smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCN(C)c1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000160466066 1021881240 /nfs/dbraw/zinc/88/12/40/1021881240.db2.gz MBSSXGOAINIPQT-QGZVFWFLSA-N 2 0 329.532 4.200 20 10 EICDRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(N2CCCCCC2)cc1 ZINC000158186542 1026556238 /nfs/dbraw/zinc/55/62/38/1026556238.db2.gz IJMADYJRUCMWKC-RBUKOAKNSA-N 2 0 329.532 4.059 20 10 EICDRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000766192204 1044398994 /nfs/dbraw/zinc/39/89/94/1044398994.db2.gz DHIGJBWYUITCNQ-LJQANCHMSA-N 2 0 343.559 4.450 20 10 EICDRP Cc1cc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c(C)n1-c1cccc(C)c1 ZINC000915683212 1045447997 /nfs/dbraw/zinc/44/79/97/1045447997.db2.gz PDZIYIFKXAZKBO-SFTDATJTSA-N 2 0 337.511 4.119 20 10 EICDRP Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]CCC[NH+]1CCCC1 ZINC000815555361 1048505577 /nfs/dbraw/zinc/50/55/77/1048505577.db2.gz XKPAXCSSRNBPQU-NRFANRHFSA-N 2 0 338.495 4.142 20 10 EICDRP CSC1(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)CC[NH+](C)CC1 ZINC000810252957 1048729383 /nfs/dbraw/zinc/72/93/83/1048729383.db2.gz XKYSTRQFHZYWMI-HNNXBMFYSA-N 2 0 344.524 4.023 20 10 EICDRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2cc(Br)ccc2O)cc1 ZINC000817963794 1049069640 /nfs/dbraw/zinc/06/96/40/1049069640.db2.gz VBFLNWYQQPGFPL-VXGBXAGGSA-N 2 0 349.272 4.025 20 10 EICDRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000817985016 1049080246 /nfs/dbraw/zinc/08/02/46/1049080246.db2.gz FNJJSHTVNGUJOF-IEBWSBKVSA-N 2 0 327.516 4.002 20 10 EICDRP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc(N3CCCCC3)cc2)CC1(C)C ZINC001171620187 1049767118 /nfs/dbraw/zinc/76/71/18/1049767118.db2.gz XWCAFACYHLVGAO-UHFFFAOYSA-N 2 0 343.559 4.418 20 10 EICDRP COc1ccc(O)c(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)c1 ZINC000823871288 1049883194 /nfs/dbraw/zinc/88/31/94/1049883194.db2.gz FZOBCOXBKKODQU-UHFFFAOYSA-N 2 0 348.531 4.170 20 10 EICDRP CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CCN2C2CCCCCC2)cc1 ZINC001179386100 1050686534 /nfs/dbraw/zinc/68/65/34/1050686534.db2.gz HJWMHLHTIQSRMQ-VQKOGROQSA-N 2 0 341.543 4.153 20 10 EICDRP CCc1cccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)c1O ZINC001180030975 1050859802 /nfs/dbraw/zinc/85/98/02/1050859802.db2.gz RTOCFUXICHEURV-MSOLQXFVSA-N 2 0 330.516 4.041 20 10 EICDRP CCCN(c1ccc(C[NH3+])cc1)C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1 ZINC001181444869 1051225442 /nfs/dbraw/zinc/22/54/42/1051225442.db2.gz HRNTZMWSLVZWRS-GCJKJVERSA-N 2 0 343.559 4.405 20 10 EICDRP CCCN(c1ccc(C[NH3+])cc1)C1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1 ZINC001181444872 1051227034 /nfs/dbraw/zinc/22/70/34/1051227034.db2.gz HRNTZMWSLVZWRS-XMSQKQJNSA-N 2 0 343.559 4.405 20 10 EICDRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc2ccccc2c1O ZINC000853240639 1053657836 /nfs/dbraw/zinc/65/78/36/1053657836.db2.gz PTGKTYFXBASQFC-FUHWJXTLSA-N 2 0 338.495 4.318 20 10 EICDRP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc2ccccc2c1O ZINC000873235812 1054511364 /nfs/dbraw/zinc/51/13/64/1054511364.db2.gz RFQXVIPXZSVVQC-HNNXBMFYSA-N 2 0 332.447 4.042 20 10 EICDRP CCN(CC)c1ccc(C[NH2+]CC2CC[NH+](CCC(C)C)CC2)cc1 ZINC001200872119 1054562676 /nfs/dbraw/zinc/56/26/76/1054562676.db2.gz JBROWWAWAYZIMK-UHFFFAOYSA-N 2 0 345.575 4.381 20 10 EICDRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000743388163 1058969967 /nfs/dbraw/zinc/96/99/67/1058969967.db2.gz NSXMOQRYDACZBX-QGZVFWFLSA-N 2 0 332.532 4.162 20 10 EICDRP Cc1cc(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000746382963 1060263218 /nfs/dbraw/zinc/26/32/18/1060263218.db2.gz QELJXBZNGHAELT-GOSISDBHSA-N 2 0 344.543 4.162 20 10 EICDRP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311038624 1022825433 /nfs/dbraw/zinc/82/54/33/1022825433.db2.gz DSSMFDLBNLQJJP-RYRKJORJSA-N 2 0 342.458 4.093 20 10 EICDRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1cc(F)ccc1O ZINC000311222991 1023005836 /nfs/dbraw/zinc/00/58/36/1023005836.db2.gz VSSLZPKTRBHDSV-AEFFLSMTSA-N 2 0 342.458 4.094 20 10 EICDRP CC[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(F)cc1[O-] ZINC000796684461 1023895065 /nfs/dbraw/zinc/89/50/65/1023895065.db2.gz UZTHGPIQQBKZFV-FQEVSTJZSA-N 2 0 342.458 4.368 20 10 EICDRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001167825982 1025616933 /nfs/dbraw/zinc/61/69/33/1025616933.db2.gz LYAIXVVZGLUWOU-IBGZPJMESA-N 2 0 331.548 4.229 20 10 EICDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N3CCCCC3)c(C)c2)[C@@H](C)C1 ZINC001167686136 1030995830 /nfs/dbraw/zinc/99/58/30/1030995830.db2.gz NUIJLGBUICNMJA-PZJWPPBQSA-N 2 0 343.559 4.147 20 10 EICDRP C[NH+](C)CC[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)C(C)(C)C ZINC000734849866 1044701587 /nfs/dbraw/zinc/70/15/87/1044701587.db2.gz QMGYPXDJVAPWGI-HXUWFJFHSA-N 2 0 331.548 4.133 20 10 EICDRP CC[NH+](CC)CC1CC[NH+](Cc2cc(C(C)C)c(C)cc2O)CC1 ZINC000738071580 1045031651 /nfs/dbraw/zinc/03/16/51/1045031651.db2.gz SBXUKFOHLWUYHG-UHFFFAOYSA-N 