC000227536946 519821657 /nfs/dbraw/zinc/82/16/57/519821657.db2.gz FJNGKWZGZCHZOH-QRVBRYPASA-N 1 3 280.415 4.118 20 0 CIADHO CCC[C@@H](NCc1ccc(C[NH+](C)C)cc1)c1ccccc1 ZINC000171127103 335055952 /nfs/dbraw/zinc/05/59/52/335055952.db2.gz JCJAPNLJHMTZFZ-HXUWFJFHSA-N 1 3 296.458 4.379 20 0 CIADHO CC(C)[C@@H]([NH2+]Cc1ccc(CN(C)C)cc1)c1ccccc1 ZINC000171127739 335055954 /nfs/dbraw/zinc/05/59/54/335055954.db2.gz FIPQPRVTGVEXHA-HXUWFJFHSA-N 1 3 296.458 4.235 20 0 CIADHO CC(C)CN1CCC([NH2+]Cc2ccc(C(C)C)cc2)CC1 ZINC000221809546 262299383 /nfs/dbraw/zinc/29/93/83/262299383.db2.gz UFQFNCHOVXHUHR-UHFFFAOYSA-N 1 3 288.479 4.020 20 0 CIADHO CC(C)c1ccc(CN[C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000415044839 263257847 /nfs/dbraw/zinc/25/78/47/263257847.db2.gz BEZUQXKHUMQGFM-FQEVSTJZSA-N 1 3 296.458 4.380 20 0 CIADHO CCC[C@@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)c1ccsc1 ZINC000187701435 263266563 /nfs/dbraw/zinc/26/65/63/263266563.db2.gz JPFUMZGKONDXOP-DOTOQJQBSA-N 1 3 294.508 4.299 20 0 CIADHO CC(C)Sc1ccc([C@H](C)[NH2+]C[C@H](C)CN(C)C)cc1 ZINC000425951884 264070805 /nfs/dbraw/zinc/07/08/05/264070805.db2.gz REDDCAKUARVEJS-GJZGRUSLSA-N 1 3 294.508 4.035 20 0 CIADHO CC(C)Sc1ccc([C@@H](C)[NH2+]C[C@@H](C)CN(C)C)cc1 ZINC000425951885 264070843 /nfs/dbraw/zinc/07/08/43/264070843.db2.gz REDDCAKUARVEJS-HUUCEWRRSA-N 1 3 294.508 4.035 20 0 CIADHO CC(C)Sc1ccc([C@H](C)[NH2+]C[C@@H](C)CN(C)C)cc1 ZINC000425951883 264070956 /nfs/dbraw/zinc/07/09/56/264070956.db2.gz REDDCAKUARVEJS-CABCVRRESA-N 1 3 294.508 4.035 20 0 CIADHO C[C@H]1C[C@H](NCc2ccc(C[NH+](C)C)cc2)c2ccccc21 ZINC000356866268 266198843 /nfs/dbraw/zinc/19/88/43/266198843.db2.gz IHSBMUTZLBRBTG-YWZLYKJASA-N 1 3 294.442 4.086 20 0 CIADHO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(CCC2CCCC2)C1 ZINC000303944170 328370931 /nfs/dbraw/zinc/37/09/31/328370931.db2.gz UEUMRYSRNMIHGJ-IEBWSBKVSA-N 1 3 292.511 4.153 20 0 CIADHO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(CCC2CCCC2)C1 ZINC000303944170 328370932 /nfs/dbraw/zinc/37/09/32/328370932.db2.gz UEUMRYSRNMIHGJ-IEBWSBKVSA-N 1 3 292.511 4.153 20 0 CIADHO C[C@@H]1CCCCN1C[C@@H]1CCC[N@H+](CCC2CCCC2)C1 ZINC000303944170 328370933 /nfs/dbraw/zinc/37/09/33/328370933.db2.gz UEUMRYSRNMIHGJ-IEBWSBKVSA-N 1 3 292.511 4.153 20 0 CIADHO C[C@@H]1CCCCN1C[C@@H]1CCC[N@@H+](CCC2CCCC2)C1 ZINC000303944170 328370934 /nfs/dbraw/zinc/37/09/34/328370934.db2.gz UEUMRYSRNMIHGJ-IEBWSBKVSA-N 1 3 292.511 4.153 20 0 CIADHO Cc1cc([C@@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@H+]3C)c(C)s1 ZINC000088163892 327016702 /nfs/dbraw/zinc/01/67/02/327016702.db2.gz DZKPDSFFRODJLC-OHRKKDJYSA-N 1 3 292.492 4.031 20 0 CIADHO Cc1cc([C@@H](C)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c(C)s1 ZINC000088163892 327016703 /nfs/dbraw/zinc/01/67/03/327016703.db2.gz DZKPDSFFRODJLC-OHRKKDJYSA-N 1 3 292.492 4.031 20 0 CIADHO C[C@@H](CCCC[NH3+])N[C@@H](C)c1ccc(Cl)cc1Cl ZINC000381242395 327171488 /nfs/dbraw/zinc/17/14/88/327171488.db2.gz KOTUAPIASKRVKZ-QWRGUYRKSA-N 1 3 289.250 4.162 20 0 CIADHO CC(C)N1CCC[C@@H](C[NH2+][C@@H]2CCCCC23CCCC3)C1 ZINC000559751806 327259718 /nfs/dbraw/zinc/25/97/18/327259718.db2.gz BUUOVJIWUHTCLX-ZWKOTPCHSA-N 1 3 292.511 4.199 20 0 CIADHO C[C@@H]1CCC[C@@H](C[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000583400883 327344549 /nfs/dbraw/zinc/34/45/49/327344549.db2.gz RLJAZWVERGSXED-IAGOWNOFSA-N 1 3 292.511 4.199 20 0 CIADHO CC(C)(C)N1CCC([NH2+]C[C@@H]2CCCC(C)(C)C2)CC1 ZINC000562869851 327521057 /nfs/dbraw/zinc/52/10/57/327521057.db2.gz ZMCCQZCWXYMZEI-OAHLLOKOSA-N 1 3 280.500 4.055 20 0 CIADHO Cc1ccc(C)c([C@@H](C)NCc2ccc(C[NH+](C)C)cc2)c1 ZINC000532200988 328705100 /nfs/dbraw/zinc/70/51/00/328705100.db2.gz SKPBPZURNDKZAP-QGZVFWFLSA-N 1 3 296.458 4.216 20 0 CIADHO CCCC[C@@H](NCc1ccc(C[NH3+])cc1)c1ccccc1 ZINC000582301984 328954987 /nfs/dbraw/zinc/95/49/87/328954987.db2.gz NFVCQASXMHBBPO-LJQANCHMSA-N 1 3 282.431 4.166 20 0 CIADHO C[C@@H](N[C@@H](C)CCCC[NH3+])c1cc(Cl)ccc1Cl ZINC000422789943 330157389 /nfs/dbraw/zinc/15/73/89/330157389.db2.gz XFGBMDIYPPMPOG-WDEREUQCSA-N 1 3 289.250 4.162 20 0 CIADHO CC[C@H](C)[C@H](N[C@H](C)[C@H]1CC[NH2+]C1)c1ccc(Cl)cc1 ZINC000422789484 330157436 /nfs/dbraw/zinc/15/74/36/330157436.db2.gz WWWFCKKZUQDVRN-YXPYIKCWSA-N 1 3 294.870 4.015 20 0 CIADHO CC(C)(C)C[C@H](N[C@@H]1CCC[NH2+]CC1)c1ccc(F)cc1 ZINC000422903498 330162191 /nfs/dbraw/zinc/16/21/91/330162191.db2.gz WGDHNCVDMSSDSC-SJORKVTESA-N 1 3 292.442 4.035 20 0 CIADHO C[C@@H](NC[C@@H]1CCC[NH2+]C1)c1cccc(-c2ccccc2)c1 ZINC000423207825 330177336 /nfs/dbraw/zinc/17/73/36/330177336.db2.gz HHHDEYJBLDSIBP-IAGOWNOFSA-N 1 3 294.442 4.004 20 0 CIADHO C[C@@H](NCC[C@H](C)[NH3+])c1ccc(SC2CCCC2)cc1 ZINC000423222825 330179782 /nfs/dbraw/zinc/17/97/82/330179782.db2.gz CVWBKZIIOQMPBE-UONOGXRCSA-N 1 3 292.492 4.109 20 0 CIADHO CC[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1cccc(C)c1 ZINC000423290542 330186882 /nfs/dbraw/zinc/18/68/82/330186882.db2.gz DKYKCQUFHXSKTN-BEFAXECRSA-N 1 3 282.431 4.256 20 0 CIADHO Cc1cc(C)c([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)cc1C ZINC000423291179 330187002 /nfs/dbraw/zinc/18/70/02/330187002.db2.gz HDYLUTZOTIWIAK-DLBZAZTESA-N 1 3 296.458 4.482 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc(Cl)s2)cc1 ZINC000423290999 330187189 /nfs/dbraw/zinc/18/71/89/330187189.db2.gz GGMBMEWNXAURIP-MNOVXSKESA-N 1 3 294.851 4.272 20 0 CIADHO CC[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1cccc(F)c1 ZINC000423292263 330187350 /nfs/dbraw/zinc/18/73/50/330187350.db2.gz MGLDIQKZWUONEC-ACJLOTCBSA-N 1 3 286.394 4.086 20 0 CIADHO CC[C@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccc(F)c1 ZINC000423292266 330187503 /nfs/dbraw/zinc/18/75/03/330187503.db2.gz MGLDIQKZWUONEC-UGSOOPFHSA-N 1 3 286.394 4.086 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2ccc(Cl)cc2)cc1 ZINC000423292525 330187626 /nfs/dbraw/zinc/18/76/26/330187626.db2.gz NGMAEMUGJCPEIM-CHWSQXEVSA-N 1 3 288.822 4.211 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc(Cl)cc2)cc1 ZINC000423292528 330187739 /nfs/dbraw/zinc/18/77/39/330187739.db2.gz NGMAEMUGJCPEIM-STQMWFEESA-N 1 3 288.822 4.211 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@H]2CC(C)(C)c3ccccc32)cc1 ZINC000423295304 330188342 /nfs/dbraw/zinc/18/83/42/330188342.db2.gz WKMRGFIXRFRDJQ-KUHUBIRLSA-N 1 3 294.442 4.219 20 0 CIADHO CCC([NH3+])(CC)CN[C@H]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000423296437 330188788 /nfs/dbraw/zinc/18/87/88/330188788.db2.gz ZFSXVXRRFYCOEF-HOCLYGCPSA-N 1 3 294.870 4.083 20 0 CIADHO C[C@@H]1CC[C@H](NCc2ccc3c(c2)C[NH2+]C3)c2ccccc21 ZINC000423370912 330194854 /nfs/dbraw/zinc/19/48/54/330194854.db2.gz GBAIFFJJFMMDFV-VLIAUNLRSA-N 1 3 292.426 4.018 20 0 CIADHO CC(C)Sc1ccc([C@H](C)N[C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000423398996 330196006 /nfs/dbraw/zinc/19/60/06/330196006.db2.gz UMNQGQKLTOSGCA-CWRNSKLLSA-N 1 3 292.492 4.108 20 0 CIADHO C[C@@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc(SC2CCCC2)cc1 ZINC000423442239 330201835 /nfs/dbraw/zinc/20/18/35/330201835.db2.gz JSBVVOBVMXPUJC-RDBSUJKOSA-N 1 3 292.492 4.108 20 0 CIADHO Cc1ccc(C)c([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000423496843 330207752 /nfs/dbraw/zinc/20/77/52/330207752.db2.gz FNDHRBYPFYJPQQ-PXNSSMCTSA-N 1 3 296.458 4.434 20 0 CIADHO Cc1ccc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c(C)c1 ZINC000423497391 330207908 /nfs/dbraw/zinc/20/79/08/330207908.db2.gz GWBWRHGYDYJCSA-PXNSSMCTSA-N 1 3 296.458 4.434 20 0 CIADHO Cc1cccc2c1CC[C@H]2N[C@H](CCC[NH3+])c1ccccc1 ZINC000423500132 330208255 /nfs/dbraw/zinc/20/82/55/330208255.db2.gz KDMWDMBZYFUIDW-WOJBJXKFSA-N 1 3 294.442 4.052 20 0 CIADHO CC[C@@H](N[C@H](CCC[NH3+])c1ccccc1)c1ccsc1 ZINC000423501457 330208415 /nfs/dbraw/zinc/20/84/15/330208415.db2.gz CUHDJEJEOKSQGN-IAGOWNOFSA-N 1 3 288.460 4.269 20 0 CIADHO CCc1ccc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423507146 330208763 /nfs/dbraw/zinc/20/87/63/330208763.db2.gz PRDHDKPMSAITGK-UZLBHIALSA-N 1 3 296.458 4.380 20 0 CIADHO Cc1ccc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)cc1C ZINC000423513125 330209435 /nfs/dbraw/zinc/20/94/35/330209435.db2.gz VFDLPUAKJJSDNA-XLIONFOSSA-N 1 3 296.458 4.434 20 0 CIADHO CC[C@@H](C)c1ccc([C@@H](C)[NH2+]CC2=CCN(C)CC2)cc1 ZINC000527876477 330291204 /nfs/dbraw/zinc/29/12/04/330291204.db2.gz OTBIHGFERHBCAE-HZPDHXFCSA-N 1 3 286.463 4.113 20 0 CIADHO CC[C@@H](C)c1ccc([C@H](C)[NH2+]CC2=CCN(C)CC2)cc1 ZINC000527876475 330291265 /nfs/dbraw/zinc/29/12/65/330291265.db2.gz OTBIHGFERHBCAE-CVEARBPZSA-N 1 3 286.463 4.113 20 0 CIADHO CCC[C@@H](NC[C@@H]1CCC[N@H+](C)C1)c1ccc(Cl)cc1 ZINC000044534215 330329867 /nfs/dbraw/zinc/32/98/67/330329867.db2.gz CKEZPZSIECDXFF-WMLDXEAASA-N 1 3 294.870 4.113 20 0 CIADHO CCC[C@@H](NC[C@@H]1CCC[N@@H+](C)C1)c1ccc(Cl)cc1 ZINC000044534215 330329868 /nfs/dbraw/zinc/32/98/68/330329868.db2.gz CKEZPZSIECDXFF-WMLDXEAASA-N 1 3 294.870 4.113 20 0 CIADHO CCC(C)(C)C1CCC([NH2+][C@H]2CCN3CCC[C@@H]3C2)CC1 ZINC000106868871 330341494 /nfs/dbraw/zinc/34/14/94/330341494.db2.gz VAMGYFCPEQSFED-ZGUYJTEBSA-N 1 3 292.511 4.198 20 0 CIADHO CC[NH+](CC)Cc1ccccc1CN[C@@H](C)c1ccccc1 ZINC000120893624 330393931 /nfs/dbraw/zinc/39/39/31/330393931.db2.gz UREUHRQQRBNOGI-KRWDZBQOSA-N 1 3 296.458 4.379 20 0 CIADHO CCC(C)(C)C[NH2+]C1CCN([C@@H]2CCC[C@H](C)C2)CC1 ZINC000429434717 330546513 /nfs/dbraw/zinc/54/65/13/330546513.db2.gz IIAOBQVAGIUZAN-DOTOQJQBSA-N 1 3 280.500 4.055 20 0 CIADHO C[C@@H]1CC(C)(C)C[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000434771664 330644813 /nfs/dbraw/zinc/64/48/13/330644813.db2.gz AOMVQMFFKWPQMX-CRAIPNDOSA-N 1 3 292.511 4.198 20 0 CIADHO C[C@@H](CCCC(F)(F)F)[NH2+]C1CC(C)(C)NC(C)(C)C1 ZINC000163231098 331004797 /nfs/dbraw/zinc/00/47/97/331004797.db2.gz WRSCRCTWALTCGW-NSHDSACASA-N 1 3 294.405 4.006 20 0 CIADHO CCC[NH+]1CCC(N[C@@H]2CC[C@@H](C)c3ccsc32)CC1 ZINC000453076383 331086981 /nfs/dbraw/zinc/08/69/81/331086981.db2.gz HQFHKHOORXHNFT-CZUORRHYSA-N 1 3 292.492 4.151 20 0 CIADHO CC(C)[NH+]1CCC(N[C@@H]2CC[C@H](C)c3ccsc32)CC1 ZINC000453143497 331093764 /nfs/dbraw/zinc/09/37/64/331093764.db2.gz FSUTWOPZPIXGNP-XJKSGUPXSA-N 1 3 292.492 4.149 20 0 CIADHO CC(C)N1CCC[C@@H](C[NH2+]C2CCC(C(C)(C)C)CC2)C1 ZINC000462750138 331327489 /nfs/dbraw/zinc/32/74/89/331327489.db2.gz WVEIMLQZDYSNKA-AOCRQIFASA-N 1 3 294.527 4.301 20 0 CIADHO CC1(C)CCC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000487788081 331981342 /nfs/dbraw/zinc/98/13/42/331981342.db2.gz VPAHMAJRPOLGKN-QGZVFWFLSA-N 1 3 292.511 4.342 20 0 CIADHO C[C@@H](N[C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc(Cl)cc1 ZINC000523853874 333348238 /nfs/dbraw/zinc/34/82/38/333348238.db2.gz YIVRHEMBZFCURH-CJNGLKHVSA-N 1 3 296.886 4.357 20 0 CIADHO CC(C)c1ccc([C@H](C)N[C@@H]2C[C@H](C)[N@H+](C)C[C@@H]2C)cc1 ZINC000252414968 334379188 /nfs/dbraw/zinc/37/91/88/334379188.db2.gz QXKBYOJOIQTDHW-IUVQAAGXSA-N 1 3 288.479 4.189 20 0 CIADHO CC(C)c1ccc([C@H](C)N[C@@H]2C[C@H](C)[N@@H+](C)C[C@@H]2C)cc1 