2 0 332.532 4.378 20 10 EICDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(-c3ccccc3)ccc2O)[C@H](C)C1 ZINC000769482760 1045970092 /nfs/dbraw/zinc/97/00/92/1045970092.db2.gz DYWYWNIQRSLXSU-DYESRHJHSA-N 2 0 338.495 4.221 20 10 EICDRP Cc1cc(O)c(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1C(C)C ZINC000772828681 1046163139 /nfs/dbraw/zinc/16/31/39/1046163139.db2.gz PFAGSLWRNNNNGB-DYESRHJHSA-N 2 0 342.527 4.273 20 10 EICDRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000844924433 1048549999 /nfs/dbraw/zinc/54/99/99/1048549999.db2.gz LMJGCHIBVLICHI-GOSISDBHSA-N 2 0 337.511 4.247 20 10 EICDRP COc1cccc([C@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1O ZINC000846141492 1048830688 /nfs/dbraw/zinc/83/06/88/1048830688.db2.gz KFAAMTHNZYXZSI-INIZCTEOSA-N 2 0 342.483 4.092 20 10 EICDRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cc(Br)ccc2O)cc1 ZINC000817963791 1049068885 /nfs/dbraw/zinc/06/88/85/1049068885.db2.gz VBFLNWYQQPGFPL-NEPJUHHUSA-N 2 0 349.272 4.025 20 10 EICDRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(N2CCCCCC2)cc1 ZINC000817965035 1049073282 /nfs/dbraw/zinc/07/32/82/1049073282.db2.gz NUQNJWOGTCTURM-GOSISDBHSA-N 2 0 329.532 4.107 20 10 EICDRP CCN(C)c1ccc([C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000817981295 1049077266 /nfs/dbraw/zinc/07/72/66/1049077266.db2.gz IQELDLFYGJRSJA-LAUBAEHRSA-N 2 0 325.500 4.274 20 10 EICDRP Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000817982177 1049077907 /nfs/dbraw/zinc/07/79/07/1049077907.db2.gz ZAPNKWYWRHCGQK-TZIWHRDSSA-N 2 0 338.495 4.188 20 10 EICDRP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817985276 1049080004 /nfs/dbraw/zinc/08/00/04/1049080004.db2.gz IURIMUAOTWEWTC-FUHWJXTLSA-N 2 0 345.506 4.141 20 10 EICDRP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001178528063 1050490887 /nfs/dbraw/zinc/49/08/87/1050490887.db2.gz IGTKLYXWNNXRIN-UHFFFAOYSA-N 2 0 343.559 4.421 20 10 EICDRP CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CCN2C2CCCCCC2)cc1 ZINC001179386098 1050687465 /nfs/dbraw/zinc/68/74/65/1050687465.db2.gz HJWMHLHTIQSRMQ-KOIKXXGWSA-N 2 0 341.543 4.153 20 10 EICDRP CCCC[N@H+](C)CC1CC[NH+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC001180124656 1050892782 /nfs/dbraw/zinc/89/27/82/1050892782.db2.gz KBYYQPIMFUIKBK-FPLPWBNLSA-N 2 0 343.559 4.210 20 10 EICDRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2[O-])C1 ZINC000774160787 1051488955 /nfs/dbraw/zinc/48/89/55/1051488955.db2.gz BDMWMNYXOOHWDL-STQMWFEESA-N 2 0 345.314 4.470 20 10 EICDRP CC[C@H]([NH2+]C1CC[NH+](CC2CCCCC2)CC1)c1ccccc1O ZINC000775497426 1051620347 /nfs/dbraw/zinc/62/03/47/1051620347.db2.gz QHEKMAGKXLMPRH-FQEVSTJZSA-N 2 0 330.516 4.478 20 10 EICDRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc2ccccc2c1O ZINC000853240641 1053657590 /nfs/dbraw/zinc/65/75/90/1053657590.db2.gz PTGKTYFXBASQFC-WMZOPIPTSA-N 2 0 338.495 4.318 20 10 EICDRP C[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1cc(F)ccc1O ZINC000186165190 1054057006 /nfs/dbraw/zinc/05/70/06/1054057006.db2.gz XOTCZYJDSMAUHC-ZLPCBKJTSA-N 2 0 334.479 4.225 20 10 EICDRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(N2CCCCC2)cc1 ZINC000125281205 1054761852 /nfs/dbraw/zinc/76/18/52/1054761852.db2.gz QWQDFQPSGOOKHG-GOSISDBHSA-N 2 0 329.532 4.059 20 10 EICDRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000765769046 1054834146 /nfs/dbraw/zinc/83/41/46/1054834146.db2.gz QEJBIQZLBWOFSX-IBGZPJMESA-N 2 0 343.559 4.450 20 10 EICDRP Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)c1 ZINC000379616839 1059607679 /nfs/dbraw/zinc/60/76/79/1059607679.db2.gz CZNJSIYIEVTEOP-ZWKOTPCHSA-N 2 0 326.484 4.262 20 10 EICDRP Cc1ccc([C@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)c(O)c1 ZINC000379627296 1059648728 /nfs/dbraw/zinc/64/87/28/1059648728.db2.gz HUAXTOVWLJUSJH-MSOLQXFVSA-N 2 0 326.484 4.262 20 10 EICDRP CC(C)[NH+]1CCC([NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000180403683 1022636667 /nfs/dbraw/zinc/63/66/67/1022636667.db2.gz RJANWXPUFFNJLK-GOSISDBHSA-N 2 0 329.532 4.200 20 10 EICDRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000310963871 1022743280 /nfs/dbraw/zinc/74/32/80/1022743280.db2.gz BJISQJOQIZGYLG-UYAOXDASSA-N 2 0 338.495 4.345 20 10 EICDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000176981411 1030823491 /nfs/dbraw/zinc/82/34/91/1030823491.db2.gz OXGZZNKPZZAIQA-OAHLLOKOSA-N 2 0 330.447 4.224 20 10 EICDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N3CCCCC3)c(C)c2)[C@H](C)C1 ZINC001167686137 1030998417 /nfs/dbraw/zinc/99/84/17/1030998417.db2.gz NUIJLGBUICNMJA-TZIWHRDSSA-N 2 0 343.559 4.147 20 10 EICDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+]C1CCC([NH+](C)C)CC1 ZINC001168315905 1038824845 /nfs/dbraw/zinc/82/48/45/1038824845.db2.gz QJTYGQMCBLILFF-ALLBUHFWSA-N 2 0 330.516 4.095 20 10 EICDRP C[C@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000324057971 1041819253 /nfs/dbraw/zinc/81/92/53/1041819253.db2.gz WDJGBBAVDOLAJW-IBGZPJMESA-N 2 0 329.532 4.031 20 10 EICDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000733325572 