ZINC000252414968 334379190 /nfs/dbraw/zinc/37/91/90/334379190.db2.gz QXKBYOJOIQTDHW-IUVQAAGXSA-N 1 3 288.479 4.189 20 0 CIADHO Cc1ccc2cc([C@@H](C)NCc3ccc(C[NH3+])cc3)oc2c1 ZINC000577062687 335293867 /nfs/dbraw/zinc/29/38/67/335293867.db2.gz ZICPZURRQKIUTR-CQSZACIVSA-N 1 3 294.398 4.051 20 0 CIADHO CCC[C@H](NCc1ccc(C[NH+](C)C)cc1)c1ccccc1 ZINC000171127098 335055849 /nfs/dbraw/zinc/05/58/49/335055849.db2.gz JCJAPNLJHMTZFZ-FQEVSTJZSA-N 1 3 296.458 4.379 20 0 CIADHO CC(C)CN1CCC([NH2+][C@H](C)c2cccc(Cl)c2)CC1 ZINC000221715405 262291551 /nfs/dbraw/zinc/29/15/51/262291551.db2.gz ARXDXKONMTWEKM-CQSZACIVSA-N 1 3 294.870 4.111 20 0 CIADHO Cc1ccc([C@@H](C)[NH2+]C2CCN(C(C)(C)C)CC2)cc1F ZINC000094837533 265263232 /nfs/dbraw/zinc/26/32/32/265263232.db2.gz NBIAXQURBUQYGO-CQSZACIVSA-N 1 3 292.442 4.048 20 0 CIADHO C[C@@H]1C[C@H](NCc2ccc(C[NH+](C)C)cc2)c2ccccc21 ZINC000356866267 266198479 /nfs/dbraw/zinc/19/84/79/266198479.db2.gz IHSBMUTZLBRBTG-QRWLVFNGSA-N 1 3 294.442 4.086 20 0 CIADHO CC(C)N1CCC[C@@H](C[NH2+][C@H](C)c2ccc(Cl)cc2)C1 ZINC000531703049 328026303 /nfs/dbraw/zinc/02/63/03/328026303.db2.gz ARCAFWXPMRKQOM-CABCVRRESA-N 1 3 294.870 4.111 20 0 CIADHO C[C@H]1CCC[C@@H](C[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000583400882 327344638 /nfs/dbraw/zinc/34/46/38/327344638.db2.gz RLJAZWVERGSXED-DLBZAZTESA-N 1 3 292.511 4.199 20 0 CIADHO Cc1ccc(C)c([C@H](C)NCc2ccc(C[NH+](C)C)cc2)c1 ZINC000532200987 328705086 /nfs/dbraw/zinc/70/50/86/328705086.db2.gz SKPBPZURNDKZAP-KRWDZBQOSA-N 1 3 296.458 4.216 20 0 CIADHO CCC[C@@H](NCc1cccc(C[NH+](C)C)c1)c1ccccc1 ZINC000123580783 329560109 /nfs/dbraw/zinc/56/01/09/329560109.db2.gz FEKPBFCBRZCYCQ-HXUWFJFHSA-N 1 3 296.458 4.379 20 0 CIADHO [NH3+][C@@H]1C[C@H](N[C@H]2CCC[C@@H]2c2ccccc2)c2ccccc21 ZINC000422702892 330151048 /nfs/dbraw/zinc/15/10/48/330151048.db2.gz GJCGVCGOODGFGC-XCLNPWKQSA-N 1 3 292.426 4.057 20 0 CIADHO [NH3+][C@@H]1C[C@H](N[C@@H]2CCC[C@H]2c2ccccc2)c2ccccc21 ZINC000422702891 330151196 /nfs/dbraw/zinc/15/11/96/330151196.db2.gz GJCGVCGOODGFGC-OBZTUIKSSA-N 1 3 292.426 4.057 20 0 CIADHO N[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2)C2CCC2)c2ccccc21 ZINC000422708377 330151467 /nfs/dbraw/zinc/15/14/67/330151467.db2.gz BVYTUDKJKPSITI-AQNXPRMDSA-N 1 3 292.426 4.262 20 0 CIADHO CCCC[C@@H](CCC)C[NH2+][C@@H](C)c1ccc(CN)nc1C ZINC000422865198 330157974 /nfs/dbraw/zinc/15/79/74/330157974.db2.gz OKQRMKRCCAECDI-GOEBONIOSA-N 1 3 291.483 4.106 20 0 CIADHO C[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@@H]1C[C@@H](N)c2ccccc21 ZINC000423030833 330166183 /nfs/dbraw/zinc/16/61/83/330166183.db2.gz WLULZHHJDYKRSY-WNISUXOKSA-N 1 3 292.426 4.044 20 0 CIADHO C[C@H](NCCC[NH3+])c1ccc(-c2ccccc2Cl)s1 ZINC000423178928 330175013 /nfs/dbraw/zinc/17/50/13/330175013.db2.gz LHYUJEWOHUOYJE-NSHDSACASA-N 1 3 294.851 4.068 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CCCc3ccc(F)cc32)cc1 ZINC000423289901 330186358 /nfs/dbraw/zinc/18/63/58/330186358.db2.gz BYNXORFZFNBPNJ-ORAYPTAESA-N 1 3 298.405 4.013 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@@H]2CCCCc3ccccc32)cc1 ZINC000423289666 330186615 /nfs/dbraw/zinc/18/66/15/330186615.db2.gz BMGNXBHELVWKLM-FOIQADDNSA-N 1 3 294.442 4.264 20 0 CIADHO CCc1ccc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)s1 ZINC000423291515 330187118 /nfs/dbraw/zinc/18/71/18/330187118.db2.gz IRYIDMCSZWEYLE-OLZOCXBDSA-N 1 3 288.460 4.181 20 0 CIADHO CC(C)[C@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccccc1 ZINC000423292107 330187344 /nfs/dbraw/zinc/18/73/44/330187344.db2.gz LJHZFWQXPNIWPZ-KXBFYZLASA-N 1 3 282.431 4.193 20 0 CIADHO CCC([NH3+])(CC)CN[C@@H]1CC[C@@H](c2ccc(Cl)cc2)C1 ZINC000423292445 330187516 /nfs/dbraw/zinc/18/75/16/330187516.db2.gz NBRTVJHTVMZGOD-GDBMZVCRSA-N 1 3 294.870 4.083 20 0 CIADHO Cc1ccc(C)c([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000423294964 330187981 /nfs/dbraw/zinc/18/79/81/330187981.db2.gz VVZQALHXBUVVEO-HOTGVXAUSA-N 1 3 282.431 4.174 20 0 CIADHO CC(C)(C)[C@@H](NCC1=CC[NH2+]CC1)c1cc2ccccc2o1 ZINC000423331143 330191305 /nfs/dbraw/zinc/19/13/05/330191305.db2.gz CIGJJNOBEIJTDW-SFHVURJKSA-N 1 3 298.430 4.029 20 0 CIADHO C[C@H]([NH2+][C@H]1CCN[C@H](C)C1)c1cccc(-c2ccccc2)c1 ZINC000423401752 330196184 /nfs/dbraw/zinc/19/61/84/330196184.db2.gz XGVLOWSCBQYABR-GUXCAODWSA-N 1 3 294.442 4.145 20 0 CIADHO Cc1cc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)cs1 ZINC000423500527 330208250 /nfs/dbraw/zinc/20/82/50/330208250.db2.gz CCHMQJAZSJABGB-RHSMWYFYSA-N 1 3 288.460 4.187 20 0 CIADHO Cc1ccsc1[C@H](C)N[C@@H](CCC[NH3+])c1ccccc1 ZINC000423514296 330209369 /nfs/dbraw/zinc/20/93/69/330209369.db2.gz WESXLHNOVVFWLJ-HOCLYGCPSA-N 1 3 288.460 4.187 20 0 CIADHO Cc1ccccc1[C@@H](C)N[C@H](CCC[NH3+])c1ccccc1 ZINC000423518609 330209820 /nfs/dbraw/zinc/20/98/20/330209820.db2.gz ZKHVRICSJJRORO-VQIMIIECSA-N 1 3 282.431 4.126 20 0 CIADHO Cc1cccc([C@H](NC2CC[NH+](C(C)C)CC2)C(C)C)c1 ZINC000527866427 330285673 /nfs/dbraw/zinc/28/56/73/330285673.db2.gz PHYSYOBWPJUJBF-LJQANCHMSA-N 1 3 288.479 4.155 20 0 CIADHO CCC[N@@H+]1CC[C@H](CN[C@@H]2CC[C@H](C)c3ccsc32)C1 ZINC000453097111 331088807 /nfs/dbraw/zinc/08/88/07/331088807.db2.gz OMZNYFKFYYWIJV-SQWLQELKSA-N 1 3 292.492 4.008 20 0 CIADHO CCC[N@H+]1CC[C@H](CN[C@@H]2CC[C@H](C)c3ccsc32)C1 ZINC000453097111 331088808 /nfs/dbraw/zinc/08/88/08/331088808.db2.gz OMZNYFKFYYWIJV-SQWLQELKSA-N 1 3 292.492 4.008 20 0 CIADHO CCCN1CC[C@H](C[NH2+][C@@H]2CC[C@H](C)c3ccsc32)C1 ZINC000453097111 331088809 /nfs/dbraw/zinc/08/88/09/331088809.db2.gz OMZNYFKFYYWIJV-SQWLQELKSA-N 1 3 292.492 4.008 20 0 CIADHO CCC[N@@H+]1CC[C@H](CN[C@@H]2CC[C@@H](C)c3ccsc32)C1 ZINC000453097109 331088848 /nfs/dbraw/zinc/08/88/48/331088848.db2.gz OMZNYFKFYYWIJV-IIAWOOMASA-N 1 3 292.492 4.008 20 0 CIADHO CCC[N@H+]1CC[C@H](CN[C@@H]2CC[C@@H](C)c3ccsc32)C1 ZINC000453097109 331088849 /nfs/dbraw/zinc/08/88/49/331088849.db2.gz OMZNYFKFYYWIJV-IIAWOOMASA-N 1 3 292.492 4.008 20 0 CIADHO CCCN1CC[C@H](C[NH2+][C@@H]2CC[C@@H](C)c3ccsc32)C1 ZINC000453097109 331088850 /nfs/dbraw/zinc/08/88/50/331088850.db2.gz OMZNYFKFYYWIJV-IIAWOOMASA-N 1 3 292.492 4.008 20 0 CIADHO CC[C@H]([NH2+]C1CCN(C2CCCC2)CC1)c1ccsc1 ZINC000453146647 331094183 /nfs/dbraw/zinc/09/41/83/331094183.db2.gz XOEIBIZYJZVIAU-KRWDZBQOSA-N 1 3 292.492 4.196 20 0 CIADHO CC(C)[C@H]1C[C@@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc21 ZINC000453375634 331124830 /nfs/dbraw/zinc/12/48/30/331124830.db2.gz XYVTXAJVYATIPA-JXKHTJAUSA-N 1 3 298.474 4.086 20 0 CIADHO CC(C)[C@H]1C[C@@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc21 ZINC000453375634 331124831 /nfs/dbraw/zinc/12/48/31/331124831.db2.gz XYVTXAJVYATIPA-JXKHTJAUSA-N 1 3 298.474 4.086 20 0 CIADHO C[C@@H]([NH2+]C1CC(C(C)(C)C)C1)[C@H]1CCCN(C2CCC2)C1 ZINC000459468475 331283205 /nfs/dbraw/zinc/28/32/05/331283205.db2.gz QTAVZFCWFZLAPX-XNIRIUNOSA-N 1 3 292.511 4.054 20 0 CIADHO CC[C@@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1cccc(F)c1 ZINC000166528511 331307468 /nfs/dbraw/zinc/30/74/68/331307468.db2.gz DADNOSDNHSIOFW-QGZVFWFLSA-N 1 3 292.442 4.129 20 0 CIADHO CC(C)CC1(C[NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000513329808 333014439 /nfs/dbraw/zinc/01/44/39/333014439.db2.gz GSLJDTPYGSQFHK-UHFFFAOYSA-N 1 3 292.511 4.199 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H](CC2CC2)c2ccccc2)cc1 ZINC000521607233 333179849 /nfs/dbraw/zinc/17/98/49/333179849.db2.gz KCNQIRJPOUUJAU-YWZLYKJASA-N 1 3 294.442 4.337 20 0 CIADHO Cc1cccc([C@H](C)NCc2cccc(C[NH+](C)C)c2)c1C ZINC000123610316 333549420 /nfs/dbraw/zinc/54/94/20/333549420.db2.gz LZRATLTUQJIIGO-KRWDZBQOSA-N 1 3 296.458 4.216 20 0 CIADHO Cc1ccc([C@H](C)NCc2cccc(C[NH+](C)C)c2)cc1C ZINC000123638565 333549891 /nfs/dbraw/zinc/54/98/91/333549891.db2.gz GSMBWUVSMQFVOJ-KRWDZBQOSA-N 1 3 296.458 4.216 20 0 CIADHO C[C@H]1CCC[C@H](N2CCC([NH2+]CCC3=CCCC3)CC2)C1 ZINC000542842653 333844672 /nfs/dbraw/zinc/84/46/72/333844672.db2.gz UVHDWVDSYHVQRZ-LPHOPBHVSA-N 1 3 290.495 4.120 20 0 CIADHO CC[C@@H](c1ccccc1)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000247218094 334277675 /nfs/dbraw/zinc/27/76/75/334277675.db2.gz XMYGYLLNNASREV-MOPGFXCFSA-N 1 3 286.463 4.088 20 0 CIADHO CC[C@@H](c1ccccc1)[N@@H+]1CCC[C@@H](N2CCCC2)CC1 ZINC000247218094 334277676 /nfs/dbraw/zinc/27/76/76/334277676.db2.gz XMYGYLLNNASREV-MOPGFXCFSA-N 1 3 286.463 4.088 20 0 CIADHO CC[C@@H](c1ccccc1)[N@H+]1CCC[C@@H](N2CCCC2)CC1 ZINC000247218094 334277677 /nfs/dbraw/zinc/27/76/77/334277677.db2.gz XMYGYLLNNASREV-MOPGFXCFSA-N 1 3 286.463 4.088 20 0 CIADHO CC(C)Cc1cccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000552245095 334307652 /nfs/dbraw/zinc/30/76/52/334307652.db2.gz QSTXOTYWNCXCPJ-JTDSTZFVSA-N 1 3 288.479 4.018 20 0 CIADHO CC(C)Cc1cccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000552245095 334307654 /nfs/dbraw/zinc/30/76/54/334307654.db2.gz QSTXOTYWNCXCPJ-JTDSTZFVSA-N 1 3 288.479 4.018 20 0 CIADHO CC(C)(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCN3CCC[C@@H]3C2)CC1 ZINC000250689942 334348660 /nfs/dbraw/zinc/34/86/60/334348660.db2.gz IYAYCZXMBMJFAW-VSZNYVQBSA-N 1 3 292.511 4.198 20 0 CIADHO CC(C)[C@H]([NH2+]Cc1cccc(CN(C)C)c1)c1ccccc1 ZINC000091281246 334375028 /nfs/dbraw/zinc/37/50/28/334375028.db2.gz GQJBVDOQWZYFKM-FQEVSTJZSA-N 1 3 296.458 4.235 20 0 CIADHO CCC(C)(C)C1CCC([NH2+][C@H]2CCN3CCC[C@H]3C2)CC1 ZINC000252674874 334385199 /nfs/dbraw/zinc/38/51/99/334385199.db2.gz VAMGYFCPEQSFED-FOIPXRHGSA-N 1 3 292.511 4.198 20 0 CIADHO CC(C)C[C@H](NCc1ccc(C[NH3+])cc1)c1cccs1 ZINC000564988401 334532875 /nfs/dbraw/zinc/53/28/75/334532875.db2.gz KJBMZRPGCPNZIQ-INIZCTEOSA-N 1 3 288.460 4.084 20 0 CIADHO C[C@H]1CCCC[C@@H]1C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000568915770 334846541 /nfs/dbraw/zinc/84/65/41/334846541.db2.gz DBAFQIFEGCNKCS-DLBZAZTESA-N 1 3 292.511 4.199 20 0 CIADHO CC(C)[C@H]([NH2+][C@@H]1C[C@H](N)c2ccccc21)c1ccccc1 ZINC000157317883 519821589 /nfs/dbraw/zinc/82/15/89/519821589.db2.gz FJNGKWZGZCHZOH-OTWHNJEPSA-N 1 3 280.415 4.118 20 0 CIADHO CC(C)[C@H]([NH2+][C@H]1C[C@H](N)c2ccccc21)c1ccccc1 ZINC000157318179 519821608 /nfs/dbraw/zinc/82/16/08/519821608.db2.gz FJNGKWZGZCHZOH-FHWLQOOXSA-N 1 3 280.415 4.118 20 0 CIADHO C[C@H](CC[NH2+]C1CCN(C(C)(C)C)CC1)c1ccccc1 ZINC000043534115 524193471 /nfs/dbraw/zinc/19/34/71/524193471.db2.gz YJDINRGHJQWTSY-MRXNPFEDSA-N 1 3 288.479 4.033 20 0 CIADHO C[C@H](CCNC1CC[NH+](C(C)(C)C)CC1)c1ccccc1 ZINC000043534115 524193478 /nfs/dbraw/zinc/19/34/78/524193478.db2.gz YJDINRGHJQWTSY-MRXNPFEDSA-N 1 3 288.479 4.033 20 0 CIADHO CC(C)(C)[C@@H]1CC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000574185155 334999100 /nfs/dbraw/zinc/99/91/00/334999100.db2.gz OQVMMQUJTCUSDN-QZTJIDSGSA-N 1 3 292.511 4.198 20 0 CIADHO C1CC2(CCCC2)[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000189143294 260204835 /nfs/dbraw/zinc/20/48/35/260204835.db2.gz DDBLTRSKLRXZJS-SFHVURJKSA-N 1 3 290.495 4.096 20 0 CIADHO CC(C)CN1CCC([NH2+][C@@H](C)c2cccc(Cl)c2)CC1 ZINC000221715351 262291565 /nfs/dbraw/zinc/29/15/65/262291565.db2.gz ARXDXKONMTWEKM-AWEZNQCLSA-N 1 3 294.870 4.111 20 0 CIADHO CC[C@@H]([NH2+]CCCN1CCCC[C@@H]1C)c1cccs1 ZINC000021511646 262389715 /nfs/dbraw/zinc/38/97/15/262389715.db2.gz BPURHOFCJHXMOS-LSDHHAIUSA-N 1 3 280.481 4.053 20 0 CIADHO CCCc1cccc(CN[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000415048108 263258137 /nfs/dbraw/zinc/25/81/37/263258137.db2.gz FPQQGXAZWRSYAC-FQEVSTJZSA-N 1 3 296.458 4.209 20 0 CIADHO CC[C@H](NCc1ccc(C[NH+](C)C)cc1)c1ccc(C)cc1 ZINC000171126764 327643668 /nfs/dbraw/zinc/64/36/68/327643668.db2.gz HLUZNQSWFMKVFE-FQEVSTJZSA-N 1 3 296.458 4.298 20 0 CIADHO Cc1ccc([C@H](NCc2ccc(C[NH3+])cc2)C2CCCC2)o1 ZINC000580197466 327729428 /nfs/dbraw/zinc/72/94/28/327729428.db2.gz JYKNBQRTWYNWJQ-LJQANCHMSA-N 1 3 298.430 4.068 20 0 CIADHO CC(C)N1CCC[C@H](C[NH2+][C@@H](C)c2ccc(Cl)cc2)C1 ZINC000531703067 328026239 /nfs/dbraw/zinc/02/62/39/328026239.db2.gz ARCAFWXPMRKQOM-LSDHHAIUSA-N 1 3 294.870 4.111 20 0 CIADHO CC(C)[C@@H]1C[C@H](NCc2ccc(C[NH3+])cc2)c2ccccc21 ZINC000571284520 328097799 /nfs/dbraw/zinc/09/77/99/328097799.db2.gz ALYSORLYSZZPLL-PMACEKPBSA-N 1 3 294.442 4.120 20 0 CIADHO CC(C)CC[C@@H](C)[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000569999230 327561188 /nfs/dbraw/zinc/56/11/88/327561188.db2.gz HSKNTOJXSRCWKJ-MRXNPFEDSA-N 1 3 280.500 4.198 20 0 CIADHO CC[C@@H](NCc1ccc(C[NH3+])cc1)c1ccc(Cl)s1 ZINC000582360857 328971019 /nfs/dbraw/zinc/97/10/19/328971019.db2.gz UZPPPUUBZXOUHT-CYBMUJFWSA-N 1 3 294.851 4.101 20 0 CIADHO N[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2)C2CCC2)c2ccccc21 ZINC000422708378 330151433 /nfs/dbraw/zinc/15/14/33/330151433.db2.gz BVYTUDKJKPSITI-HSALFYBXSA-N 1 3 292.426 4.262 20 0 CIADHO c1ccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[NH2+]3)C2CCCCC2)cc1 ZINC000422933057 330161040 /nfs/dbraw/zinc/16/10/40/330161040.db2.gz DCWXGDAILFWCQK-JIRNRHONSA-N 1 3 298.474 4.181 20 0 CIADHO CC[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccs1 ZINC000423289832 330186397 /nfs/dbraw/zinc/18/63/97/330186397.db2.gz BQXLVBVATZLDRF-SWLSCSKDSA-N 1 3 274.433 4.009 20 0 CIADHO CC[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccc(C)cc1 ZINC000423288996 330186517 /nfs/dbraw/zinc/18/65/17/330186517.db2.gz AHQCCOKQPOLPKV-HNAYVOBHSA-N 1 3 282.431 4.256 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CCCCc3ccccc32)cc1 ZINC000423289669 330186579 /nfs/dbraw/zinc/18/65/79/330186579.db2.gz BMGNXBHELVWKLM-YWZLYKJASA-N 1 3 294.442 4.264 20 0 CIADHO CC[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccc(C)cc1 ZINC000423288995 330186601 /nfs/dbraw/zinc/18/66/01/330186601.db2.gz AHQCCOKQPOLPKV-DNVCBOLYSA-N 1 3 282.431 4.256 20 0 CIADHO Cc1ccc([C@@H](NCc2ccc([C@H](C)[NH3+])cc2)C2CC2)cc1 ZINC000423291474 330187027 /nfs/dbraw/zinc/18/70/27/330187027.db2.gz ILCMXYCUDUQYJF-MGPUTAFESA-N 1 3 294.442 4.256 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CC(C)(C)Cc3occc32)cc1 ZINC000423291370 330187077 /nfs/dbraw/zinc/18/70/77/330187077.db2.gz HZUQGKUOZJLLLE-SUMWQHHRSA-N 1 3 298.430 4.103 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc(Cl)s2)cc1 ZINC000423291000 330187081 /nfs/dbraw/zinc/18/70/81/330187081.db2.gz GGMBMEWNXAURIP-QWRGUYRKSA-N 1 3 294.851 4.272 20 0 CIADHO Cc1ccc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)cc1C ZINC000423291496 330187242 /nfs/dbraw/zinc/18/72/42/330187242.db2.gz INSXSJBMABSALO-HOTGVXAUSA-N 1 3 282.431 4.174 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@H](c2ccc(F)cc2)C2CC2)cc1 ZINC000423292197 330187509 /nfs/dbraw/zinc/18/75/09/330187509.db2.gz LXZCDJWCAUKRDV-YJYMSZOUSA-N 1 3 298.405 4.086 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@H]2C[C@@H](C)c3ccccc32)cc1 ZINC000423291967 330187513 /nfs/dbraw/zinc/18/75/13/330187513.db2.gz KUENKSBVUJCYOC-TYILLQQXSA-N 1 3 280.415 4.044 20 0 CIADHO CC[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccc(F)c1 ZINC000423292265 330187545 /nfs/dbraw/zinc/18/75/45/330187545.db2.gz MGLDIQKZWUONEC-SCLBCKFNSA-N 1 3 286.394 4.086 20 0 CIADHO CC[C@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccsc1 ZINC000423292884 330187616 /nfs/dbraw/zinc/18/76/16/330187616.db2.gz OVADJWSYIYXNEL-LRDDRELGSA-N 1 3 274.433 4.009 20 0 CIADHO Cc1ccc(C)c([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000423294965 330188292 /nfs/dbraw/zinc/18/82/92/330188292.db2.gz VVZQALHXBUVVEO-HZPDHXFCSA-N 1 3 282.431 4.174 20 0 CIADHO Cc1cc(C)cc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000423295189 330188335 /nfs/dbraw/zinc/18/83/35/330188335.db2.gz WJTXSFNJDGMWEI-HOTGVXAUSA-N 1 3 282.431 4.174 20 0 CIADHO C[C@H]([NH2+][C@H]1CCNC[C@H]1C)c1cccc(-c2ccccc2)c1 ZINC000423363235 330193907 /nfs/dbraw/zinc/19/39/07/330193907.db2.gz BPRXFOKNWKQSCQ-GUXCAODWSA-N 1 3 294.442 4.002 20 0 CIADHO C[C@@H]1CC[C@@H](NCc2ccc3c(c2)C[NH2+]C3)c2ccccc21 ZINC000423370910 330194965 /nfs/dbraw/zinc/19/49/65/330194965.db2.gz GBAIFFJJFMMDFV-JLTOFOAXSA-N 1 3 292.426 4.018 20 0 CIADHO C[C@H]1CC[C@H](NCc2ccc3c(c2)C[NH2+]C3)c2sccc21 ZINC000423398972 330195940 /nfs/dbraw/zinc/19/59/40/330195940.db2.gz ULGGVQGYSBQVBC-SJCJKPOMSA-N 1 3 298.455 4.080 20 0 CIADHO CC(C)C[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccccc1 ZINC000423381923 330199166 /nfs/dbraw/zinc/19/91/66/330199166.db2.gz JPSMUCLAHCDTEK-FQEVSTJZSA-N 1 3 294.442 4.167 20 0 CIADHO C[C@H]([NH2+][C@H]1CCNC[C@@H]1C)c1ccc(-c2ccccc2)cc1 ZINC000423392740 330200760 /nfs/dbraw/zinc/20/07/60/330200760.db2.gz LYYMGMHCZSJKLB-FTRWYGJKSA-N 1 3 294.442 4.002 20 0 CIADHO CC[C@@H](NCCC[C@H]1CCC[NH2+]1)c1cccc(Cl)c1F ZINC000423476355 330205596 /nfs/dbraw/zinc/20/55/96/330205596.db2.gz IZYGCRGMRLWFHC-IUODEOHRSA-N 1 3 298.833 4.052 20 0 CIADHO Cc1ccc(C)c([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000423496842 330207949 /nfs/dbraw/zinc/20/79/49/330207949.db2.gz FNDHRBYPFYJPQQ-FXAWDEMLSA-N 1 3 296.458 4.434 20 0 CIADHO Cc1cccc2c1CC[C@@H]2N[C@H](CCC[NH3+])c1ccccc1 ZINC000423500130 330208236 /nfs/dbraw/zinc/20/82/36/330208236.db2.gz KDMWDMBZYFUIDW-UXHICEINSA-N 1 3 294.442 4.052 20 0 CIADHO Cc1cccc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)c1C ZINC000423502534 330208479 /nfs/dbraw/zinc/20/84/79/330208479.db2.gz MAUHMAZFUMAUBY-YLJYHZDGSA-N 1 3 296.458 4.434 20 0 CIADHO CCc1ccc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423507144 330208703 /nfs/dbraw/zinc/20/87/03/330208703.db2.gz PRDHDKPMSAITGK-OXQOHEQNSA-N 1 3 296.458 4.380 20 0 CIADHO Cc1ccc2c(c1)[C@@H](N[C@@H](CCC[NH3+])c1ccccc1)CC2 ZINC000423510111 330209060 /nfs/dbraw/zinc/20/90/60/330209060.db2.gz SBRVBGKMWOIYTM-PMACEKPBSA-N 1 3 294.442 4.052 20 0 CIADHO Cc1cccc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000423518695 330209778 /nfs/dbraw/zinc/20/97/78/330209778.db2.gz ZQAXLHHQBZXVKG-LPHOPBHVSA-N 1 3 282.431 4.126 20 0 CIADHO CC(C)C(C)(C)C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000437096057 330693345 /nfs/dbraw/zinc/69/33/45/330693345.db2.gz LQSHKTOHKGFUSQ-UHFFFAOYSA-N 1 3 280.500 4.055 20 0 CIADHO Cc1cc([C@@H](C)NCCCC[NH+]2CCC(C)CC2)c(C)o1 ZINC000447545179 330869508 /nfs/dbraw/zinc/86/95/08/330869508.db2.gz WJECWBYDQSEWTK-MRXNPFEDSA-N 1 3 292.467 4.059 20 0 CIADHO Cc1cc([C@@H](C)[NH2+]C2CCN(C3CCCC3)CC2)cs1 ZINC000453120264 331091274 /nfs/dbraw/zinc/09/12/74/331091274.db2.gz CDVHSUCGLROZET-CQSZACIVSA-N 1 3 292.492 4.114 20 0 CIADHO C[C@@H]1CC[C@@H]([NH2+]C2CCN(C3CCCCC3)CC2)[C@H](C)C1 ZINC000482965223 331854335 /nfs/dbraw/zinc/85/43/35/331854335.db2.gz TWSPHLVCDLWXRM-GPMSIDNRSA-N 1 3 292.511 4.198 20 0 CIADHO CC[C@@H](NCc1ccc(C[NH3+])cc1)c1ccc(Cl)cc1 ZINC000566915205 334669176 /nfs/dbraw/zinc/66/91/76/334669176.db2.gz FRNJCECYXKMRFN-QGZVFWFLSA-N 1 3 288.822 4.040 20 0 CIADHO C[C@@H]1CCCC[C@H]1CC[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000513208093 333008632 /nfs/dbraw/zinc/00/86/32/333008632.db2.gz MNVRPEOEOLEWRG-CVEARBPZSA-N 1 3 280.500 4.055 20 0 CIADHO CC1(C)CCCC[C@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000513341105 333014817 /nfs/dbraw/zinc/01/48/17/333014817.db2.gz QKXGGYVJUBRRNA-GOSISDBHSA-N 1 3 292.511 4.342 20 0 CIADHO Cc1c[nH+]ccc1NC1CCN([C@H](C)c2ccccc2)CC1 ZINC000192600670 333236890 /nfs/dbraw/zinc/23/68/90/333236890.db2.gz WOHKYSMOIUORJB-MRXNPFEDSA-N 1 3 295.430 4.028 20 0 CIADHO C[C@@H](N[C@H](CC[NH+](C)C)C(C)(C)C)c1cccc(Cl)c1 ZINC000522546431 333289478 /nfs/dbraw/zinc/28/94/78/333289478.db2.gz MCYYDWVQDVKBCG-CZUORRHYSA-N 1 3 296.886 4.357 20 0 CIADHO CCCC[NH+]1CCC(NCc2cccc3ccccc32)CC1 ZINC000236766676 333375421 /nfs/dbraw/zinc/37/54/21/333375421.db2.gz RSNQNAHRKZFVMO-UHFFFAOYSA-N 1 3 296.458 4.194 20 0 CIADHO C[C@H]([NH2+][C@@H]1C=CCCCCC1)[C@H]1CCCN(C2CCC2)C1 ZINC000549932028 334209499 /nfs/dbraw/zinc/20/94/99/334209499.db2.gz OSRWHVRJOHFDRL-OKZBNKHCSA-N 1 3 290.495 4.118 20 0 CIADHO C[C@H](N[C@@H]1C=CCCCCC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000549932028 334209500 /nfs/dbraw/zinc/20/95/00/334209500.db2.gz OSRWHVRJOHFDRL-OKZBNKHCSA-N 1 3 290.495 4.118 20 0 CIADHO C[C@H](N[C@@H]1C=CCCCCC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000549932028 334209502 /nfs/dbraw/zinc/20/95/02/334209502.db2.gz OSRWHVRJOHFDRL-OKZBNKHCSA-N 1 3 290.495 4.118 20 0 CIADHO c1cc(C2CCC2)ccc1C[NH2+]C1CC(N2CCCCC2)C1 ZINC000550215507 334216103 /nfs/dbraw/zinc/21/61/03/334216103.db2.gz DDBSMRZRZVJOGJ-UHFFFAOYSA-N 1 3 298.474 4.061 20 0 CIADHO CC(C)(CC[NH2+]C1CCN(C2CCCCC2)CC1)C1CC1 ZINC000551296313 334245414 /nfs/dbraw/zinc/24/54/14/334245414.db2.gz JGMKZWRQBJTEBP-UHFFFAOYSA-N 1 3 292.511 4.199 20 0 CIADHO CC(C)C(C[NH2+][C@H](C)[C@H]1CCCN(C2CCC2)C1)C(C)C ZINC000551804552 334262328 /nfs/dbraw/zinc/26/23/28/334262328.db2.gz ACOLOHZAZQFNGW-SJORKVTESA-N 1 3 294.527 4.157 20 0 CIADHO C[C@@H]([NH2+][C@@H](C)c1cccs1)[C@H]1CCCN(C2CCC2)C1 ZINC000248408248 334300574 /nfs/dbraw/zinc/30/05/74/334300574.db2.gz VHEYGJHGGATSIR-ILXRZTDVSA-N 1 3 292.492 4.052 20 0 CIADHO CC(C)(C)C1CCC(C[NH2+][C@H]2CCN3CCC[C@H]3C2)CC1 ZINC000252729897 334387695 /nfs/dbraw/zinc/38/76/95/334387695.db2.gz IUDHIJFGSJNLFH-FOIPXRHGSA-N 1 3 292.511 4.055 20 0 CIADHO C[C@@H](c1cccc2ccccc21)[N@@H+]1CCC[C@@H](N(C)C)CC1 ZINC000576416288 335201430 /nfs/dbraw/zinc/20/14/30/335201430.db2.gz YYRGKVGTUGGNLL-FUHWJXTLSA-N 1 3 296.458 4.317 20 0 CIADHO C[C@@H](c1cccc2ccccc21)[N@H+]1CCC[C@@H](N(C)C)CC1 ZINC000576416288 335201432 /nfs/dbraw/zinc/20/14/32/335201432.db2.gz YYRGKVGTUGGNLL-FUHWJXTLSA-N 1 3 296.458 4.317 20 0 CIADHO C[C@@H](c1cccc2ccccc21)N1CCC[C@@H]([NH+](C)C)CC1 ZINC000576416288 335201433 /nfs/dbraw/zinc/20/14/33/335201433.db2.gz YYRGKVGTUGGNLL-FUHWJXTLSA-N 1 3 296.458 4.317 20 0 CIADHO CCCCN1CCC([NH2+][C@H](CC)c2ccsc2)CC1 ZINC000382195458 336084496 /nfs/dbraw/zinc/08/44/96/336084496.db2.gz ZSVAWIVCLDMMQT-MRXNPFEDSA-N 1 3 280.481 4.053 20 0 CIADHO CC(C)N1CC[C@H](C[NH2+][C@H](C)CCC2CCCCC2)C1 ZINC000581634741 336115275 /nfs/dbraw/zinc/11/52/75/336115275.db2.gz CIRFTSJVWZTLAD-SJLPKXTDSA-N 1 3 280.500 4.055 20 0 CIADHO CC[C@H](NCc1cccc(C[NH+](C)C)c1)c1ccsc1 ZINC000296211420 522654299 /nfs/dbraw/zinc/65/42/99/522654299.db2.gz