1044188906 /nfs/dbraw/zinc/18/89/06/1044188906.db2.gz KGRPDYDDWJSXMS-UHFFFAOYSA-N 2 0 332.875 4.176 20 10 EICDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC000733325739 1044189031 /nfs/dbraw/zinc/18/90/31/1044189031.db2.gz RDTHCRRFHNSCDR-UHFFFAOYSA-N 2 0 343.490 4.022 20 10 EICDRP C[C@H]([NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1)c1ccccc1O ZINC001168023387 1044579866 /nfs/dbraw/zinc/57/98/66/1044579866.db2.gz VXOVCLHXSKLGSP-KURKYZTESA-N 2 0 338.495 4.484 20 10 EICDRP Cc1cc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c(C)n1-c1cccc(C)c1 ZINC000915683209 1045448120 /nfs/dbraw/zinc/44/81/20/1045448120.db2.gz PDZIYIFKXAZKBO-LEWJYISDSA-N 2 0 337.511 4.119 20 10 EICDRP COc1cccc(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)c1O ZINC000824383497 1047864840 /nfs/dbraw/zinc/86/48/40/1047864840.db2.gz ODZOTQZYHWEKMH-UHFFFAOYSA-N 2 0 348.531 4.170 20 10 EICDRP Oc1c(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc2ccccc21 ZINC000816594426 1048833157 /nfs/dbraw/zinc/83/31/57/1048833157.db2.gz CTLYIHSHUBKNNI-IBGZPJMESA-N 2 0 346.474 4.157 20 10 EICDRP Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)c1O ZINC000817984407 1049080203 /nfs/dbraw/zinc/08/02/03/1049080203.db2.gz XUYHSHCXQQEQJJ-KBXCAEBGSA-N 2 0 332.875 4.485 20 10 EICDRP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)c1ccc(N(C)C)cc1 ZINC000773074653 1049564938 /nfs/dbraw/zinc/56/49/38/1049564938.db2.gz GYQNUYMWLKFRTM-GHTZIAJQSA-N 2 0 331.548 4.161 20 10 EICDRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000324804419 1049785097 /nfs/dbraw/zinc/78/50/97/1049785097.db2.gz BAXBMUMUSISJAG-QGZVFWFLSA-N 2 0 326.484 4.393 20 10 EICDRP C[C@H]([NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C)c1ccccc1O ZINC000183563085 1051168499 /nfs/dbraw/zinc/16/84/99/1051168499.db2.gz LGPHDRHNUYFWMY-BZSNNMDCSA-N 2 0 338.495 4.199 20 10 EICDRP CC[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc(Cl)ccc1O ZINC000775488403 1051577457 /nfs/dbraw/zinc/57/74/57/1051577457.db2.gz SQWNWOPDYYEKLN-SFHVURJKSA-N 2 0 332.875 4.348 20 10 EICDRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc2c(cc1O)CCCC2 ZINC000184937130 1052320304 /nfs/dbraw/zinc/32/03/04/1052320304.db2.gz BPMRUBDRPXGMFJ-MRXNPFEDSA-N 2 0 338.495 4.183 20 10 EICDRP C[C@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(N2CCCCCC2)cc1 ZINC000764667090 1053259631 /nfs/dbraw/zinc/25/96/31/1053259631.db2.gz OWWKPIAKFXXLEO-IBGZPJMESA-N 2 0 329.532 4.204 20 10 EICDRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(C)cc1O ZINC000794819310 1053434093 /nfs/dbraw/zinc/43/40/93/1053434093.db2.gz UQHLJOPMNHZVLW-QKLQHJQFSA-N 2 0 330.516 4.394 20 10 EICDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000765082258 1053437730 /nfs/dbraw/zinc/43/77/30/1053437730.db2.gz SKUIRKUCFDSMQE-GOSISDBHSA-N 2 0 339.527 4.445 20 10 EICDRP CC[C@H]([NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1ccc(C)cc1O ZINC000842922767 1053684464 /nfs/dbraw/zinc/68/44/64/1053684464.db2.gz DALZXBUCDOKJBM-GIVPXCGWSA-N 2 0 338.495 4.087 20 10 EICDRP CC[N@@H+](Cc1cccc(C)c1O)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000775727507 1053697173 /nfs/dbraw/zinc/69/71/73/1053697173.db2.gz DZWQOPSOLIXWCU-HXUWFJFHSA-N 2 0 338.495 4.045 20 10 EICDRP C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc2ccccc2c1O ZINC000873235813 1054512770 /nfs/dbraw/zinc/51/27/70/1054512770.db2.gz RFQXVIPXZSVVQC-OAHLLOKOSA-N 2 0 332.447 4.042 20 10 EICDRP CC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(N3CCCCC3)c(F)c2)CC1 ZINC000765767742 1054782593 /nfs/dbraw/zinc/78/25/93/1054782593.db2.gz HFWUMPCKHNDACH-QGZVFWFLSA-N 2 0 347.522 4.199 20 10 EICDRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000765769048 1054834355 /nfs/dbraw/zinc/83/43/55/1054834355.db2.gz QEJBIQZLBWOFSX-LJQANCHMSA-N 2 0 343.559 4.450 20 10 EICDRP CC1CC[NH+](C2CCC([NH2+]Cc3ccc(N(C)C)c(F)c3)CC2)CC1 ZINC001201607931 1054863587 /nfs/dbraw/zinc/86/35/87/1054863587.db2.gz JOALFRCKYWZKJD-UHFFFAOYSA-N 2 0 347.522 4.024 20 10 EICDRP C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001201946484 1054962036 /nfs/dbraw/zinc/96/20/36/1054962036.db2.gz FESZYIKSGKQCQJ-QUCCMNQESA-N 2 0 341.543 4.029 20 10 EICDRP Cc1cccc(C[NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1O ZINC000776251836 1055057960 /nfs/dbraw/zinc/05/79/60/1055057960.db2.gz DLHXMIFIXDHADO-ICSRJNTNSA-N 2 0 338.495 4.091 20 10 EICDRP Oc1cccc(Cl)c1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000397511996 1020890675 /nfs/dbraw/zinc/89/06/75/1020890675.db2.gz ORWMQEKWCWQHIN-UHFFFAOYSA-N 2 0 344.886 4.047 20 10 EICDRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1ccccc1O ZINC000183495362 1022865914 /nfs/dbraw/zinc/86/59/14/1022865914.db2.gz RAJSCSIKNJWYTL-GOSISDBHSA-N 2 0 338.495 4.475 20 10 EICDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N3CCCCC3)c(C)c2)[C@H](C)C1 ZINC001167686134 1030999256 /nfs/dbraw/zinc/99/92/56/1030999256.db2.gz NUIJLGBUICNMJA-CTNGQTDRSA-N 2 0 343.559 4.147 20 10 EICDRP CC[N@H+](CCC1CC[NH+](Cc2ccc(N(C)C)cc2)CC1)CC1CC1 