ZLLZZJKAWBNKPP-KRWDZBQOSA-N 1 3 288.460 4.051 20 0 CIADHO CC[C@@H](NCc1ccc(C[NH+](C)C)cc1)c1cccc(C)c1 ZINC000353438008 529183083 /nfs/dbraw/zinc/18/30/83/529183083.db2.gz ULYSLWYACSPXOQ-HXUWFJFHSA-N 1 3 296.458 4.298 20 0 CIADHO CC[C@H](NCc1ccc(C[NH+](C)C)cc1)c1cccc(C)c1 ZINC000353438007 529626758 /nfs/dbraw/zinc/62/67/58/529626758.db2.gz ULYSLWYACSPXOQ-FQEVSTJZSA-N 1 3 296.458 4.298 20 0 CIADHO CC[C@H](NCc1cccc(C[NH+](C)C)c1)c1cccc(C)c1 ZINC000353442910 529630760 /nfs/dbraw/zinc/63/07/60/529630760.db2.gz DLACVFPGVVHHES-FQEVSTJZSA-N 1 3 296.458 4.298 20 0 CIADHO CC(C)[C@H]([NH2+]Cc1ccc(CN(C)C)cc1)c1ccccc1 ZINC000171127735 335055982 /nfs/dbraw/zinc/05/59/82/335055982.db2.gz FIPQPRVTGVEXHA-FQEVSTJZSA-N 1 3 296.458 4.235 20 0 CIADHO CC[C@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1ccc(F)cc1 ZINC000037786223 260118100 /nfs/dbraw/zinc/11/81/00/260118100.db2.gz RFOJFGWNYGZYSW-KRWDZBQOSA-N 1 3 292.442 4.129 20 0 CIADHO CC[NH+](CC)CCC[C@H](C)NCc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000019914841 262205999 /nfs/dbraw/zinc/20/59/99/262205999.db2.gz HODICMDWIYIYOL-YQQAZPJKSA-N 1 3 292.467 4.003 20 0 CIADHO Cc1oc2ccccc2c1CNCc1ccc([C@H](C)[NH3+])cc1 ZINC000414815437 263053829 /nfs/dbraw/zinc/05/38/29/263053829.db2.gz XOSQVQMDJYYSNE-ZDUSSCGKSA-N 1 3 294.398 4.051 20 0 CIADHO CC(C)[C@@H]1C[C@@H](NCc2ccc(C[NH3+])cc2)c2ccccc21 ZINC000571284522 328097592 /nfs/dbraw/zinc/09/75/92/328097592.db2.gz ALYSORLYSZZPLL-VQTJNVASSA-N 1 3 294.442 4.120 20 0 CIADHO C[C@H](CCCC[NH3+])N[C@@H](C)c1ccc(Cl)cc1Cl ZINC000381242394 327171530 /nfs/dbraw/zinc/17/15/30/327171530.db2.gz KOTUAPIASKRVKZ-MNOVXSKESA-N 1 3 289.250 4.162 20 0 CIADHO CC[C@H](NCc1ccc(C[NH3+])cc1)c1cccc(Cl)c1 ZINC000564989337 327341041 /nfs/dbraw/zinc/34/10/41/327341041.db2.gz XPKMVPXDYZYZGC-KRWDZBQOSA-N 1 3 288.822 4.040 20 0 CIADHO C[C@@H]1CCC[C@H](C[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000583400885 327344597 /nfs/dbraw/zinc/34/45/97/327344597.db2.gz RLJAZWVERGSXED-SJORKVTESA-N 1 3 292.511 4.199 20 0 CIADHO CCC(C)(C)CC[NH2+][C@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000583408398 327349478 /nfs/dbraw/zinc/34/94/78/327349478.db2.gz WARZNRGFNKJLLM-CVEARBPZSA-N 1 3 280.500 4.055 20 0 CIADHO C[C@@H]1CCC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)[C@H]1C ZINC000563993433 328848222 /nfs/dbraw/zinc/84/82/22/328848222.db2.gz MWPGAOPIVBIKJT-GJYPPUQNSA-N 1 3 292.511 4.198 20 0 CIADHO CC[C@H](NCc1ccc(C[NH3+])cc1)c1ccc(Cl)s1 ZINC000582360858 328971042 /nfs/dbraw/zinc/97/10/42/328971042.db2.gz UZPPPUUBZXOUHT-ZDUSSCGKSA-N 1 3 294.851 4.101 20 0 CIADHO C[C@H](NCc1ccc(C[NH3+])cc1)c1ccc(C(C)(C)C)cc1 ZINC000582786769 329198378 /nfs/dbraw/zinc/19/83/78/329198378.db2.gz DIFKITFTVZYBRZ-HNNXBMFYSA-N 1 3 296.458 4.294 20 0 CIADHO C[C@H](CCCC[NH3+])N[C@H](C)c1cccc(Cl)c1Cl ZINC000422754006 330153551 /nfs/dbraw/zinc/15/35/51/330153551.db2.gz FRCIGCVXRRRYEL-GHMZBOCLSA-N 1 3 289.250 4.162 20 0 CIADHO CC[C@H](C)[C@H](N[C@H](C)[C@@H]1CC[NH2+]C1)c1ccc(Cl)cc1 ZINC000422789483 330157339 /nfs/dbraw/zinc/15/73/39/330157339.db2.gz WWWFCKKZUQDVRN-SHFYGJNESA-N 1 3 294.870 4.015 20 0 CIADHO C[C@@H](CCCC[NH3+])N[C@@H](C)c1cc(Cl)ccc1Cl ZINC000422789941 330157462 /nfs/dbraw/zinc/15/74/62/330157462.db2.gz XFGBMDIYPPMPOG-QWRGUYRKSA-N 1 3 289.250 4.162 20 0 CIADHO C[C@H](N)C[C@H](C)[NH2+][C@@H]1CCC[C@@H](c2cccc(Cl)c2)C1 ZINC000423165409 330173886 /nfs/dbraw/zinc/17/38/86/330173886.db2.gz PYGWPTXVTVZPPT-YOKBYHGQSA-N 1 3 294.870 4.082 20 0 CIADHO C[C@H](N)C[C@H](C)[NH2+][C@H]1CCC[C@H](c2cccc(Cl)c2)C1 ZINC000423165407 330174039 /nfs/dbraw/zinc/17/40/39/330174039.db2.gz PYGWPTXVTVZPPT-HPZZRFSDSA-N 1 3 294.870 4.082 20 0 CIADHO CC[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1cccs1 ZINC000423289831 330186629 /nfs/dbraw/zinc/18/66/29/330186629.db2.gz BQXLVBVATZLDRF-IUODEOHRSA-N 1 3 274.433 4.009 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CCCc3cc(F)ccc32)cc1 ZINC000423290482 330186706 /nfs/dbraw/zinc/18/67/06/330186706.db2.gz DDNZULDMTBKVSF-ORAYPTAESA-N 1 3 298.405 4.013 20 0 CIADHO CC[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccc(C)c1 ZINC000423290544 330186783 /nfs/dbraw/zinc/18/67/83/330186783.db2.gz DKYKCQUFHXSKTN-HNAYVOBHSA-N 1 3 282.431 4.256 20 0 CIADHO CC[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1cccc(C)c1 ZINC000423290543 330186786 /nfs/dbraw/zinc/18/67/86/330186786.db2.gz DKYKCQUFHXSKTN-DNVCBOLYSA-N 1 3 282.431 4.256 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CC[C@H](C)c3ccccc32)cc1 ZINC000423290282 330186837 /nfs/dbraw/zinc/18/68/37/330186837.db2.gz CQGVAPPZUCMJJD-AVYPCKFXSA-N 1 3 294.442 4.435 20 0 CIADHO Cc1ccc([C@H](NCc2ccc([C@@H](C)[NH3+])cc2)C2CCC2)o1 ZINC000423291239 330186972 /nfs/dbraw/zinc/18/69/72/330186972.db2.gz HMRCYWFHTUOAJO-AUUYWEPGSA-N 1 3 298.430 4.239 20 0 CIADHO CC[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccc(F)cc1 ZINC000423291416 330187047 /nfs/dbraw/zinc/18/70/47/330187047.db2.gz IFQRWTMZBMIDGQ-SCLBCKFNSA-N 1 3 286.394 4.086 20 0 CIADHO CCC([NH3+])(CC)CN[C@@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000423292446 330187471 /nfs/dbraw/zinc/18/74/71/330187471.db2.gz NBRTVJHTVMZGOD-GOEBONIOSA-N 1 3 294.870 4.083 20 0 CIADHO CC(C)[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccccc1 ZINC000423292104 330187524 /nfs/dbraw/zinc/18/75/24/330187524.db2.gz LJHZFWQXPNIWPZ-BEFAXECRSA-N 1 3 282.431 4.193 20 0 CIADHO Cc1cc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c(C)s1 ZINC000423292354 330187527 /nfs/dbraw/zinc/18/75/27/330187527.db2.gz MSMRSLAINXSNDT-CHWSQXEVSA-N 1 3 288.460 4.235 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CCSc3ccccc32)cc1 ZINC000423292563 330187576 /nfs/dbraw/zinc/18/75/76/330187576.db2.gz NIHWZYRRIONHMR-SUMWQHHRSA-N 1 3 298.455 4.033 20 0 CIADHO CCC([NH3+])(CC)CN[C@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000423296439 330188460 /nfs/dbraw/zinc/18/84/60/330188460.db2.gz ZFSXVXRRFYCOEF-ZBFHGGJFSA-N 1 3 294.870 4.083 20 0 CIADHO C[C@@H]1C[C@@H]([NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)CCN1 ZINC000423403590 330196191 /nfs/dbraw/zinc/19/61/91/330196191.db2.gz YPOXTXRJEHLTNW-COXVUDFISA-N 1 3 292.442 4.033 20 0 CIADHO C[C@H](N)[C@H](C)[NH2+][C@@H](C)c1ccc(SC2CCCC2)cc1 ZINC000423442233 330201844 /nfs/dbraw/zinc/20/18/44/330201844.db2.gz JSBVVOBVMXPUJC-IHRRRGAJSA-N 1 3 292.492 4.108 20 0 CIADHO C[C@@H](N)[C@@H](C)[NH2+][C@@H](C)c1ccc(SC2CCCC2)cc1 ZINC000423442237 330201915 /nfs/dbraw/zinc/20/19/15/330201915.db2.gz JSBVVOBVMXPUJC-MCIONIFRSA-N 1 3 292.492 4.108 20 0 CIADHO CC[C@H](NCCC[C@H]1CCC[NH2+]1)c1cccc(Cl)c1F ZINC000423476354 330205686 /nfs/dbraw/zinc/20/56/86/330205686.db2.gz IZYGCRGMRLWFHC-DOMZBBRYSA-N 1 3 298.833 4.052 20 0 CIADHO Cc1cccc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)c1C ZINC000423502530 330208466 /nfs/dbraw/zinc/20/84/66/330208466.db2.gz MAUHMAZFUMAUBY-FXAWDEMLSA-N 1 3 296.458 4.434 20 0 CIADHO CC[C@@H](N[C@@H](CCC[NH3+])c1ccccc1)c1ccsc1 ZINC000423501461 330208627 /nfs/dbraw/zinc/20/86/27/330208627.db2.gz CUHDJEJEOKSQGN-SJORKVTESA-N 1 3 288.460 4.269 20 0 CIADHO Cc1cc(C)cc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000423510872 330209211 /nfs/dbraw/zinc/20/92/11/330209211.db2.gz SOOWQQAPWGMFIX-YLJYHZDGSA-N 1 3 296.458 4.434 20 0 CIADHO C[C@@H]([NH2+]C1CCN(CC2CCCC2)CC1)C1CCCCC1 ZINC000527232596 330239251 /nfs/dbraw/zinc/23/92/51/330239251.db2.gz KNCAGDORADFVGR-MRXNPFEDSA-N 1 3 292.511 4.199 20 0 CIADHO CC[C@H](C)c1ccc([C@H](C)[NH2+]CC2=CCN(C)CC2)cc1 ZINC000527876476 330291330 /nfs/dbraw/zinc/29/13/30/330291330.db2.gz OTBIHGFERHBCAE-HOTGVXAUSA-N 1 3 286.463 4.113 20 0 CIADHO C[C@H]([NH2+]CCCN1CCCCC1)c1ccc(Cl)c(F)c1 ZINC000212767374 330367286 /nfs/dbraw/zinc/36/72/86/330367286.db2.gz KDVUHAJRFSLAAP-ZDUSSCGKSA-N 1 3 298.833 4.006 20 0 CIADHO CC(C)[C@@H]([NH2+]C[C@@H]1CCCN(C(C)C)C1)c1ccccc1 ZINC000536998895 330375293 /nfs/dbraw/zinc/37/52/93/330375293.db2.gz PGMMGDAUSKUUCW-PKOBYXMFSA-N 1 3 288.479 4.094 20 0 CIADHO CC(C)[C@@H](NC[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccccc1 ZINC000536998895 330375294 /nfs/dbraw/zinc/37/52/94/330375294.db2.gz PGMMGDAUSKUUCW-PKOBYXMFSA-N 1 3 288.479 4.094 20 0 CIADHO CC(C)[C@@H](NC[C@@H]1CCC[N@H+](C(C)C)C1)c1ccccc1 ZINC000536998895 330375295 /nfs/dbraw/zinc/37/52/95/330375295.db2.gz PGMMGDAUSKUUCW-PKOBYXMFSA-N 1 3 288.479 4.094 20 0 CIADHO CC(C)(C)CC(C)(C)[NH+]1CCC(NC2CC(C)(F)C2)CC1 ZINC000449374359 330920195 /nfs/dbraw/zinc/92/01/95/330920195.db2.gz ACSUAMLQWCSCKA-UHFFFAOYSA-N 1 3 298.490 4.146 20 0 CIADHO CC(C)[NH+]1CCC(N[C@@H]2CC[C@@H](C)c3ccsc32)CC1 ZINC000453143496 331093750 /nfs/dbraw/zinc/09/37/50/331093750.db2.gz FSUTWOPZPIXGNP-CZUORRHYSA-N 1 3 292.492 4.149 20 0 CIADHO CC(C)[C@H]1C[C@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc21 ZINC000453375637 331124798 /nfs/dbraw/zinc/12/47/98/331124798.db2.gz XYVTXAJVYATIPA-KBOHQZAKSA-N 1 3 298.474 4.086 20 0 CIADHO CC(C)[C@H]1C[C@H](NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c2ccccc21 ZINC000453375637 331124799 /nfs/dbraw/zinc/12/47/99/331124799.db2.gz XYVTXAJVYATIPA-KBOHQZAKSA-N 1 3 298.474 4.086 20 0 CIADHO CC(C)N1CCC[C@H](C[NH2+]C2CCC(C(C)(C)C)CC2)C1 ZINC000462750139 331327437 /nfs/dbraw/zinc/32/74/37/331327437.db2.gz WVEIMLQZDYSNKA-WWDZGPRUSA-N 1 3 294.527 4.301 20 0 CIADHO C[C@@H](CCC1CC1)[NH2+]C1CCN([C@H]2CCC[C@@H](C)C2)CC1 ZINC000469810007 331461836 /nfs/dbraw/zinc/46/18/36/331461836.db2.gz VKTLVSBBJZTWDM-GJYPPUQNSA-N 1 3 292.511 4.198 20 0 CIADHO C[C@H](CCC1CC1)[NH2+]C1CCN([C@H]2CCCC[C@H]2C)CC1 ZINC000469810399 331461874 /nfs/dbraw/zinc/46/18/74/331461874.db2.gz WWIOVRMUPGYZEV-MDZRGWNJSA-N 1 3 292.511 4.198 20 0 CIADHO CC(C)N(CCC[NH2+][C@H]1CCC[C@@H]1CCCF)C(C)C ZINC000510701632 332912569 /nfs/dbraw/zinc/91/25/69/332912569.db2.gz LAAFSDZMJBPSLV-SJORKVTESA-N 1 3 286.479 4.003 20 0 CIADHO C[C@H](NCCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccsc1 ZINC000480646633 331781410 /nfs/dbraw/zinc/78/14/10/331781410.db2.gz ZEXAFMSIDOJVKV-OAGGEKHMSA-N 1 3 294.508 4.157 20 0 CIADHO CC[C@H](NCc1ccc(C[NH3+])cc1)c1ccc(Cl)cc1 ZINC000566915204 334669161 /nfs/dbraw/zinc/66/91/61/334669161.db2.gz FRNJCECYXKMRFN-KRWDZBQOSA-N 1 3 288.822 4.040 20 0 CIADHO C1CC2(CCCC2)[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000189143274 333182291 /nfs/dbraw/zinc/18/22/91/333182291.db2.gz DDBLTRSKLRXZJS-GOSISDBHSA-N 1 3 290.495 4.096 20 0 CIADHO CCC[C@H](N[C@@H]1CC[N@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000224109949 333216821 /nfs/dbraw/zinc/21/68/21/333216821.db2.gz NHWOKXOWSXSTJU-XKQJLSEDSA-N 1 3 294.870 4.254 20 0 CIADHO CCC[C@H](N[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000224109949 333216823 /nfs/dbraw/zinc/21/68/23/333216823.db2.gz NHWOKXOWSXSTJU-XKQJLSEDSA-N 1 3 294.870 4.254 20 0 CIADHO CCCCN1CCC([NH2+]Cc2ccc(C)c(Cl)c2)CC1 ZINC000232968271 333346366 /nfs/dbraw/zinc/34/63/66/333346366.db2.gz YTKRSNGXQYCOAR-UHFFFAOYSA-N 1 3 294.870 4.003 20 0 CIADHO C[C@H](N[C@H](CC[NH+](C)C)C(C)(C)C)c1ccc(Cl)cc1 ZINC000523853876 333348164 /nfs/dbraw/zinc/34/81/64/333348164.db2.gz YIVRHEMBZFCURH-XJKSGUPXSA-N 1 3 296.886 4.357 20 0 CIADHO C[C@@H]1C[C@H]([NH2+]Cc2ccc(CN(C)C)cc2)CC(C)(C)C1 ZINC000524679846 333371099 /nfs/dbraw/zinc/37/10/99/333371099.db2.gz IOKLPPZVCKNISZ-QAPCUYQASA-N 1 3 288.479 4.053 20 0 CIADHO CN1CCCC[C@@H]1CC[N@H+](C)Cc1ccc2ccccc2c1 ZINC000524755514 333386558 /nfs/dbraw/zinc/38/65/58/333386558.db2.gz DILYHGZDZUAZGH-HXUWFJFHSA-N 1 3 296.458 4.146 20 0 CIADHO CN1CCCC[C@@H]1CC[N@@H+](C)Cc1ccc2ccccc2c1 ZINC000524755514 333386560 /nfs/dbraw/zinc/38/65/60/333386560.db2.gz DILYHGZDZUAZGH-HXUWFJFHSA-N 1 3 296.458 4.146 20 0 CIADHO CC(C)Cc1cccc([C@H](C)N[C@H]2CC[N@H+](C)[C@H](C)C2)c1 ZINC000552245094 334307692 /nfs/dbraw/zinc/30/76/92/334307692.db2.gz QSTXOTYWNCXCPJ-GJYPPUQNSA-N 1 3 288.479 4.018 20 0 CIADHO CC(C)Cc1cccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000552245094 334307693 /nfs/dbraw/zinc/30/76/93/334307693.db2.gz QSTXOTYWNCXCPJ-GJYPPUQNSA-N 1 3 288.479 4.018 20 0 CIADHO CCC(C)(C)C1CCC([NH2+][C@@H]2CCN3CCC[C@H]3C2)CC1 ZINC000252674875 334385140 /nfs/dbraw/zinc/38/51/40/334385140.db2.gz VAMGYFCPEQSFED-HIEASXQVSA-N 1 3 292.511 4.198 20 0 CIADHO CC(C)CC[C@H]([NH2+]C1CCN(C2CCCC2)CC1)C1CC1 ZINC000555225475 334471767 /nfs/dbraw/zinc/47/17/67/334471767.db2.gz CAFUYXULFYSEMS-IBGZPJMESA-N 1 3 292.511 4.198 20 0 CIADHO CC[C@H]1CC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000556201272 334499296 /nfs/dbraw/zinc/49/92/96/334499296.db2.gz DMIKWLVVPBZRBD-QAQDUYKDSA-N 1 3 292.511 4.342 20 0 CIADHO CC(C)N1CC[C@@H](C[NH2+]C2CCC3(CCCCC3)CC2)C1 ZINC000577661946 335387025 /nfs/dbraw/zinc/38/70/25/335387025.db2.gz FDXJIBQRGDDOEK-KRWDZBQOSA-N 1 3 292.511 4.199 20 0 CIADHO CC[C@@H]([NH2+]CCCN1CCCC[C@H]1C)c1ccsc1 ZINC000382129476 336082331 /nfs/dbraw/zinc/08/23/31/336082331.db2.gz OJFOXQUNPGGOQS-GDBMZVCRSA-N 1 3 280.481 4.053 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CNCc2ccc(C(C)(C)C)cc2)cc1 ZINC000414815305 263053842 /nfs/dbraw/zinc/05/38/42/263053842.db2.gz XCWBKNBMMNWELR-OAHLLOKOSA-N 1 3 296.458 4.294 20 0 CIADHO [NH3+]CCC[C@H](NCc1coc2ccccc12)c1ccccc1 ZINC000415055842 263258829 /nfs/dbraw/zinc/25/88/29/263258829.db2.gz OZHOXPVHWXUEFU-SFHVURJKSA-N 1 3 294.398 4.003 20 0 CIADHO CCC[C@@H]([NH2+]C[C@H]1CCCN(C(C)C)C1)c1ccsc1 ZINC000187701476 263266702 /nfs/dbraw/zinc/26/67/02/263266702.db2.gz JPFUMZGKONDXOP-NVXWUHKLSA-N 1 3 294.508 4.299 20 0 CIADHO CC[C@@H](NCc1ccc(C[NH+](C)C)cc1)c1ccc(C)cc1 ZINC000171126768 327643697 /nfs/dbraw/zinc/64/36/97/327643697.db2.gz HLUZNQSWFMKVFE-HXUWFJFHSA-N 1 3 296.458 4.298 20 0 CIADHO C(CC1CCCCCC1)[NH2+]C1CCN(C2CCCC2)CC1 ZINC000557521930 327011356 /nfs/dbraw/zinc/01/13/56/327011356.db2.gz FYRQKWRLLJXSNV-UHFFFAOYSA-N 1 3 292.511 4.344 20 0 CIADHO CC(C)N1CCC[C@H](C[NH2+][C@@H]2CCCCC23CCCC3)C1 ZINC000559751804 327259409 /nfs/dbraw/zinc/25/94/09/327259409.db2.gz BUUOVJIWUHTCLX-QZTJIDSGSA-N 1 3 292.511 4.199 20 0 CIADHO CCC(C)(C)CC[NH2+][C@@H](C)[C@@H]1CCCN(C2CCC2)C1 ZINC000583408401 327349444 /nfs/dbraw/zinc/34/94/44/327349444.db2.gz WARZNRGFNKJLLM-JKSUJKDBSA-N 1 3 280.500 4.055 20 0 CIADHO [NH3+][C@@H]1C[C@H](N[C@H]2CCC[C@H]2c2ccccc2)c2ccccc21 ZINC000422702890 330151149 /nfs/dbraw/zinc/15/11/49/330151149.db2.gz GJCGVCGOODGFGC-LDTOTXGLSA-N 1 3 292.426 4.057 20 0 CIADHO CCCC[C@H](CCC)C[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000422865200 330158192 /nfs/dbraw/zinc/15/81/92/330158192.db2.gz OKQRMKRCCAECDI-ZBFHGGJFSA-N 1 3 291.483 4.106 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@H]2CCCCc3ccccc32)cc1 ZINC000423289668 330186342 /nfs/dbraw/zinc/18/63/42/330186342.db2.gz BMGNXBHELVWKLM-QRWLVFNGSA-N 1 3 294.442 4.264 20 0 CIADHO CCc1ccc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423290046 330186698 /nfs/dbraw/zinc/18/66/98/330186698.db2.gz CCNBDWJCTTXUMH-GJZGRUSLSA-N 1 3 282.431 4.120 20 0 CIADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1cccc(C2CC2)c1 ZINC000423291070 330187062 /nfs/dbraw/zinc/18/70/62/330187062.db2.gz GOIIKZZBROPYTL-LSDHHAIUSA-N 1 3 294.442 4.435 20 0 CIADHO Cc1ccc([C@H](NCc2ccc([C@H](C)[NH3+])cc2)C2CC2)cc1 ZINC000423291476 330187103 /nfs/dbraw/zinc/18/71/03/330187103.db2.gz ILCMXYCUDUQYJF-YWZLYKJASA-N 1 3 294.442 4.256 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2C[C@H](C)c3ccccc32)cc1 ZINC000423291965 330187391 /nfs/dbraw/zinc/18/73/91/330187391.db2.gz KUENKSBVUJCYOC-CKFHNAJUSA-N 1 3 280.415 4.044 20 0 CIADHO Cc1ccc2c(c1)[C@H](NCc1ccc([C@H](C)[NH3+])cc1)[C@H](C)C2 ZINC000423292303 330187438 /nfs/dbraw/zinc/18/74/38/330187438.db2.gz MLIUNOYPJVAKQJ-QEEYODRMSA-N 1 3 294.442 4.038 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@H](C)c2cc3ccccc3o2)cc1 ZINC000423294768 330188080 /nfs/dbraw/zinc/18/80/80/330188080.db2.gz VGHHKEAENIMXSR-ZIAGYGMSSA-N 1 3 294.398 4.303 20 0 CIADHO C[C@H]([NH2+][C@@H]1CCNC[C@@H]1C)c1cccc(-c2ccccc2)c1 ZINC000423363237 330194083 /nfs/dbraw/zinc/19/40/83/330194083.db2.gz BPRXFOKNWKQSCQ-TWOQFEAHSA-N 1 3 294.442 4.002 20 0 CIADHO Cc1cc(C)c([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)cc1C ZINC000423366140 330194646 /nfs/dbraw/zinc/19/46/46/330194646.db2.gz XHDIKQDWISUCJX-MRXNPFEDSA-N 1 3 294.442 4.066 20 0 CIADHO Cc1ccc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423498181 330208270 /nfs/dbraw/zinc/20/82/70/330208270.db2.gz HRYNUDRNXHRYRE-APWZRJJASA-N 1 3 282.431 4.126 20 0 CIADHO CCc1ccc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423507142 330208779 /nfs/dbraw/zinc/20/87/79/330208779.db2.gz PRDHDKPMSAITGK-OXJNMPFZSA-N 1 3 296.458 4.380 20 0 CIADHO Cc1ccc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)s1 ZINC000423514834 330209358 /nfs/dbraw/zinc/20/93/58/330209358.db2.gz WTXMMDYVPZFRFS-ZBFHGGJFSA-N 1 3 288.460 4.187 20 0 CIADHO Cc1cc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)oc1C ZINC000423519776 330209840 /nfs/dbraw/zinc/20/98/40/330209840.db2.gz QMOULYXDNABKKM-YOEHRIQHSA-N 1 3 286.419 4.027 20 0 CIADHO CC[NH+](CC)Cc1ccc(CN[C@@H](C)c2ccccc2)cc1 ZINC000120503541 330388989 /nfs/dbraw/zinc/38/89/89/330388989.db2.gz KZMANIKFCASLAE-KRWDZBQOSA-N 1 3 296.458 4.379 20 0 CIADHO CC[NH+](CC)Cc1ccc(CN[C@H](C)c2ccccc2)cc1 ZINC000120503662 330389018 /nfs/dbraw/zinc/38/90/18/330389018.db2.gz KZMANIKFCASLAE-QGZVFWFLSA-N 1 3 296.458 4.379 20 0 CIADHO C[C@H]1CC(C)(C)C[C@@H]1[NH2+]C1CCN(CC2CCCC2)CC1 ZINC000434779983 330645082 /nfs/dbraw/zinc/64/50/82/330645082.db2.gz WRFZOQJKAHTDOW-YJBOKZPZSA-N 1 3 292.511 4.055 20 0 CIADHO CC[C@H](NCc1ccc(C[NH+](C)C)cc1)c1ccsc1 ZINC000453098563 331088955 /nfs/dbraw/zinc/08/89/55/331088955.db2.gz VCNUZJSPZLBWBP-KRWDZBQOSA-N 1 3 288.460 4.051 20 0 CIADHO CC(C)C[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccs1 ZINC000453335920 331118454 /nfs/dbraw/zinc/11/84/54/331118454.db2.gz FCUUNTMOELBDQI-WTXIUTQJSA-N 1 3 292.492 4.050 20 0 CIADHO CC(C)C[C@@H](NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C)c1cccs1 ZINC000453335920 331118455 /nfs/dbraw/zinc/11/84/55/331118455.db2.gz FCUUNTMOELBDQI-WTXIUTQJSA-N 1 3 292.492 4.050 20 0 CIADHO C[C@H]([NH2+]C1CC(C(C)(C)C)C1)[C@@H]1CCCN(C2CCC2)C1 ZINC000459468471 331283100 /nfs/dbraw/zinc/28/31/00/331283100.db2.gz QTAVZFCWFZLAPX-NJINODPHSA-N 1 3 292.511 4.054 20 0 CIADHO C[C@H]([NH2+]C1CC(C(C)(C)C)C1)[C@H]1CCCN(C2CCC2)C1 ZINC000459468470 331283163 /nfs/dbraw/zinc/28/31/63/331283163.db2.gz QTAVZFCWFZLAPX-JUVOFCAFSA-N 1 3 292.511 4.054 20 0 CIADHO CC[NH+]1CCC(CCN[C@H](C)c2ccccc2Cl)CC1 ZINC000483748402 331883923 /nfs/dbraw/zinc/88/39/23/331883923.db2.gz QZIIJIPBEFGDOR-CQSZACIVSA-N 1 3 294.870 4.113 20 0 CIADHO CCC[C@H](C)[C@@H](CC)[NH2+]C1CCN(C2CCCC2)CC1 ZINC000484488972 331899870 /nfs/dbraw/zinc/89/98/70/331899870.db2.gz VVGVQSNVKNIUKN-MAUKXSAKSA-N 1 3 280.500 4.198 20 0 CIADHO CC1(C)CCC[C@H]([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000487788080 331981436 /nfs/dbraw/zinc/98/14/36/331981436.db2.gz VPAHMAJRPOLGKN-KRWDZBQOSA-N 1 3 292.511 4.342 20 0 CIADHO CC(C)[N@H+](C)Cc1cccc(CN[C@H](C)c2ccccc2)c1 ZINC000173358336 335132434 /nfs/dbraw/zinc/13/24/34/335132434.db2.gz AUBHJPHQEZPPDP-QGZVFWFLSA-N 1 3 296.458 4.378 20 0 CIADHO CC(C)[N@@H+](C)Cc1cccc(CN[C@H](C)c2ccccc2)c1 ZINC000173358336 335132436 /nfs/dbraw/zinc/13/24/36/335132436.db2.gz AUBHJPHQEZPPDP-QGZVFWFLSA-N 1 3 296.458 4.378 20 0 CIADHO CC1(C)CCC([NH2+]C2CCN(C3CCCCC3)CC2)CC1 ZINC000236741802 333375263 /nfs/dbraw/zinc/37/52/63/333375263.db2.gz RKAQTLFLNCWNEZ-UHFFFAOYSA-N 1 3 292.511 4.342 20 0 CIADHO CC(C)(C)C1CCC(C[NH2+][C@H]2CCN3CCC[C@@H]3C2)CC1 ZINC000135691676 334136449 /nfs/dbraw/zinc/13/64/49/334136449.db2.gz IUDHIJFGSJNLFH-ZGUYJTEBSA-N 1 3 292.511 4.055 20 0 CIADHO C[C@H]([NH2+][C@H]1C=CCCCCC1)[C@H]1CCCN(C2CCC2)C1 ZINC000549932026 334209693 /nfs/dbraw/zinc/20/96/93/334209693.db2.gz OSRWHVRJOHFDRL-BZSNNMDCSA-N 1 3 290.495 4.118 20 0 CIADHO C[C@H](N[C@H]1C=CCCCCC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000549932026 334209694 /nfs/dbraw/zinc/20/96/94/334209694.db2.gz OSRWHVRJOHFDRL-BZSNNMDCSA-N 1 3 290.495 4.118 20 0 CIADHO C[C@H](N[C@H]1C=CCCCCC1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000549932026 334209695 /nfs/dbraw/zinc/20/96/95/334209695.db2.gz OSRWHVRJOHFDRL-BZSNNMDCSA-N 1 3 290.495 4.118 20 0 CIADHO C1CCC(N2CCC([NH2+][C@@H]3CCCC34CCCC4)CC2)C1 ZINC000550678775 334226587 /nfs/dbraw/zinc/22/65/87/334226587.db2.gz SXLIKVJMFGXSPG-GOSISDBHSA-N 1 3 290.495 4.096 20 0 CIADHO C[C@@H](NC1CCC([NH+](C)C)CC1)c1ccc(F)cc1Cl ZINC000552249654 334308521 /nfs/dbraw/zinc/30/85/21/334308521.db2.gz GYYXCVHBSZLBCT-LMWSTFAQSA-N 1 3 298.833 4.003 20 0 CIADHO CC[C@H]([NH2+]C[C@@H]1CCCN(CC(C)C)C1)c1cccs1 ZINC000090585209 334364050 /nfs/dbraw/zinc/36/40/50/334364050.db2.gz CSEDRMSEVWGWDZ-HOTGVXAUSA-N 1 3 294.508 4.157 20 0 CIADHO CC[C@H]([NH2+]C[C@H]1CCCN(CC(C)C)C1)c1cccs1 ZINC000090585213 334364150 /nfs/dbraw/zinc/36/41/50/334364150.db2.gz CSEDRMSEVWGWDZ-CVEARBPZSA-N 1 3 294.508 4.157 20 0 CIADHO C(C[NH2+]C1CCN(C2CCCC2)CC1)CC1CCCCC1 ZINC000568614022 334832609 /nfs/dbraw/zinc/83/26/09/334832609.db2.gz CQNYXSKKXMHXNV-UHFFFAOYSA-N 1 3 292.511 4.344 20 0 CIADHO CCCC[C@@H](C)[C@@H](C)[NH2+]C1CCN(C2CCCC2)CC1 ZINC000573011751 334900458 /nfs/dbraw/zinc/90/04/58/334900458.db2.gz LCYNKXOZIOQDEV-HZPDHXFCSA-N 1 3 280.500 4.198 20 0 CIADHO C[C@H](c1cccc2ccccc21)[N@@H+]1CCC[C@H](N(C)C)CC1 ZINC000576416287 335201523 /nfs/dbraw/zinc/20/15/23/335201523.db2.gz YYRGKVGTUGGNLL-AEFFLSMTSA-N 1 3 296.458 4.317 20 0 CIADHO C[C@H](c1cccc2ccccc21)[N@H+]1CCC[C@H](N(C)C)CC1 ZINC000576416287 335201525 /nfs/dbraw/zinc/20/15/25/335201525.db2.gz YYRGKVGTUGGNLL-AEFFLSMTSA-N 1 3 296.458 4.317 20 0 CIADHO C[C@H](c1cccc2ccccc21)N1CCC[C@H]([NH+](C)C)CC1 ZINC000576416287 335201526 /nfs/dbraw/zinc/20/15/26/335201526.db2.gz YYRGKVGTUGGNLL-AEFFLSMTSA-N 1 3 296.458 4.317 20 0 CIADHO C[C@H]1C[C@@H](NCc2cccc(C[NH+](C)C)c2)c2ccccc21 ZINC000289098209 524808310 /nfs/dbraw/zinc/80/83/10/524808310.db2.gz CAOLILICJYUYSM-MGPUTAFESA-N 1 3 294.442 4.086 20 0 CIADHO CC[C@@H](NCc1cccc(C[NH+](C)C)c1)c1cccc(C)c1 ZINC000353442911 529185258 /nfs/dbraw/zinc/18/52/58/529185258.db2.gz DLACVFPGVVHHES-HXUWFJFHSA-N 1 3 296.458 4.298 20 0 CIADHO CCC[NH+]1CCC(N[C@@H]2CC[C@H](C)c3ccccc32)CC1 ZINC000126469296 260353345 /nfs/dbraw/zinc/35/33/45/260353345.db2.gz GTUZDPBCNLXQNR-HNAYVOBHSA-N 1 3 286.463 4.089 20 0 CIADHO CC[NH+](CC)CCC[C@@H](C)N[C@H](C)c1cc(F)ccc1F ZINC000019915174 262178334 /nfs/dbraw/zinc/17/83/34/262178334.db2.gz WUJWEHJAZOVHBS-ZIAGYGMSSA-N 1 3 298.421 4.126 20 0 CIADHO Cc1cc(C)c([C@@H](C)NC2CC[NH+](C(C)C)CC2)cc1C ZINC000020548620 262249229 /nfs/dbraw/zinc/24/92/29/262249229.db2.gz LEUVQNLANVJXTM-QGZVFWFLSA-N 1 3 288.479 4.135 20 0 CIADHO CC(C)CN1CCC([NH2+][C@H](C)c2ccc(Cl)cc2)CC1 ZINC000221716290 262292556 /nfs/dbraw/zinc/29/25/56/262292556.db2.gz PZWJDVFAVMRNGO-CQSZACIVSA-N 1 3 294.870 4.111 20 0 CIADHO CCC[C@@H](C)[NH2+]C[C@@H]1CCCCN(Cc2ccccc2)C1 ZINC000390767704 262338521 /nfs/dbraw/zinc/33/85/21/262338521.db2.gz JDVPBGDSEOZYTE-MJGOQNOKSA-N 1 3 288.479 4.067 20 0 CIADHO Cc1cc(C)c(CN[C@@H](CCC[NH3+])c2ccccc2)cc1C ZINC000415059178 263258852 /nfs/dbraw/zinc/25/88/52/263258852.db2.gz UPHOBBWCAROTLC-FQEVSTJZSA-N 1 3 296.458 4.182 20 0 CIADHO Cc1ccc(CNCc2cccc(C[N@@H+](C)C(C)C)c2)cc1 ZINC000065976623 265006578 /nfs/dbraw/zinc/00/65/78/265006578.db2.gz OVUNHXQYINNSLK-UHFFFAOYSA-N 1 3 296.458 4.125 20 0 CIADHO Cc1ccc(CNCc2cccc(C[N@H+](C)C(C)C)c2)cc1 ZINC000065976623 265006582 /nfs/dbraw/zinc/00/65/82/265006582.db2.gz OVUNHXQYINNSLK-UHFFFAOYSA-N 1 3 296.458 4.125 20 0 CIADHO C[C@H]1C[C@@H](NCc2ccc(C[NH+](C)C)cc2)c2ccccc21 ZINC000356866265 266198499 /nfs/dbraw/zinc/19/84/99/266198499.db2.gz IHSBMUTZLBRBTG-MGPUTAFESA-N 1 3 294.442 4.086 20 0 CIADHO C[C@H](NCc1ccc(C[NH3+])cc1)c1ccccc1C(C)(C)C ZINC000570632926 327607476 /nfs/dbraw/zinc/60/74/76/327607476.db2.gz LJGIEVFFJDSVBQ-HNNXBMFYSA-N 1 3 296.458 4.294 20 0 CIADHO CC1(C)CC[C@H](NCc2ccc(C[NH3+])cc2)c2ccccc21 ZINC000583145309 329322027 /nfs/dbraw/zinc/32/20/27/329322027.db2.gz IXJMXSFPZYIMIR-IBGZPJMESA-N 1 3 294.442 4.048 20 0 CIADHO Cc1ccc([C@H](NCc2ccc(C[NH3+])cc2)C2CCC2)cc1 ZINC000571921337 329929422 /nfs/dbraw/zinc/92/94/22/329929422.db2.gz NFZLCBSLEVCAMO-HXUWFJFHSA-N 1 3 294.442 4.085 20 0 CIADHO [NH3+]CCC[C@H](NCc1cccc(C2CC2)c1)c1ccccc1 ZINC000422553603 330149164 /nfs/dbraw/zinc/14/91/64/330149164.db2.gz KKCYXYXCQFBFPC-FQEVSTJZSA-N 1 3 294.442 4.134 20 0 CIADHO Cc1ccccc1[C@H]([NH2+][C@@H]1C[C@H](N)c2ccccc21)C(C)C ZINC000422719902 330152072 /nfs/dbraw/zinc/15/20/72/330152072.db2.gz ZFOWSWVOAYGFLP-XUVXKRRUSA-N 1 3 294.442 4.427 20 0 CIADHO C[C@H](CCCC[NH3+])N[C@H](C)c1cc(Cl)ccc1Cl ZINC000422789937 330157347 /nfs/dbraw/zinc/15/73/47/330157347.db2.gz XFGBMDIYPPMPOG-GHMZBOCLSA-N 1 3 289.250 4.162 20 0 CIADHO CCC(CC)[C@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccs1 ZINC000422936933 330161366 /nfs/dbraw/zinc/16/13/66/330161366.db2.gz NGQHXRMLNFNEMW-MYSGWJLTSA-N 1 3 292.492 4.098 20 0 CIADHO c1ccc([C@H](CC2CCCC2)NC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000423002955 330167545 /nfs/dbraw/zinc/16/75/45/330167545.db2.gz KIHFHNBGWNBKFC-XNMUZJSGSA-N 1 3 298.474 4.181 20 0 CIADHO CC[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccc(C)cc1 ZINC000423288994 330186443 /nfs/dbraw/zinc/18/64/43/330186443.db2.gz AHQCCOKQPOLPKV-BEFAXECRSA-N 1 3 282.431 4.256 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CC[C@H](C)c3ccccc32)cc1 ZINC000423290281 330186691 /nfs/dbraw/zinc/18/66/91/330186691.db2.gz CQGVAPPZUCMJJD-AUSJPIAWSA-N 1 3 294.442 4.435 20 0 CIADHO Cc1ccc([C@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)cc1C ZINC000423291495 330187038 /nfs/dbraw/zinc/18/70/38/330187038.db2.gz INSXSJBMABSALO-CVEARBPZSA-N 1 3 282.431 4.174 20 0 CIADHO CCc1ccc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)s1 ZINC000423291514 330187150 /nfs/dbraw/zinc/18/71/50/330187150.db2.gz IRYIDMCSZWEYLE-CHWSQXEVSA-N 1 3 288.460 4.181 20 0 CIADHO Cc1ccc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c(C)c1 ZINC000423291338 330187218 /nfs/dbraw/zinc/18/72/18/330187218.db2.gz HWRQHFYYHZDGQD-JKSUJKDBSA-N 1 3 282.431 4.174 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H](c2ccc(F)cc2)C2CC2)cc1 ZINC000423292196 330187465 /nfs/dbraw/zinc/18/74/65/330187465.db2.gz LXZCDJWCAUKRDV-ORAYPTAESA-N 1 3 298.405 4.086 20 0 CIADHO Cc1cccc2c1[C@H](C)C[C@@H]2NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000423292360 330187468 /nfs/dbraw/zinc/18/74/68/330187468.db2.gz MSUMSHUEMOJBNT-CLCXKQKWSA-N 1 3 294.442 4.353 20 0 CIADHO CC(C)[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccccc1 ZINC000423292106 330187492 /nfs/dbraw/zinc/18/74/92/330187492.db2.gz LJHZFWQXPNIWPZ-HNAYVOBHSA-N 1 3 282.431 4.193 20 0 CIADHO CCC([NH3+])(CC)CN[C@H]1CC[C@H](c2ccc(Cl)cc2)C1 ZINC000423292447 330187497 /nfs/dbraw/zinc/18/74/97/330187497.db2.gz NBRTVJHTVMZGOD-HOCLYGCPSA-N 1 3 294.870 4.083 20 0 CIADHO CC[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccsc1 ZINC000423292883 330187800 /nfs/dbraw/zinc/18/78/00/330187800.db2.gz OVADJWSYIYXNEL-BLLLJJGKSA-N 1 3 274.433 4.009 20 0 CIADHO Cc1ccc(C)c([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000423294966 330188246 /nfs/dbraw/zinc/18/82/46/330188246.db2.gz VVZQALHXBUVVEO-JKSUJKDBSA-N 1 3 282.431 4.174 20 0 CIADHO CCC[C@@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccsc1 ZINC000423295306 330188344 /nfs/dbraw/zinc/18/83/44/330188344.db2.gz WKPFHUYWROJURP-CXAGYDPISA-N 1 3 288.460 4.399 20 0 CIADHO CC(C)c1ccc([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)cc1 ZINC000423357080 330193321 /nfs/dbraw/zinc/19/33/21/330193321.db2.gz LJBAYTHUHQDHQL-HNNXBMFYSA-N 1 3 294.442 4.264 20 0 CIADHO CC(C)Sc1ccc([C@H](C)N[C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000423399000 330195793 /nfs/dbraw/zinc/19/57/93/330195793.db2.gz UMNQGQKLTOSGCA-NUEKZKHPSA-N 1 3 292.492 4.108 20 0 CIADHO C[C@H](CCCC[NH3+])N[C@@H](C)c1cc(Cl)sc1Cl ZINC000423429334 330198471 /nfs/dbraw/zinc/19/84/71/330198471.db2.gz KFQBHBWQJPGERJ-BDAKNGLRSA-N 1 3 295.279 4.223 20 0 CIADHO CCCC[C@H](NCc1ccc2c(c1)C[NH2+]C2)c1ccccc1 ZINC000423388273 330199983 /nfs/dbraw/zinc/19/99/83/330199983.db2.gz NJPXTGGRDDJWCH-FQEVSTJZSA-N 1 3 294.442 4.311 20 0 CIADHO Cc1cc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)cs1 ZINC000423500530 330208168 /nfs/dbraw/zinc/20/81/68/330208168.db2.gz CCHMQJAZSJABGB-YOEHRIQHSA-N 1 3 288.460 4.187 20 0 CIADHO Cc1ccc2c(c1)[C@H](N[C@H](CCC[NH3+])c1ccccc1)CC2 ZINC000423510114 330209200 /nfs/dbraw/zinc/20/92/00/330209200.db2.gz SBRVBGKMWOIYTM-WOJBJXKFSA-N 1 3 294.442 4.052 20 0 CIADHO Cc1cc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)oc1C ZINC000423519772 330209775 /nfs/dbraw/zinc/20/97/75/330209775.db2.gz QMOULYXDNABKKM-PBHICJAKSA-N 1 3 286.419 4.027 20 0 CIADHO C[C@H]([NH2+]C1CCN(CC2CCCC2)CC1)C1CCCCC1 ZINC000527232595 330239305 /nfs/dbraw/zinc/23/93/05/330239305.db2.gz KNCAGDORADFVGR-INIZCTEOSA-N 1 3 292.511 4.199 20 0 CIADHO CC[C@H](C)c1ccc([C@@H](C)[NH2+]CC2=CCN(C)CC2)cc1 ZINC000527876678 330291355 /nfs/dbraw/zinc/29/13/55/330291355.db2.gz OTBIHGFERHBCAE-JKSUJKDBSA-N 1 3 286.463 4.113 20 0 CIADHO CCCCc1ccc([C@H](C)NC[C@H]2CCC[N@H+](C)C2)cc1 ZINC000044534290 330329676 /nfs/dbraw/zinc/32/96/76/330329676.db2.gz FQQMNYQITMFVMH-FUHWJXTLSA-N 1 3 288.479 4.022 20 0 CIADHO CCCCc1ccc([C@H](C)NC[C@H]2CCC[N@@H+](C)C2)cc1 ZINC000044534290 330329677 /nfs/dbraw/zinc/32/96/77/330329677.db2.gz FQQMNYQITMFVMH-FUHWJXTLSA-N 1 3 288.479 4.022 20 0 CIADHO CCCCc1ccc([C@@H](C)NC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000044534284 330329835 /nfs/dbraw/zinc/32/98/35/330329835.db2.gz FQQMNYQITMFVMH-AEFFLSMTSA-N 1 3 288.479 4.022 20 0 CIADHO CCCCc1ccc([C@@H](C)NC[C@@H]2CCC[N@@H+](C)C2)cc1 ZINC000044534284 330329836 /nfs/dbraw/zinc/32/98/36/330329836.db2.gz FQQMNYQITMFVMH-AEFFLSMTSA-N 1 3 288.479 4.022 20 0 CIADHO [NH3+]Cc1ccc(CN[C@@H](CC2CCC2)c2ccccc2)cc1 ZINC000514728084 330463824 /nfs/dbraw/zinc/46/38/24/330463824.db2.gz MDMDQRXRVFINRH-FQEVSTJZSA-N 1 3 294.442 4.166 20 0 CIADHO C[C@H](NCCCC[N@H+](C)C1CC1)c1ccc(F)cc1Cl ZINC000453397518 331128066 /nfs/dbraw/zinc/12/80/66/331128066.db2.gz JNWZAAMGYVCBAL-LBPRGKRZSA-N 1 3 298.833 4.004 20 0 CIADHO C[C@H](NCCCC[N@@H+](C)C1CC1)c1ccc(F)cc1Cl ZINC000453397518 331128067 /nfs/dbraw/zinc/12/80/67/331128067.db2.gz JNWZAAMGYVCBAL-LBPRGKRZSA-N 1 3 298.833 4.004 20 0 CIADHO CC(C)(C)N1CCC([NH2+]CC(C)(C)C2=CCCCC2)CC1 ZINC000480713541 331785677 /nfs/dbraw/zinc/78/56/77/331785677.db2.gz WIRRNEGXVWGJCB-UHFFFAOYSA-N 1 3 292.511 4.366 20 0 CIADHO C[C@H]1CCCC[C@@H]1CC[NH2+]C1CCN(C(C)(C)C)CC1 ZINC000513208096 333008429 /nfs/dbraw/zinc/00/84/29/333008429.db2.gz MNVRPEOEOLEWRG-JKSUJKDBSA-N 1 3 280.500 4.055 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@H](CC2CC2)c2ccccc2)cc1 ZINC000521607225 333179819 /nfs/dbraw/zinc/17/98/19/333179819.db2.gz KCNQIRJPOUUJAU-FOIQADDNSA-N 1 3 294.442 4.337 20 0 CIADHO CCCC1CCC([NH2+]Cc2cccc(CN(C)C)c2)CC1 ZINC000521819448 333190114 /nfs/dbraw/zinc/19/01/14/333190114.db2.gz IZLZOIABUVBLRI-UHFFFAOYSA-N 1 3 288.479 4.197 20 0 CIADHO CC(C)N(C)CCC[NH2+][C@@H](C)c1cccc2ccccc21 ZINC000226312792 333256425 /nfs/dbraw/zinc/25/64/25/333256425.db2.gz HMPWWWQZWPMFED-INIZCTEOSA-N 1 3 284.447 4.221 20 0 CIADHO C[C@H]([NH2+][C@@H](CCN(C)C)C(C)(C)C)c1ccccc1Cl ZINC000523851273 333347992 /nfs/dbraw/zinc/34/79/92/333347992.db2.gz NAVWKPSPAWEAPW-BBRMVZONSA-N 1 3 296.886 4.357 20 0 CIADHO CC(C)(C)N1CCC([NH2+]Cc2cccc3ccccc32)CC1 ZINC000236644436 333374308 /nfs/dbraw/zinc/37/43/08/333374308.db2.gz UFMDGHILEKPODD-UHFFFAOYSA-N 1 3 296.458 4.192 20 0 CIADHO C[C@H]([NH2+]C1CCN(C2CCCCC2)CC1)C1CCCCC1 ZINC000237530964 333380036 /nfs/dbraw/zinc/38/00/36/333380036.db2.gz AXIDKLPKYLTVOI-INIZCTEOSA-N 1 3 292.511 4.342 20 0 CIADHO CC[NH+](CC)CCCC1CCN(Cc2cccs2)CC1 ZINC000542176523 333813531 /nfs/dbraw/zinc/81/35/31/333813531.db2.gz XLMLWEIFMKOJAD-UHFFFAOYSA-N 1 3 294.508 4.082 20 0 CIADHO Cc1ccccc1[C@H](C)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000137569517 334175051 /nfs/dbraw/zinc/17/50/51/334175051.db2.gz REGZCUOJBDZGCQ-ROUUACIJSA-N 1 3 286.463 4.006 20 0 CIADHO CCN(C)C[C@@H]1CC[N@@H+]([C@H](C)c2ccc3ccccc3c2)C1 ZINC000245441035 334193724 /nfs/dbraw/zinc/19/37/24/334193724.db2.gz GYVWBESWELYPHR-SJORKVTESA-N 1 3 296.458 4.174 20 0 CIADHO CCN(C)C[C@@H]1CC[N@H+]([C@H](C)c2ccc3ccccc3c2)C1 ZINC000245441035 334193726 /nfs/dbraw/zinc/19/37/26/334193726.db2.gz GYVWBESWELYPHR-SJORKVTESA-N 1 3 296.458 4.174 20 0 CIADHO CC(C)C(C[NH2+][C@H](C)[C@@H]1CCCN(C2CCC2)C1)C(C)C ZINC000551804550 334262274 /nfs/dbraw/zinc/26/22/74/334262274.db2.gz ACOLOHZAZQFNGW-IAGOWNOFSA-N 1 3 294.527 4.157 20 0 CIADHO CC(C)Cc1cccc([C@H](C)N[C@H]2CC[N@H+](C)[C@@H](C)C2)c1 ZINC000552245089 334307684 /nfs/dbraw/zinc/30/76/84/334307684.db2.gz QSTXOTYWNCXCPJ-BXWFABGCSA-N 1 3 288.479 4.018 20 0 CIADHO CC(C)Cc1cccc([C@H](C)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1 ZINC000552245089 334307685 /nfs/dbraw/zinc/30/76/85/334307685.db2.gz QSTXOTYWNCXCPJ-BXWFABGCSA-N 1 3 288.479 4.018 20 0 CIADHO CC(C)C[C@@H](NCc1ccc(C[NH3+])cc1)c1cccs1 