ZINC001168425136 1038864510 /nfs/dbraw/zinc/86/45/10/1038864510.db2.gz ZRMYVSSEXSGQEE-UHFFFAOYSA-N 2 0 343.559 4.087 20 10 EICDRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000769498014 1045993826 /nfs/dbraw/zinc/99/38/26/1045993826.db2.gz JLAINJKBECGMGI-UHFFFAOYSA-N 2 0 343.559 4.231 20 10 EICDRP C[NH+]1CCN(c2ccc(C[NH2+][C@H](CC3CC3)c3ccccc3)cc2)CC1 ZINC000771840031 1046499338 /nfs/dbraw/zinc/49/93/38/1046499338.db2.gz DBTPSFCXMLBVDI-HSZRJFAPSA-N 2 0 349.522 4.069 20 10 EICDRP CCCN(CCC)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000824989040 1048016015 /nfs/dbraw/zinc/01/60/15/1048016015.db2.gz YKOSDSNZMHTKRY-VCSGRIEYSA-N 2 0 329.532 4.028 20 10 EICDRP Cc1cc(O)c(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1Cl ZINC000825064163 1048028861 /nfs/dbraw/zinc/02/88/61/1048028861.db2.gz IXASTYBKKXOEHU-UHFFFAOYSA-N 2 0 344.886 4.240 20 10 EICDRP Cc1cc(O)c(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc1Cl ZINC000825421517 1048090390 /nfs/dbraw/zinc/09/03/90/1048090390.db2.gz BRKRXYCQFWOLRU-UHFFFAOYSA-N 2 0 344.886 4.240 20 10 EICDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2cccc(OC)c2O)c1 ZINC000846141599 1048830300 /nfs/dbraw/zinc/83/03/00/1048830300.db2.gz QXGIPPAPCWSEKZ-INIZCTEOSA-N 2 0 342.483 4.093 20 10 EICDRP C[C@@H]1C[C@H]([NH2+][C@@H](CCC[NH3+])c2ccccc2)c2c1c(F)ccc2O ZINC000817983247 1049076432 /nfs/dbraw/zinc/07/64/32/1049076432.db2.gz LDEPXRPLZWKFTG-COXVUDFISA-N 2 0 328.431 4.149 20 10 EICDRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cc2c(cc1O)CCCC2 ZINC000817982882 1049076602 /nfs/dbraw/zinc/07/66/02/1049076602.db2.gz IYVTWYZURDGGMU-IERDGZPVSA-N 2 0 338.495 4.402 20 10 EICDRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1ccccc1O ZINC000183418604 1051116327 /nfs/dbraw/zinc/11/63/27/1051116327.db2.gz GEBHYSDCBKLJKL-ROUUACIJSA-N 2 0 338.495 4.475 20 10 EICDRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc2c(cc1O)CCCC2 ZINC000184937099 1052319863 /nfs/dbraw/zinc/31/98/63/1052319863.db2.gz BPMRUBDRPXGMFJ-INIZCTEOSA-N 2 0 338.495 4.183 20 10 EICDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000185062275 1052388834 /nfs/dbraw/zinc/38/88/34/1052388834.db2.gz OISOSOLMZXNKFZ-KRWDZBQOSA-N 2 0 326.484 4.393 20 10 EICDRP Cc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)c1 ZINC000185192169 1052516708 /nfs/dbraw/zinc/51/67/08/1052516708.db2.gz IDFSNPNXKLRXNF-KRWDZBQOSA-N 2 0 326.484 4.392 20 10 EICDRP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCCC1)c1ccc2ccccc2c1O ZINC000325126355 1052984746 /nfs/dbraw/zinc/98/47/46/1052984746.db2.gz DAYPZMLTPZFYMW-DLBZAZTESA-N 2 0 326.484 4.318 20 10 EICDRP Cc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c(O)c1C ZINC000794829128 1053439581 /nfs/dbraw/zinc/43/95/81/1053439581.db2.gz STQUVLSVKQMRIY-AZUAARDMSA-N 2 0 338.495 4.182 20 10 EICDRP Cc1cccc(C[NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1O ZINC000776251837 1055059463 /nfs/dbraw/zinc/05/94/63/1055059463.db2.gz DLHXMIFIXDHADO-QUCCMNQESA-N 2 0 338.495 4.091 20 10 EICDRP Cc1ccc(O)c([C@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)c1 ZINC000379616835 1059609716 /nfs/dbraw/zinc/60/97/16/1059609716.db2.gz CZNJSIYIEVTEOP-MSOLQXFVSA-N 2 0 326.484 4.262 20 10 EICDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000310890155 1022581453 /nfs/dbraw/zinc/58/14/53/1022581453.db2.gz KHWGFWWBROGWSV-GCJKJVERSA-N 2 0 338.495 4.263 20 10 EICDRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000310963862 1022743513 /nfs/dbraw/zinc/74/35/13/1022743513.db2.gz BJISQJOQIZGYLG-ICSRJNTNSA-N 2 0 338.495 4.345 20 10 EICDRP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(O)c1 ZINC000311073411 1023544968 /nfs/dbraw/zinc/54/49/68/1023544968.db2.gz KNNOACVXAZUYKK-BJLQDIEVSA-N 2 0 338.495 4.262 20 10 EICDRP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(N2CCCCC2)cc1 ZINC000178257133 1023876136 /nfs/dbraw/zinc/87/61/36/1023876136.db2.gz XYPMGKIULBJQKA-SFHVURJKSA-N 2 0 341.543 4.202 20 10 EICDRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)C1 ZINC000163281469 1029986511 /nfs/dbraw/zinc/98/65/11/1029986511.db2.gz PYDNASLGUYXKOY-OALUTQOASA-N 2 0 329.532 4.059 20 10 EICDRP CC[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(C)cc1O ZINC000279990460 1035115693 /nfs/dbraw/zinc/11/56/93/1035115693.db2.gz FHNMLVTYKGBMDV-IBGZPJMESA-N 2 0 330.447 4.142 20 10 EICDRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000766192201 1044401246 /nfs/dbraw/zinc/40/12/46/1044401246.db2.gz DHIGJBWYUITCNQ-IBGZPJMESA-N 2 0 343.559 4.450 20 10 EICDRP C[C@@H]([NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1)c1ccccc1O ZINC001168030473 1044796276 /nfs/dbraw/zinc/79/62/76/1044796276.db2.gz VXOVCLHXSKLGSP-KZNAEPCWSA-N 2 0 338.495 4.484 20 10 EICDRP CC[NH+](CC)CC1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000738072052 1045033110 /nfs/dbraw/zinc/03/31/10/1045033110.db2.gz YQLHXUHWHSQFFR-UHFFFAOYSA-N 2 0 326.484 4.099 20 10 EICDRP CCCC[N@H+](C)CC1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000738066798 1045033820 /nfs/dbraw/zinc/03/38/20/1045033820.db2.gz FPFUKXSRLIEBAI-UHFFFAOYSA-N 2 0 340.511 4.489 20 10 EICDRP CCc1cc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000739876967 1045169031 /nfs/dbraw/zinc/16/90/31/1045169031.db2.gz WZMZXTXEJBKYOV-SFHVURJKSA-N 2 0 344.543 4.170 20 10 EICDRP Cc1cc(O)c(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1C(C)C ZINC000772828683 1046162989 /nfs/dbraw/zinc/16/29/89/1046162989.db2.gz PFAGSLWRNNNNGB-LAUBAEHRSA-N 2 0 342.527 4.273 20 10 EICDRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc(N2CCCCCC2)cc1 ZINC000844927427 1048552256 /nfs/dbraw/zinc/55/22/56/1048552256.db2.gz NIXRVGGYLUKQCS-SFHVURJKSA-N 2 0 329.532 4.107 20 10 EICDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](CC)c2ccc(C(F)(F)F)cc2O)C1 ZINC000810212445 1048682386 /nfs/dbraw/zinc/68/23/86/1048682386.db2.gz BCUAUCKZNUHZJU-CJNGLKHVSA-N 2 0 344.421 4.184 20 10 EICDRP CC[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1O ZINC000810235234 1048700396 /nfs/dbraw/zinc/70/03/96/1048700396.db2.gz NCJYUFDHSHIXNT-OAHLLOKOSA-N 2 0 344.421 4.184 20 10 EICDRP Oc1c(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)ccc2ccccc21 ZINC000816530330 1048824342 /nfs/dbraw/zinc/82/43/42/1048824342.db2.gz DQXUCNIKNWUILX-UHFFFAOYSA-N 2 0 346.474 4.431 20 10 EICDRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816534980 1048825275 /nfs/dbraw/zinc/82/52/75/1048825275.db2.gz BCTCLGYIFSTHPX-KRWDZBQOSA-N 2 0 326.484 4.290 20 10 EICDRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816534981 1048826242 /nfs/dbraw/zinc/82/62/42/1048826242.db2.gz BCTCLGYIFSTHPX-QGZVFWFLSA-N 2 0 326.484 4.290 20 10 EICDRP COc1cccc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c1O ZINC000846139910 1048830095 /nfs/dbraw/zinc/83/00/95/1048830095.db2.gz WPGQPVUFPZVTOR-INIZCTEOSA-N 2 0 342.483 4.092 20 10 EICDRP CC[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1O ZINC000817414364 1048963133 /nfs/dbraw/zinc/96/31/33/1048963133.db2.gz XIRBMINPFLZUAB-XUJLQICISA-N 2 0 344.421 4.325 20 10 EICDRP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1ccccc1O ZINC001171983389 1049838693 /nfs/dbraw/zinc/83/86/93/1049838693.db2.gz NPJNSUDQKJFVNZ-PKOBYXMFSA-N 2 0 338.495 4.486 20 10 EICDRP CC[NH+](CC)C1CCC([N@H+](CC)Cc2ccc(N(C)C)cc2)CC1 ZINC001173113884 1050311104 /nfs/dbraw/zinc/31/11/04/1050311104.db2.gz NUZQTVRWXQWPDD-UHFFFAOYSA-N 2 0 331.548 4.228 20 10 EICDRP CCc1cccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)c1O ZINC001180030982 1050859578 /nfs/dbraw/zinc/85/95/78/1050859578.db2.gz RTOCFUXICHEURV-QZTJIDSGSA-N 2 0 330.516 4.041 20 10 EICDRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(N(C)C)cc1 ZINC000183187028 1051015576 /nfs/dbraw/zinc/01/55/76/1051015576.db2.gz IEMXTAZIBGKHOU-JENIJYKNSA-N 2 0 329.532 4.056 20 10 EICDRP C[C@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)C[NH+]1CCCCC1 ZINC000325126358 1052984890 /nfs/dbraw/zinc/98/48/90/1052984890.db2.gz DAYPZMLTPZFYMW-SJORKVTESA-N 2 0 326.484 4.318 20 10 EICDRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(Cl)ccc1O ZINC000794827580 1053439711 /nfs/dbraw/zinc/43/97/11/1053439711.db2.gz KXMJLTBMFQSIDQ-WBVHZDCISA-N 2 0 344.886 4.218 20 10 EICDRP CC[N@@H+](Cc1cccc(C)c1O)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000775727506 1053696730 /nfs/dbraw/zinc/69/67/30/1053696730.db2.gz DZWQOPSOLIXWCU-FQEVSTJZSA-N 2 0 338.495 4.045 20 10 EICDRP Cc1ccc([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c(O)c1 ZINC000186165090 1054057157 /nfs/dbraw/zinc/05/71/57/1054057157.db2.gz BXAKIFSGBYPJEA-VIQWUECVSA-N 2 0 330.516 4.394 20 10 EICDRP CCN(C)c1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1 ZINC000123613921 1054211821 /nfs/dbraw/zinc/21/18/21/1054211821.db2.gz RBGYGUPKSSLMRP-KRWDZBQOSA-N 2 0 325.500 4.055 20 10 EICDRP Cc1cc(O)c(C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c(Cl)c1 ZINC001199320980 1054392822 /nfs/dbraw/zinc/39/28/22/1054392822.db2.gz SLCNHSFOWGKFEQ-IYBDPMFKSA-N 2 0 338.923 4.202 20 10 EICDRP C[C@H](c1ccccc1)[N@H+](CC[C@@H]1CCC[NH+]1C)Cc1ccccc1O ZINC000776002537 1054437599 /nfs/dbraw/zinc/43/75/99/1054437599.db2.gz FDLVKUNDHUMBEE-NQIIRXRSSA-N 2 0 338.495 4.440 20 10 EICDRP CCCN(CCC)c1ccc(C[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000742718222 1058754298 /nfs/dbraw/zinc/75/42/98/1058754298.db2.gz UVQQWMDLIFIVSJ-UHFFFAOYSA-N 2 0 343.559 4.420 20 10 EICDRP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc3oc4ccccc4c3cc2O)C1 ZINC000743399493 1058979608 /nfs/dbraw/zinc/97/96/08/1058979608.db2.gz MVQKFDJOEXUNSX-HNNXBMFYSA-N 2 0 338.451 4.065 20 10 EICDRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000310963857 1022743648 /nfs/dbraw/zinc/74/36/48/1022743648.db2.gz BJISQJOQIZGYLG-AZUAARDMSA-N 2 0 338.495 4.345 20 10 EICDRP CCN(CC)c1ccc(C[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000727643783 1043254852 /nfs/dbraw/zinc/25/48/52/1043254852.db2.gz KXESUVPNEVHCAO-LJQANCHMSA-N 2 0 331.548 4.135 20 10 EICDRP Cc1cc(O)c(C[NH+]2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)cc1C ZINC000738107822 1045042174 /nfs/dbraw/zinc/04/21/74/1045042174.db2.gz OQKFPQSDIKYFEG-MOPGFXCFSA-N 