ZINC000564988407 334532867 /nfs/dbraw/zinc/53/28/67/334532867.db2.gz KJBMZRPGCPNZIQ-MRXNPFEDSA-N 1 3 288.460 4.084 20 0 CIADHO CCc1ccc([C@H](NCc2ccc(C[NH3+])cc2)C(C)C)cc1 ZINC000566245251 334638124 /nfs/dbraw/zinc/63/81/24/334638124.db2.gz GHWGNNNGEQFZKS-HXUWFJFHSA-N 1 3 296.458 4.195 20 0 CIADHO CCc1ccc([C@@H](NCc2ccc(C[NH3+])cc2)C(C)C)cc1 ZINC000566245250 334638144 /nfs/dbraw/zinc/63/81/44/334638144.db2.gz GHWGNNNGEQFZKS-FQEVSTJZSA-N 1 3 296.458 4.195 20 0 CIADHO Cc1ccc2cc([C@H](C)NCc3ccc(C[NH3+])cc3)oc2c1 ZINC000577062686 335293746 /nfs/dbraw/zinc/29/37/46/335293746.db2.gz ZICPZURRQKIUTR-AWEZNQCLSA-N 1 3 294.398 4.051 20 0 CIADHO CC[C@H]([NH2+]CCCN1CCCC[C@@H]1C)c1ccsc1 ZINC000382129480 336082161 /nfs/dbraw/zinc/08/21/61/336082161.db2.gz OJFOXQUNPGGOQS-HOCLYGCPSA-N 1 3 280.481 4.053 20 0 CIADHO C[C@@H](CNCc1cccc2ccccc21)C[NH+]1CCCCC1 ZINC000386938481 336182708 /nfs/dbraw/zinc/18/27/08/336182708.db2.gz QHOGLBIHPKXZQH-KRWDZBQOSA-N 1 3 296.458 4.051 20 0 CIADHO C[C@@H](C[NH2+]Cc1cccc2ccccc21)CN1CCCCC1 ZINC000386938481 336182710 /nfs/dbraw/zinc/18/27/10/336182710.db2.gz QHOGLBIHPKXZQH-KRWDZBQOSA-N 1 3 296.458 4.051 20 0 CIADHO C[C@@H](NCc1cccc(C[NH+]2CCCC2)c1)c1ccccc1 ZINC000193136321 518178274 /nfs/dbraw/zinc/17/82/74/518178274.db2.gz UGASUPOFJSDQSJ-QGZVFWFLSA-N 1 3 294.442 4.133 20 0 CIADHO C[C@H](NC1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Cl)cc1 ZINC000088163873 525299338 /nfs/dbraw/zinc/29/93/38/525299338.db2.gz SSYVNTBRKOGEES-RJCAOGMDSA-N 1 3 292.854 4.006 20 0 CIADHO C[C@H](NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccc(Cl)cc1 ZINC000088163873 525299346 /nfs/dbraw/zinc/29/93/46/525299346.db2.gz SSYVNTBRKOGEES-RJCAOGMDSA-N 1 3 292.854 4.006 20 0 CIADHO CC(C)N(C)CCC[NH2+][C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000223024882 260259370 /nfs/dbraw/zinc/25/93/70/260259370.db2.gz WOIBNJOWASMXCW-QGZVFWFLSA-N 1 3 294.870 4.111 20 0 CIADHO CC[NH+](CC)CCC[C@@H](C)N[C@@H](C)c1ccc(F)cc1F ZINC000019915154 262178293 /nfs/dbraw/zinc/17/82/93/262178293.db2.gz GUFJJSPOXOFFGX-KGLIPLIRSA-N 1 3 298.421 4.126 20 0 CIADHO CC(C)c1ccc(CNCc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000414806153 263051996 /nfs/dbraw/zinc/05/19/96/263051996.db2.gz HHRAALILZNTZBI-OAHLLOKOSA-N 1 3 282.431 4.120 20 0 CIADHO C[C@H]([NH3+])c1ccc(CNCc2ccc(C(C)(C)C)cc2)cc1 ZINC000414815302 263053834 /nfs/dbraw/zinc/05/38/34/263053834.db2.gz XCWBKNBMMNWELR-HNNXBMFYSA-N 1 3 296.458 4.294 20 0 CIADHO CCCc1cccc(CN[C@H](CCC[NH3+])c2ccccc2)c1 ZINC000415048110 263258237 /nfs/dbraw/zinc/25/82/37/263258237.db2.gz FPQQGXAZWRSYAC-HXUWFJFHSA-N 1 3 296.458 4.209 20 0 CIADHO CC[C@H](NCc1ccc(C[NH+](C)C)cc1)c1cccs1 ZINC000171130959 327646242 /nfs/dbraw/zinc/64/62/42/327646242.db2.gz IJACKJLMAKZENZ-INIZCTEOSA-N 1 3 288.460 4.051 20 0 CIADHO C[C@@H](N[C@@H](C)CCCC[NH3+])c1ccc(Cl)cc1Cl ZINC000381242396 327171501 /nfs/dbraw/zinc/17/15/01/327171501.db2.gz KOTUAPIASKRVKZ-WDEREUQCSA-N 1 3 289.250 4.162 20 0 CIADHO CC[C@@H](NCc1ccc(C[NH3+])cc1)c1cccc(Cl)c1 ZINC000564989347 327341062 /nfs/dbraw/zinc/34/10/62/327341062.db2.gz XPKMVPXDYZYZGC-QGZVFWFLSA-N 1 3 288.822 4.040 20 0 CIADHO C[C@H]1CCC[C@H](C[NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000583400884 327344526 /nfs/dbraw/zinc/34/45/26/327344526.db2.gz RLJAZWVERGSXED-IRXDYDNUSA-N 1 3 292.511 4.199 20 0 CIADHO CCC(C)(C)CC[NH2+][C@@H](C)[C@H]1CCCN(C2CCC2)C1 ZINC000583408399 327349394 /nfs/dbraw/zinc/34/93/94/327349394.db2.gz WARZNRGFNKJLLM-HOTGVXAUSA-N 1 3 280.500 4.055 20 0 CIADHO CC1(C)CCC[C@H](C[NH2+]C2CCN(C3CCCC3)CC2)C1 ZINC000561527822 327400837 /nfs/dbraw/zinc/40/08/37/327400837.db2.gz UIUMVRFPLINJDF-INIZCTEOSA-N 1 3 292.511 4.199 20 0 CIADHO CC(C)(C)N1CCC([NH2+]CCCC2CCCCC2)CC1 ZINC000395191966 329279151 /nfs/dbraw/zinc/27/91/51/329279151.db2.gz ZFZLRWNYSQWHQB-UHFFFAOYSA-N 1 3 280.500 4.199 20 0 CIADHO C[C@@H](NCCCC[NH3+])c1ccc(Cl)c(Cl)c1Cl ZINC000037715469 329550682 /nfs/dbraw/zinc/55/06/82/329550682.db2.gz GTBGWAVYSKRRGX-MRVPVSSYSA-N 1 3 295.641 4.036 20 0 CIADHO [NH3+]CCC[C@@H](NCc1cccc(C2CC2)c1)c1ccccc1 ZINC000422553604 330149136 /nfs/dbraw/zinc/14/91/36/330149136.db2.gz KKCYXYXCQFBFPC-HXUWFJFHSA-N 1 3 294.442 4.134 20 0 CIADHO CCCC[C@@H](CCC)C[NH2+][C@H](C)c1ccc(CN)nc1C ZINC000422865197 330158055 /nfs/dbraw/zinc/15/80/55/330158055.db2.gz OKQRMKRCCAECDI-GDBMZVCRSA-N 1 3 291.483 4.106 20 0 CIADHO C[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@H]1C[C@H](N)c2ccccc21 ZINC000423030829 330166386 /nfs/dbraw/zinc/16/63/86/330166386.db2.gz WLULZHHJDYKRSY-HOLAOCEGSA-N 1 3 292.426 4.044 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2CCCCc3ccccc32)cc1 ZINC000423289667 330186556 /nfs/dbraw/zinc/18/65/56/330186556.db2.gz BMGNXBHELVWKLM-MGPUTAFESA-N 1 3 294.442 4.264 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@@H]2CCCc3cc(F)ccc32)cc1 ZINC000423290480 330186694 /nfs/dbraw/zinc/18/66/94/330186694.db2.gz DDNZULDMTBKVSF-BFUOFWGJSA-N 1 3 298.405 4.013 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CCCc3cc(F)ccc32)cc1 ZINC000423290481 330186718 /nfs/dbraw/zinc/18/67/18/330186718.db2.gz DDNZULDMTBKVSF-DJJJIMSYSA-N 1 3 298.405 4.013 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H](C)c2ccc3c(c2)CCC3)cc1 ZINC000423292327 330187488 /nfs/dbraw/zinc/18/74/88/330187488.db2.gz MNECGGLFGJNZDN-GJZGRUSLSA-N 1 3 294.442 4.046 20 0 CIADHO CC[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1ccsc1 ZINC000423292886 330187664 /nfs/dbraw/zinc/18/76/64/330187664.db2.gz OVADJWSYIYXNEL-WBMJQRKESA-N 1 3 274.433 4.009 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@@H]2CCSc3ccccc32)cc1 ZINC000423292560 330187819 /nfs/dbraw/zinc/18/78/19/330187819.db2.gz NIHWZYRRIONHMR-CXAGYDPISA-N 1 3 298.455 4.033 20 0 CIADHO Cc1cc(C)c([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)cc1C ZINC000423366133 330194759 /nfs/dbraw/zinc/19/47/59/330194759.db2.gz XHDIKQDWISUCJX-INIZCTEOSA-N 1 3 294.442 4.066 20 0 CIADHO CCCc1ccc([C@@H](C)NCc2ccc3c(c2)C[NH2+]C3)cc1 ZINC000423370950 330194923 /nfs/dbraw/zinc/19/49/23/330194923.db2.gz GCZPQIZCFWHGAO-OAHLLOKOSA-N 1 3 294.442 4.093 20 0 CIADHO C[C@@H]1CC[C@@H](NCc2ccc3c(c2)C[NH2+]C3)c2sccc21 ZINC000423398974 330195881 /nfs/dbraw/zinc/19/58/81/330195881.db2.gz ULGGVQGYSBQVBC-SJKOYZFVSA-N 1 3 298.455 4.080 20 0 CIADHO C[C@@H](NCc1ccc2c(c1)C[NH2+]C2)c1cccc(C2CC2)c1 ZINC000423407314 330197047 /nfs/dbraw/zinc/19/70/47/330197047.db2.gz ZUUJWODEXOCECE-CQSZACIVSA-N 1 3 292.426 4.018 20 0 CIADHO C[C@H]([NH2+][C@@H]1CCNC[C@@H]1C)c1ccc(-c2ccccc2)cc1 ZINC000423392743 330200539 /nfs/dbraw/zinc/20/05/39/330200539.db2.gz LYYMGMHCZSJKLB-TWOQFEAHSA-N 1 3 294.442 4.002 20 0 CIADHO C[C@H]([NH2+][C@H]1CCNC[C@H]1C)c1ccc(-c2ccccc2)cc1 ZINC000423392742 330200765 /nfs/dbraw/zinc/20/07/65/330200765.db2.gz LYYMGMHCZSJKLB-GUXCAODWSA-N 1 3 294.442 4.002 20 0 CIADHO CCc1ccc([C@H](C)N[C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423507122 330208885 /nfs/dbraw/zinc/20/88/85/330208885.db2.gz PRDHDKPMSAITGK-JXFKEZNVSA-N 1 3 296.458 4.380 20 0 CIADHO C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000434771666 330644801 /nfs/dbraw/zinc/64/48/01/330644801.db2.gz AOMVQMFFKWPQMX-QAPCUYQASA-N 1 3 292.511 4.198 20 0 CIADHO CCC[NH+]1CCC(N[C@H]2CC[C@H](C)c3ccsc32)CC1 ZINC000453076375 331086874 /nfs/dbraw/zinc/08/68/74/331086874.db2.gz HQFHKHOORXHNFT-BBRMVZONSA-N 1 3 292.492 4.151 20 0 CIADHO c1cc(C2CCCC2)ccc1CNC1CC[NH+](C2CC2)CC1 ZINC000462783122 331328827 /nfs/dbraw/zinc/32/88/27/331328827.db2.gz IYZVRJCECUDNAN-UHFFFAOYSA-N 1 3 298.474 4.061 20 0 CIADHO C[C@@H](NCCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccsc1 ZINC000480646632 331781430 /nfs/dbraw/zinc/78/14/30/331781430.db2.gz ZEXAFMSIDOJVKV-BZUAXINKSA-N 1 3 294.508 4.157 20 0 CIADHO CC[NH+](CC)CCC[C@@H](C)N[C@H](C)c1cc(C)c(C)o1 ZINC000502687411 332668928 /nfs/dbraw/zinc/66/89/28/332668928.db2.gz PRBLJNSAPSQYPJ-HUUCEWRRSA-N 1 3 280.456 4.058 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@H](CC2CC2)c2ccccc2)cc1 ZINC000521607228 333179884 /nfs/dbraw/zinc/17/98/84/333179884.db2.gz KCNQIRJPOUUJAU-MGPUTAFESA-N 1 3 294.442 4.337 20 0 CIADHO C[C@@H](N[C@@H](CC[NH+](C)C)C(C)(C)C)c1cccc(Cl)c1 ZINC000522546430 333289506 /nfs/dbraw/zinc/28/95/06/333289506.db2.gz MCYYDWVQDVKBCG-CJNGLKHVSA-N 1 3 296.886 4.357 20 0 CIADHO C[C@@H]([NH2+]C1CCN(C2CCCC2)CC1)C1CCCCCC1 ZINC000543401638 333871545 /nfs/dbraw/zinc/87/15/45/333871545.db2.gz XGYIZHUVSBKWDQ-MRXNPFEDSA-N 1 3 292.511 4.342 20 0 CIADHO c1ccc2c(c1)CCC[C@@H]2N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000246963424 334272843 /nfs/dbraw/zinc/27/28/43/334272843.db2.gz GHUCHLCGHUWOCM-QUCCMNQESA-N 1 3 298.474 4.014 20 0 CIADHO CC[C@H](c1ccccc1)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000247218110 334277690 /nfs/dbraw/zinc/27/76/90/334277690.db2.gz XMYGYLLNNASREV-RTBURBONSA-N 1 3 286.463 4.088 20 0 CIADHO CC[C@H](c1ccccc1)[N@@H+]1CCC[C@@H](N2CCCC2)CC1 ZINC000247218110 334277691 /nfs/dbraw/zinc/27/76/91/334277691.db2.gz XMYGYLLNNASREV-RTBURBONSA-N 1 3 286.463 4.088 20 0 CIADHO CC[C@H](c1ccccc1)[N@H+]1CCC[C@@H](N2CCCC2)CC1 ZINC000247218110 334277692 /nfs/dbraw/zinc/27/76/92/334277692.db2.gz XMYGYLLNNASREV-RTBURBONSA-N 1 3 286.463 4.088 20 0 CIADHO C[C@H](NC1CCC([NH+](C)C)CC1)c1ccc(F)cc1Cl ZINC000552249655 334308559 /nfs/dbraw/zinc/30/85/59/334308559.db2.gz GYYXCVHBSZLBCT-XGNXJENSSA-N 1 3 298.833 4.003 20 0 CIADHO C1C[C@H]2C[C@H]([NH2+]C3CCC4(CCCCC4)CC3)CCN2C1 ZINC000248889420 334320890 /nfs/dbraw/zinc/32/08/90/334320890.db2.gz YMMDGHJLLUXYTI-MSOLQXFVSA-N 1 3 290.495 4.096 20 0 CIADHO C[C@H](c1cccc2ccccc21)[N@@H+]1CCC[C@@H](N(C)C)CC1 ZINC000576416289 335201514 /nfs/dbraw/zinc/20/15/14/335201514.db2.gz YYRGKVGTUGGNLL-SJLPKXTDSA-N 1 3 296.458 4.317 20 0 CIADHO C[C@H](c1cccc2ccccc21)[N@H+]1CCC[C@@H](N(C)C)CC1 ZINC000576416289 335201515 /nfs/dbraw/zinc/20/15/15/335201515.db2.gz YYRGKVGTUGGNLL-SJLPKXTDSA-N 1 3 296.458 4.317 20 0 CIADHO C[C@H](c1cccc2ccccc21)N1CCC[C@@H]([NH+](C)C)CC1 ZINC000576416289 335201517 /nfs/dbraw/zinc/20/15/17/335201517.db2.gz YYRGKVGTUGGNLL-SJLPKXTDSA-N 1 3 296.458 4.317 20 0 CIADHO CC(C)CC[C@@H](NCc1ccc(C[NH3+])cc1)c1ccoc1 ZINC000578359669 335619842 /nfs/dbraw/zinc/61/98/42/335619842.db2.gz RAAZKUPUMGNBRJ-GOSISDBHSA-N 1 3 286.419 4.005 20 0 CIADHO C[C@@H](CC[NH2+]C1CCN(C(C)(C)C)CC1)c1ccccc1 ZINC000043534114 524498882 /nfs/dbraw/zinc/49/88/82/524498882.db2.gz YJDINRGHJQWTSY-INIZCTEOSA-N 1 3 288.479 4.033 20 0 CIADHO C[C@@H](CCNC1CC[NH+](C(C)(C)C)CC1)c1ccccc1 ZINC000043534114 524498887 /nfs/dbraw/zinc/49/88/87/524498887.db2.gz YJDINRGHJQWTSY-INIZCTEOSA-N 1 3 288.479 4.033 20 0 CIADHO Cc1ccc([C@@H](C)NCc2ccc(C[NH+](C)C)cc2)cc1C ZINC000171133309 335056208 /nfs/dbraw/zinc/05/62/08/335056208.db2.gz DVOIBMMZBUILMN-QGZVFWFLSA-N 1 3 296.458 4.216 20 0 CIADHO CC[NH+](CC)CCC[C@H](C)NCc1ccsc1Cl ZINC000312589047 260163024 /nfs/dbraw/zinc/16/30/24/260163024.db2.gz UUMQXTPANJPDJE-LBPRGKRZSA-N 1 3 288.888 4.002 20 0 CIADHO [NH3+]CCC[C@@H](NCc1cc2ccccc2o1)c1ccccc1 ZINC000415057199 263258735 /nfs/dbraw/zinc/25/87/35/263258735.db2.gz RISORGPBTZPUNM-GOSISDBHSA-N 1 3 294.398 4.003 20 0 CIADHO C[C@@H]1C[C@@H](NCc2ccc(C[NH+](C)C)cc2)c2ccccc21 ZINC000356866253 266199017 /nfs/dbraw/zinc/19/90/17/266199017.db2.gz IHSBMUTZLBRBTG-FOIQADDNSA-N 1 3 294.442 4.086 20 0 CIADHO CC[C@@H](NCc1ccc(C[NH+](C)C)cc1)c1cccs1 ZINC000171130963 327646020 /nfs/dbraw/zinc/64/60/20/327646020.db2.gz IJACKJLMAKZENZ-MRXNPFEDSA-N 1 3 288.460 4.051 20 0 CIADHO CCC[C@H]([NH2+]C1CCN(C(C)(C)C)CC1)c1ccsc1 ZINC000187768641 328302124 /nfs/dbraw/zinc/30/21/24/328302124.db2.gz QFFSOKSQJQOOEE-INIZCTEOSA-N 1 3 294.508 4.442 20 0 CIADHO CC(C)(C)C1CC([NH2+]C2CCN(C3CCCCC3)CC2)C1 ZINC000559879834 327266204 /nfs/dbraw/zinc/26/62/04/327266204.db2.gz VXUVLTCVGUKVPN-UHFFFAOYSA-N 1 3 292.511 4.198 20 0 CIADHO CC(C)(C)C1CC(NC2CC[NH+](C3CCCCC3)CC2)C1 ZINC000559879834 327266205 /nfs/dbraw/zinc/26/62/05/327266205.db2.gz VXUVLTCVGUKVPN-UHFFFAOYSA-N 1 3 292.511 4.198 20 0 CIADHO C[C@@H](CCC(C)(C)C)[NH2+]C1CCN(C2CCCC2)CC1 ZINC000150966593 327402527 /nfs/dbraw/zinc/40/25/27/327402527.db2.gz VUQPROJPOWCKAN-HNNXBMFYSA-N 1 3 280.500 4.198 20 0 CIADHO C[C@H](NCCCCC[NH+]1CCCCC1)c1ccccc1F ZINC000532511716 328785783 /nfs/dbraw/zinc/78/57/83/328785783.db2.gz ZRNSSRJOHIEKBV-INIZCTEOSA-N 1 3 292.442 4.133 20 0 CIADHO C[C@@H]([NH2+]C1CCN(CC2CCCC2)CC1)c1cccs1 ZINC000178158426 329196786 /nfs/dbraw/zinc/19/67/86/329196786.db2.gz LZAZPJYTVYBYOM-CQSZACIVSA-N 1 3 292.492 4.053 20 0 CIADHO CC1(C)CC[C@@H](NCc2ccc(C[NH3+])cc2)c2ccccc21 ZINC000583145312 329322142 /nfs/dbraw/zinc/32/21/42/329322142.db2.gz IXJMXSFPZYIMIR-LJQANCHMSA-N 1 3 294.442 4.048 20 0 CIADHO CCC(CC)[C@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccccc1 ZINC000422720506 330152142 /nfs/dbraw/zinc/15/21/42/330152142.db2.gz SNTRRWQDNQJZQL-SWDXFRIISA-N 1 3 286.463 4.037 20 0 CIADHO CC(C)(C)C[C@H]([NH2+]C1CCNCC1)c1ccc(Cl)cc1 ZINC000422790719 330155270 /nfs/dbraw/zinc/15/52/70/330155270.db2.gz VFZFCWYMWLLDSW-INIZCTEOSA-N 1 3 294.870 4.159 20 0 CIADHO CC(C)(C)C[C@@H]([NH2+]C1CCNCC1)c1ccc(Cl)cc1 ZINC000422791031 330155313 /nfs/dbraw/zinc/15/53/13/330155313.db2.gz VFZFCWYMWLLDSW-MRXNPFEDSA-N 1 3 294.870 4.159 20 0 CIADHO CCC(CC)[C@@H](NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccs1 ZINC000422936925 330161348 /nfs/dbraw/zinc/16/13/48/330161348.db2.gz NGQHXRMLNFNEMW-KJFZJZGVSA-N 1 3 292.492 4.098 20 0 CIADHO C[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@H]1C[C@@H](N)c2ccccc21 ZINC000423030832 330166130 /nfs/dbraw/zinc/16/61/30/330166130.db2.gz WLULZHHJDYKRSY-NWTFUFRBSA-N 1 3 292.426 4.044 20 0 CIADHO CC[C@H](NCc1ccc([C@@H](C)[NH3+])cc1)c1cccs1 ZINC000423289830 330186319 /nfs/dbraw/zinc/18/63/19/330186319.db2.gz BQXLVBVATZLDRF-DOMZBBRYSA-N 1 3 274.433 4.009 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@@H]2CCCc3ccc(F)cc32)cc1 ZINC000423289899 330186533 /nfs/dbraw/zinc/18/65/33/330186533.db2.gz BYNXORFZFNBPNJ-BFUOFWGJSA-N 1 3 298.405 4.013 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@H]2CC[C@@H](C)c3ccccc32)cc1 ZINC000423290284 330186822 /nfs/dbraw/zinc/18/68/22/330186822.db2.gz CQGVAPPZUCMJJD-SIFCLUCFSA-N 1 3 294.442 4.435 20 0 CIADHO Cc1ccc([C@@H](C)NCc2ccc([C@H](C)[NH3+])cc2)cc1C ZINC000423291498 330187165 /nfs/dbraw/zinc/18/71/65/330187165.db2.gz INSXSJBMABSALO-JKSUJKDBSA-N 1 3 282.431 4.174 20 0 CIADHO Cc1ccc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c(C)c1 ZINC000423291337 330187182 /nfs/dbraw/zinc/18/71/82/330187182.db2.gz HWRQHFYYHZDGQD-HZPDHXFCSA-N 1 3 282.431 4.174 20 0 CIADHO CCc1ccc([C@H](C)NCc2ccc([C@H](C)[NH3+])cc2)s1 ZINC000423291517 330187214 /nfs/dbraw/zinc/18/72/14/330187214.db2.gz IRYIDMCSZWEYLE-STQMWFEESA-N 1 3 288.460 4.181 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](C)c2cccc(C3CC3)c2)cc1 ZINC000423291067 330187232 /nfs/dbraw/zinc/18/72/32/330187232.db2.gz GOIIKZZBROPYTL-CABCVRRESA-N 1 3 294.442 4.435 20 0 CIADHO C[C@H]([NH3+])c1ccc(CN[C@@H]2C[C@@H](C)c3ccccc32)cc1 ZINC000423291964 330187379 /nfs/dbraw/zinc/18/73/79/330187379.db2.gz KUENKSBVUJCYOC-BIENJYKASA-N 1 3 280.415 4.044 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@@H](c2ccc(F)cc2)C2CC2)cc1 ZINC000423292194 330187505 /nfs/dbraw/zinc/18/75/05/330187505.db2.gz LXZCDJWCAUKRDV-BFUOFWGJSA-N 1 3 298.405 4.086 20 0 CIADHO C[C@@H](NCc1ccc([C@H](C)[NH3+])cc1)c1ccc(Cl)cc1 ZINC000423292527 330187592 /nfs/dbraw/zinc/18/75/92/330187592.db2.gz NGMAEMUGJCPEIM-QWHCGFSZSA-N 1 3 288.822 4.211 20 0 CIADHO C[C@@H]([NH3+])c1ccc(CN[C@H]2CCSc3ccccc32)cc1 ZINC000423292561 330187804 /nfs/dbraw/zinc/18/78/04/330187804.db2.gz NIHWZYRRIONHMR-DYVFJYSZSA-N 1 3 298.455 4.033 20 0 CIADHO Cc1cc(C)cc([C@@H](C)NCc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000423295190 330188387 /nfs/dbraw/zinc/18/83/87/330188387.db2.gz WJTXSFNJDGMWEI-HZPDHXFCSA-N 1 3 282.431 4.174 20 0 CIADHO C[C@H]([NH2+][C@@H]1CCNC[C@H]1C)c1cccc(-c2ccccc2)c1 ZINC000423363234 330194058 /nfs/dbraw/zinc/19/40/58/330194058.db2.gz BPRXFOKNWKQSCQ-GQIGUUNPSA-N 1 3 294.442 4.002 20 0 CIADHO CCCc1ccc([C@H](C)NCc2ccc3c(c2)C[NH2+]C3)cc1 ZINC000423370949 330195027 /nfs/dbraw/zinc/19/50/27/330195027.db2.gz GCZPQIZCFWHGAO-HNNXBMFYSA-N 1 3 294.442 4.093 20 0 CIADHO C[C@H]1CC[C@H](NCc2ccc3c(c2)C[NH2+]C3)c2ccccc21 ZINC000423370914 330195087 /nfs/dbraw/zinc/19/50/87/330195087.db2.gz GBAIFFJJFMMDFV-XOBRGWDASA-N 1 3 292.426 4.018 20 0 CIADHO CC(C)Sc1ccc([C@H](C)N[C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000423398998 330195924 /nfs/dbraw/zinc/19/59/24/330195924.db2.gz UMNQGQKLTOSGCA-IMJJTQAJSA-N 1 3 292.492 4.108 20 0 CIADHO C[C@@H]([NH2+][C@@H]1CCN[C@H](C)C1)c1cccc(-c2ccccc2)c1 ZINC000423401753 330196467 /nfs/dbraw/zinc/19/64/67/330196467.db2.gz XGVLOWSCBQYABR-JXXFODFXSA-N 1 3 294.442 4.145 20 0 CIADHO C[C@H](CCCC[NH3+])N[C@H](C)c1cc(Cl)sc1Cl ZINC000423429343 330198523 /nfs/dbraw/zinc/19/85/23/330198523.db2.gz KFQBHBWQJPGERJ-RKDXNWHRSA-N 1 3 295.279 4.223 20 0 CIADHO Cc1cc([C@@H](C)N[C@@H](CCC[NH3+])c2ccccc2)cs1 ZINC000423500513 330208267 /nfs/dbraw/zinc/20/82/67/330208267.db2.gz CCHMQJAZSJABGB-PBHICJAKSA-N 1 3 288.460 4.187 20 0 CIADHO Cc1cc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)cs1 ZINC000423500529 330208277 /nfs/dbraw/zinc/20/82/77/330208277.db2.gz CCHMQJAZSJABGB-WMLDXEAASA-N 1 3 288.460 4.187 20 0 CIADHO CC[C@H](N[C@H](CCC[NH3+])c1ccccc1)c1ccsc1 ZINC000423501456 330208540 /nfs/dbraw/zinc/20/85/40/330208540.db2.gz CUHDJEJEOKSQGN-DLBZAZTESA-N 1 3 288.460 4.269 20 0 CIADHO C[C@@H]1C[C@H](N[C@@H](CCC[NH3+])c2ccccc2)c2ccccc21 ZINC000423510223 330209035 /nfs/dbraw/zinc/20/90/35/330209035.db2.gz MIEMXZXXCLPAOM-XPGWFJOJSA-N 1 3 294.442 4.305 20 0 CIADHO Cc1ccc([C@@H](C)N[C@H](CCC[NH3+])c2ccccc2)s1 ZINC000423514831 330209328 /nfs/dbraw/zinc/20/93/28/330209328.db2.gz WTXMMDYVPZFRFS-GDBMZVCRSA-N 1 3 288.460 4.187 20 0 CIADHO Cc1cc([C@H](C)N[C@H](CCC[NH3+])c2ccccc2)oc1C ZINC000423519774 330209853 /nfs/dbraw/zinc/20/98/53/330209853.db2.gz QMOULYXDNABKKM-WMLDXEAASA-N 1 3 286.419 4.027 20 0 CIADHO CCC(C)(C)C1CCC([NH2+][C@@H]2CCN3CCC[C@@H]3C2)CC1 ZINC000106868868 330341413 /nfs/dbraw/zinc/34/14/13/330341413.db2.gz VAMGYFCPEQSFED-OPQOLIRYSA-N 1 3 292.511 4.198 20 0 CIADHO C[C@@H](CC[NH2+]C1CCN(C(C)(C)C)CC1)CC(C)(C)C ZINC000443191159 330796265 /nfs/dbraw/zinc/79/62/65/330796265.db2.gz FQKQUWKHQQTECF-HNNXBMFYSA-N 1 3 282.516 4.301 20 0 CIADHO C[C@@H]1CCC[C@@H]1C[NH2+]C1CCN([C@@H]2CCCC[C@H]2C)CC1 ZINC000467452255 331420171 /nfs/dbraw/zinc/42/01/71/331420171.db2.gz DHJZKIKHNHBUCR-YWTNHNAXSA-N 1 3 292.511 4.055 20 0 CIADHO CC(C)(C)N1CCC([NH2+]CCC2=CCCCCC2)CC1 ZINC000467544760 331421614 /nfs/dbraw/zinc/42/16/14/331421614.db2.gz XXTFXHZJVQNBOA-UHFFFAOYSA-N 1 3 278.484 4.120 20 0 CIADHO CC(C)N(CCC[NH2+][C@@H]1CCC[C@H]1CCCF)C(C)C ZINC000510701629 332912457 /nfs/dbraw/zinc/91/24/57/332912457.db2.gz LAAFSDZMJBPSLV-DLBZAZTESA-N 1 3 286.479 4.003 20 0 CIADHO CCC[NH+]1CCC(CN[C@@H](C)c2ccccc2Cl)CC1 ZINC000482501880 331835577 /nfs/dbraw/zinc/83/55/77/331835577.db2.gz CKBNLTPDISGNFB-AWEZNQCLSA-N 1 3 294.870 4.113 20 0 CIADHO CCCCc1ccc([C@H](C)N[C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000224107053 333216878 /nfs/dbraw/zinc/21/68/78/333216878.db2.gz NOYOPTSKXFZMEH-TXPKVOOTSA-N 1 3 288.479 4.163 20 0 CIADHO CCCCc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1 ZINC000224107053 333216879 /nfs/dbraw/zinc/21/68/79/333216879.db2.gz NOYOPTSKXFZMEH-TXPKVOOTSA-N 1 3 288.479 4.163 20 0 CIADHO CC(C)N(C)CCC[NH2+][C@@H](C)c1ccc2ccccc2c1 ZINC000226312814 333256356 /nfs/dbraw/zinc/25/63/56/333256356.db2.gz XRSQNWYDGNQVOC-INIZCTEOSA-N 1 3 284.447 4.221 20 0 CIADHO CCN(C)C[C@H]1CC[N@@H+]([C@H](C)c2ccc3ccccc3c2)C1 ZINC000245441034 334193857 /nfs/dbraw/zinc/19/38/57/334193857.db2.gz GYVWBESWELYPHR-IAGOWNOFSA-N 1 3 296.458 4.174 20 0 CIADHO CCN(C)C[C@H]1CC[N@H+]([C@H](C)c2ccc3ccccc3c2)C1 ZINC000245441034 334193859 /nfs/dbraw/zinc/19/38/59/334193859.db2.gz GYVWBESWELYPHR-IAGOWNOFSA-N 1 3 296.458 4.174 20 0 CIADHO C[C@H]([NH2+][C@@H]1C=CCCCCC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000549932029 334209592 /nfs/dbraw/zinc/20/95/92/334209592.db2.gz OSRWHVRJOHFDRL-RCCFBDPRSA-N 1 3 290.495 4.118 20 0 CIADHO C[C@H](N[C@@H]1C=CCCCCC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000549932029 334209593 /nfs/dbraw/zinc/20/95/93/334209593.db2.gz OSRWHVRJOHFDRL-RCCFBDPRSA-N 1 3 290.495 4.118 20 0 CIADHO C[C@H](N[C@@H]1C=CCCCCC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000549932029 334209594 /nfs/dbraw/zinc/20/95/94/334209594.db2.gz OSRWHVRJOHFDRL-RCCFBDPRSA-N 1 3 290.495 4.118 20 0 CIADHO C[C@H]([NH2+][C@H]1C=CCCCCC1)[C@@H]1CCCN(C2CCC2)C1 ZINC000549932027 334209647 /nfs/dbraw/zinc/20/96/47/334209647.db2.gz OSRWHVRJOHFDRL-KSZLIROESA-N 1 3 290.495 4.118 20 0 CIADHO C[C@H](N[C@H]1C=CCCCCC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000549932027 334209649 /nfs/dbraw/zinc/20/96/49/334209649.db2.gz OSRWHVRJOHFDRL-KSZLIROESA-N 1 3 290.495 4.118 20 0 CIADHO C[C@H](N[C@H]1C=CCCCCC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000549932027 334209650 /nfs/dbraw/zinc/20/96/50/334209650.db2.gz OSRWHVRJOHFDRL-KSZLIROESA-N 1 3 290.495 4.118 20 0 CIADHO CC[C@@H]([NH2+]C[C@@H]1CCCN(CC(C)C)C1)c1cccs1 ZINC000090585212 334364298 /nfs/dbraw/zinc/36/42/98/334364298.db2.gz CSEDRMSEVWGWDZ-JKSUJKDBSA-N 1 3 294.508 4.157 20 0 CIADHO CC(C)(C)C1CCC(C[NH2+][C@@H]2CCN3CCC[C@H]3C2)CC1 ZINC000252729898 334387618 /nfs/dbraw/zinc/38/76/18/334387618.db2.gz IUDHIJFGSJNLFH-HIEASXQVSA-N 1 3 292.511 4.055 20 0 CIADHO C[C@@H]1CCCC[C@H]1C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000568915773 334846551 /nfs/dbraw/zinc/84/65/51/334846551.db2.gz DBAFQIFEGCNKCS-SJORKVTESA-N 1 3 292.511 4.199 20 0 CIADHO CC(C)C[C@H](C)C[NH2+]C1CCN(C2CCCCC2)CC1 ZINC000572763325 334876388 /nfs/dbraw/zinc/87/63/88/334876388.db2.gz JJWSTEYOZFRMNT-INIZCTEOSA-N 1 3 280.500 4.055 20 0 CIADHO CC[C@@H]([NH2+]CCCN1CCCC[C@@H]1C)c1ccsc1 ZINC000382129479 336082150 /nfs/dbraw/zinc/08/21/50/336082150.db2.gz OJFOXQUNPGGOQS-GOEBONIOSA-N 1 3 280.481 4.053 20 0 CIADHO