2 0 330.516 4.095 20 10 EICDRP Cc1cc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c(O)c(C(C)(C)C)c1 ZINC000738273074 1045046537 /nfs/dbraw/zinc/04/65/37/1045046537.db2.gz WFWVXYIYFYCZPX-IBGZPJMESA-N 2 0 344.543 4.448 20 10 EICDRP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1ccc2ccccc2c1O ZINC000790749523 1045571952 /nfs/dbraw/zinc/57/19/52/1045571952.db2.gz HNEQRHKYGHRZMX-INIZCTEOSA-N 2 0 326.484 4.318 20 10 EICDRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1cc2c(cc1O)CCCC2 ZINC000815647473 1048570944 /nfs/dbraw/zinc/57/09/44/1048570944.db2.gz LJTFYQXQWGFKBD-KRWDZBQOSA-N 2 0 330.516 4.188 20 10 EICDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](CC)c2ccc(C(F)(F)F)cc2O)C1 ZINC000810212446 1048681899 /nfs/dbraw/zinc/68/18/99/1048681899.db2.gz BCUAUCKZNUHZJU-CZUORRHYSA-N 2 0 344.421 4.184 20 10 EICDRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816535407 1048825953 /nfs/dbraw/zinc/82/59/53/1048825953.db2.gz NTIVULSLXMEHGO-QGZVFWFLSA-N 2 0 326.484 4.147 20 10 EICDRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(N2CCCCC2)cc1 ZINC000817968492 1049071375 /nfs/dbraw/zinc/07/13/75/1049071375.db2.gz KFIDYDAULMGMJH-QGZVFWFLSA-N 2 0 335.495 4.131 20 10 EICDRP Cc1cccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)c1O ZINC001171976517 1049836927 /nfs/dbraw/zinc/83/69/27/1049836927.db2.gz SHAFZBIGHPOAMN-HXUWFJFHSA-N 2 0 338.495 4.233 20 10 EICDRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(N(C)C3CCCCC3)cc2)CC[N@@H+]1C ZINC000765446018 1053550720 /nfs/dbraw/zinc/55/07/20/1053550720.db2.gz PEYOMIRFWBLMGB-HKUYNNGSSA-N 2 0 329.532 4.028 20 10 EICDRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc2ccccc2c1O ZINC000853240640 1053658129 /nfs/dbraw/zinc/65/81/29/1053658129.db2.gz PTGKTYFXBASQFC-SJLPKXTDSA-N 2 0 338.495 4.318 20 10 EICDRP Cc1ccc(O)c([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC000186164938 1054054876 /nfs/dbraw/zinc/05/48/76/1054054876.db2.gz LKWWUWMOFQHMKY-VIQWUECVSA-N 2 0 330.516 4.394 20 10 EICDRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000123919100 1054329083 /nfs/dbraw/zinc/32/90/83/1054329083.db2.gz QVHGCQQUVLEEBW-KRWDZBQOSA-N 2 0 325.500 4.055 20 10 EICDRP Cc1ccc([C@@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)c(O)c1 ZINC000379627305 1059648469 /nfs/dbraw/zinc/64/84/69/1059648469.db2.gz HUAXTOVWLJUSJH-ZWKOTPCHSA-N 2 0 326.484 4.262 20 10 EICDRP C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183187061 1022850294 /nfs/dbraw/zinc/85/02/94/1022850294.db2.gz IEMXTAZIBGKHOU-YQVWRLOYSA-N 2 0 329.532 4.056 20 10 EICDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000161715761 1028749865 /nfs/dbraw/zinc/74/98/65/1028749865.db2.gz ZFRAYGBPSBKGGE-GOSISDBHSA-N 2 0 339.527 4.444 20 10 EICDRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)c(O)c1C ZINC000273609207 1037523936 /nfs/dbraw/zinc/52/39/36/1037523936.db2.gz VGXBECNYAMLDFC-OAHLLOKOSA-N 2 0 330.447 4.061 20 10 EICDRP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(O)c1 ZINC000311073427 1041252013 /nfs/dbraw/zinc/25/20/13/1041252013.db2.gz KNNOACVXAZUYKK-WSTZPKSXSA-N 2 0 338.495 4.262 20 10 EICDRP CCN(CC)c1ccc(C[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000727643572 1043255364 /nfs/dbraw/zinc/25/53/64/1043255364.db2.gz CAUSHEXFNUMJFG-LJQANCHMSA-N 2 0 331.548 4.277 20 10 EICDRP CCN(CC)c1ccc(C[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000727643782 1043255808 /nfs/dbraw/zinc/25/58/08/1043255808.db2.gz KXESUVPNEVHCAO-IBGZPJMESA-N 2 0 331.548 4.135 20 10 EICDRP Cc1cc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c(O)c(C(C)(C)C)c1 ZINC000738273076 1045049431 /nfs/dbraw/zinc/04/94/31/1045049431.db2.gz WFWVXYIYFYCZPX-LJQANCHMSA-N 2 0 344.543 4.448 20 10 EICDRP CCc1cc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000739876963 1045169497 /nfs/dbraw/zinc/16/94/97/1045169497.db2.gz WZMZXTXEJBKYOV-GOSISDBHSA-N 2 0 344.543 4.170 20 10 EICDRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000768925305 1045861556 /nfs/dbraw/zinc/86/15/56/1045861556.db2.gz BFGIFERWWNWRTM-UHFFFAOYSA-N 2 0 343.559 4.229 20 10 EICDRP Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c(O)c1 ZINC000788509124 1047209321 /nfs/dbraw/zinc/20/93/21/1047209321.db2.gz ZHDUUMCJEKFOCC-GOSISDBHSA-N 2 0 338.495 4.456 20 10 EICDRP CC[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(N(C)C)cc1 ZINC000817980779 1049077394 /nfs/dbraw/zinc/07/73/94/1049077394.db2.gz DJUDTTUAXUZAPL-NHCUHLMSSA-N 2 0 325.500 4.274 20 10 EICDRP Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)c1O ZINC000817984414 1049079939 /nfs/dbraw/zinc/07/99/39/1049079939.db2.gz XUYHSHCXQQEQJJ-KSSFIOAISA-N 2 0 332.875 4.485 20 10 EICDRP C[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc(N(C)C)cc1 ZINC000773098139 1049580341 /nfs/dbraw/zinc/58/03/41/1049580341.db2.gz KJELOHVCVKKYOH-NLMOZGTASA-N 2 0 343.559 4.446 20 10 EICDRP CC[N@H+](Cc1ccc(N(C)C)cc1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171641290 1049779998 /nfs/dbraw/zinc/77/99/98/1049779998.db2.gz ODWQWUMBFDCPML-UHFFFAOYSA-N 2 0 331.548 4.226 20 10 EICDRP Cc1c2ccccc2n(C)c1C[NH2+]C1CCC(C)([NH+]2CCCC2)CC1 ZINC001179610863 1050730820 /nfs/dbraw/zinc/73/08/20/1050730820.db2.gz ALINOUZRISSQBM-UHFFFAOYSA-N 2 0 339.527 4.373 20 10 EICDRP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)c1ccc(N2CCCCC2)cc1 ZINC000764663225 1053249944 /nfs/dbraw/zinc/24/99/44/1053249944.db2.gz QTKIXKQDZWJPMQ-LJQANCHMSA-N 2 0 329.532 4.204 20 10 EICDRP CC[C@@H]([NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1ccc(C)cc1O ZINC000842922769 1053683983 /nfs/dbraw/zinc/68/39/83/1053683983.db2.gz DALZXBUCDOKJBM-HLAWJBBLSA-N 2 0 338.495 4.087 20 10 EICDRP CC[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(N(C)C)cc1 ZINC000123657797 1054218961 /nfs/dbraw/zinc/21/89/61/1054218961.db2.gz HLKMITVVFAVXBG-NRFANRHFSA-N 2 0 325.500 4.055 20 10 EICDRP CC[C@@H]([NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1)c1ccccc1O ZINC000379624598 1059617310 /nfs/dbraw/zinc/61/73/10/1059617310.db2.gz DLQDSYZXABMXJC-YLJYHZDGSA-N 2 0 326.484 4.344 20 10 EICDRP Cc1ccc(O)c(C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)c1 ZINC000311203216 1023001988 /nfs/dbraw/zinc/00/19/88/1023001988.db2.gz ILHRHRSHLCMULY-FQEVSTJZSA-N 2 0 338.495 4.093 20 10 EICDRP Oc1cc2ccccc2cc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167972792 1026131786 /nfs/dbraw/zinc/13/17/86/1026131786.db2.gz BQVAQMAAJSLPGL-SEJPIABJSA-N 2 0 336.479 4.040 20 10 EICDRP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccc2ccccc2c1O ZINC000323861764 1035719254 /nfs/dbraw/zinc/71/92/54/1035719254.db2.gz PAMUCUUFSBLOCP-SJORKVTESA-N 2 0 326.484 4.461 20 10 EICDRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000324057972 1041819050 /nfs/dbraw/zinc/81/90/50/1041819050.db2.gz WDJGBBAVDOLAJW-LJQANCHMSA-N 2 0 329.532 4.031 20 10 EICDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(-c3ccccc3)ccc2O)[C@@H](C)C1 ZINC000769482767 1045969887 /nfs/dbraw/zinc/96/98/87/1045969887.db2.gz DYWYWNIQRSLXSU-UWJYYQICSA-N 2 0 338.495 4.221 20 10 EICDRP Oc1ccc(-c2ccccc2)cc1C[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000793337738 1046210187 /nfs/dbraw/zinc/21/01/87/1046210187.db2.gz TXGMOQDWAHFHFW-UHFFFAOYSA-N 2 0 336.479 4.166 20 10 EICDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cc2ccccc2o1 ZINC000785556800 1046713364 /nfs/dbraw/zinc/71/33/64/1046713364.db2.gz FGRGWYQTAADDRK-QGZVFWFLSA-N 2 0 349.478 4.035 20 10 EICDRP Oc1ccc(-c2ccccc2)cc1C[NH+]1CCC([NH2+]C2CCC2)CC1 ZINC000897981973 1047526829 /nfs/dbraw/zinc/52/68/29/1047526829.db2.gz SYOBHLPRCOSNSI-UHFFFAOYSA-N 2 0 336.479 4.166 20 10 EICDRP Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]CCC[NH+]1CCCC1 ZINC000815555362 1048504987 /nfs/dbraw/zinc/50/49/87/1048504987.db2.gz XKPAXCSSRNBPQU-OAQYLSRUSA-N 2 0 338.495 4.142 20 10 EICDRP Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]CCC1CC[NH2+]CC1 ZINC000844926555 1048548945 /nfs/dbraw/zinc/54/89/45/1048548945.db2.gz WIXBJNUQLPUJOQ-NRFANRHFSA-N 2 0 338.495 4.045 20 10 EICDRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816535406 1048825471 /nfs/dbraw/zinc/82/54/71/1048825471.db2.gz NTIVULSLXMEHGO-KRWDZBQOSA-N 2 0 326.484 4.147 20 10 EICDRP Oc1c(C[NH2+]C2CC[NH+](CC3CCCC3)CC2)ccc2ccccc21 ZINC000816543692 1048826696 /nfs/dbraw/zinc/82/66/96/1048826696.db2.gz KQVPPJRDHIBSGT-UHFFFAOYSA-N 2 0 338.495 4.290 20 10 EICDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846136997 1048829651 /nfs/dbraw/zinc/82/96/51/1048829651.db2.gz PLAMZXOCQNZNOH-MRXNPFEDSA-N 2 0 342.483 4.093 20 10 EICDRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816557793 1048834321 /nfs/dbraw/zinc/83/43/21/1048834321.db2.gz BKWQSPHPWVUWPX-KRWDZBQOSA-N 2 0 326.484 4.003 20 10 EICDRP C[C@H](CCCC[NH3+])[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000817975746 1049075555 /nfs/dbraw/zinc/07/55/55/1049075555.db2.gz ATWCWMBUVCBNTO-XLIONFOSSA-N 2 0 326.484 4.173 20 10 EICDRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(C(F)(F)F)cc1O ZINC000817984942 1049078072 /nfs/dbraw/zinc/07/80/72/1049078072.db2.gz CREFYLTWQPJZQD-HIFRSBDPSA-N 2 0 342.405 4.126 20 10 EICDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cc1 ZINC000773076559 1049567357 /nfs/dbraw/zinc/56/73/57/1049567357.db2.gz ODOMQSSITKGDTM-RBUKOAKNSA-N 2 0 331.548 4.161 20 10 EICDRP C[C@@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1ccccc1O ZINC001171975663 1049836787 /nfs/dbraw/zinc/83/67/87/1049836787.db2.gz NPJNSUDQKJFVNZ-IEBWSBKVSA-N 2 0 338.495 4.486 20 10 EICDRP CC[N@H+](CCC[NH2+]C/C=C/c1ccc(N(C)C)cc1)C1CCCCC1 ZINC001179090691 1050629762 /nfs/dbraw/zinc/62/97/62/1050629762.db2.gz IBFAXHVDJXCKBO-CSKARUKUSA-N 2 0 343.559 4.400 20 10 EICDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N3CCCCC3)c(C)c2)C[C@@H]1C ZINC001191418185 1051453095 /nfs/dbraw/zinc/45/30/95/1051453095.db2.gz SDYYPGLDVCZTJY-PZJWPPBQSA-N 2 0 343.559 4.290 20 10 EICDRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2[O-])C1 ZINC000774160785 1051487897 /nfs/dbraw/zinc/48/78/97/1051487897.db2.gz BDMWMNYXOOHWDL-OLZOCXBDSA-N 2 0 345.314 4.470 20 10 EICDRP CC(C)C[NH+]1CCC([NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000764828178 1053319494 /nfs/dbraw/zinc/31/94/94/1053319494.db2.gz QBMLPMOTZWHHQB-IBGZPJMESA-N 2 0 343.559 4.448 20 10 EICDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)C1 ZINC000765292678 1053498949 /nfs/dbraw/zinc/49/89/49/1053498949.db2.gz WYMVORXCVBHMQA-VQTJNVASSA-N 2 0 343.559 4.450 20 10 EICDRP Cc1cccc(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)c1O ZINC000775678381 1053555345 /nfs/dbraw/zinc/55/53/45/1053555345.db2.gz CJJKJANRRYPMAI-UHFFFAOYSA-N 2 0 338.495 4.045 20 10 EICDRP Cc1cccc(C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)c1O ZINC000775734457 1053710916 /nfs/dbraw/zinc/71/09/16/1053710916.db2.gz QHWDEIDIZAKAAE-GOSISDBHSA-N 2 0 330.516 4.177 20 10 EICDRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(N(C)C)cc1 ZINC000123016762 1054076926 /nfs/dbraw/zinc/07/69/26/1054076926.db2.gz KTURABOMDZCDJG-SFHVURJKSA-N 2 0 337.511 4.199 20 10 EICDRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC001199027805 1054337867 /nfs/dbraw/zinc/33/78/67/1054337867.db2.gz JAEORDZTZHKLKK-UHFFFAOYSA-N 2 0 343.490 4.023 20 10 EICDRP C[C@@H](c1ccccc1)[N@H+](CC[C@@H]1CCC[NH+]1C)Cc1ccccc1O ZINC000776002538 1054437293 /nfs/dbraw/zinc/43/72/93/1054437293.db2.gz FDLVKUNDHUMBEE-RXVVDRJESA-N 2 0 338.495 4.440 20 10 EICDRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(N2CCCCCC2)cc1 ZINC000126293371 1055004141 /nfs/dbraw/zinc/00/41/41/1055004141.db2.gz DOXKWLNFWZLHTQ-GOSISDBHSA-N 2 0 329.532 4.059 20 10 EICDRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(N2CCCCC2)cc1 ZINC000780745309 1055191147 /nfs/dbraw/zinc/19/11/47/1055191147.db2.gz IEWRFGCATWBNJY-SFHVURJKSA-N 2 0 329.532 4.059 20 10 EICDRP Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)c1 ZINC000379616837 1059607897 /nfs/dbraw/zinc/60/78/97/1059607897.db2.gz CZNJSIYIEVTEOP-QZTJIDSGSA-N 2 0 326.484 4.262 20 10 EICDRP CC[C@H]([NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1)c1ccccc1O ZINC000379624596 1059618939 /nfs/dbraw/zinc/61/89/39/1059618939.db2.gz DLQDSYZXABMXJC-XLIONFOSSA-N 2 0 326.484 4.344 20 10 EICDRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000325580897 1021027391 /nfs/dbraw/zinc/02/73/91/1021027391.db2.gz NXEFDQWODMHHCP-OAHLLOKOSA-N 2 0 330.447 4.224 20 10 EICDRP Cc1ccc([C@@H](C)[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)c(O)c1 ZINC000311001918 1022811236 /nfs/dbraw/zinc/81/12/36/1022811236.db2.gz JTMUDQQFUFLIHG-XMSQKQJNSA-N 2 0 338.495 4.263 20 10 EICDRP CC[C@H]([NH2+]Cc1ccc(C[NH+](CC)CC)cc1)c1ccccc1O ZINC000323947568 1039060637 /nfs/dbraw/zinc/06/06/37/1039060637.db2.gz MPHWITJDOIADLY-FQEVSTJZSA-N 2 0 326.484 4.475 20 10 EICDRP C[C@@H]([NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1O ZINC001168023378 1044577803 /nfs/dbraw/zinc/57/78/03/1044577803.db2.gz VXOVCLHXSKLGSP-AJYBTWMASA-N 2 0 338.495 4.484 20 10 EICDRP C[C@H]([NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)c1ccccc1O ZINC000895460113 1044757150 /nfs/dbraw/zinc/75/71/50/1044757150.db2.gz JKZPCXNQIXFWSD-FFGOWVMKSA-N 2 0 336.479 4.096 20 10 EICDRP CCN(CC)c1ccc(C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1F ZINC000740003328 1045174336 /nfs/dbraw/zinc/17/43/36/1045174336.db2.gz XKHYKVZOMDGTJL-UHFFFAOYSA-N 2 0 335.511 4.071 20 10 EICDRP Cc1cc(C)c([C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c(O)c1 ZINC000788610433 1047234068 /nfs/dbraw/zinc/23/40/68/1047234068.db2.gz KSENYQJRGVKGJK-QGZVFWFLSA-N 2 0 330.516 4.457 20 10 EICDRP Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)c1O ZINC000808673715 1048045367 /nfs/dbraw/zinc/04/53/67/1048045367.db2.gz ICGGLNHSWICBAW-AWEZNQCLSA-N 2 0 332.875 4.266 20 10 EICDRP Oc1c(C[NH2+]C2CCC([NH+]3CCCCC3)CC2)ccc2ccccc21 ZINC000816555733 1048833698 /nfs/dbraw/zinc/83/36/98/1048833698.db2.gz OMVURNUWTXCXMI-UHFFFAOYSA-N 2 0 338.495 4.432 20 10 EICDRP CC(C)[NH2+]CCC[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000817952354 1049066267 /nfs/dbraw/zinc/06/62/67/1049066267.db2.gz DYXVEONYUDMVRQ-FQEVSTJZSA-N 2 0 326.484 4.044 20 10 EICDRP CC[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(C(F)(F)F)cc1O ZINC000817984943 1049076400 /nfs/dbraw/zinc/07/64/00/1049076400.db2.gz CREFYLTWQPJZQD-UKRRQHHQSA-N 2 0 342.405 4.126 20 10 EICDRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(N2CCCCCC2)cc1 ZINC000817984584 1049079288 /nfs/dbraw/zinc/07/92/88/1049079288.db2.gz USTJJZNAGPBKIX-SFHVURJKSA-N 2 0 327.516 4.027 20 10 EICDRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1cc(F)ccc1O ZINC000184905675 1052302803 /nfs/dbraw/zinc/30/28/03/1052302803.db2.gz TZWNSKJCXMPEBJ-MRXNPFEDSA-N 2 0 342.458 4.368 20 10 EICDRP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000764828181 1053319224 /nfs/dbraw/zinc/31/92/24/1053319224.db2.gz QBMLPMOTZWHHQB-LJQANCHMSA-N 2 0 343.559 4.448 20 10 EICDRP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)c1ccc(N2CCCCC2)cc1 ZINC000765118958 1053444638 /nfs/dbraw/zinc/44/46/38/1053444638.db2.gz JLKLFJRCCHSNDL-RBUKOAKNSA-N 2 0 329.532 4.059 20 10 EICDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000123989517 1054424913 /nfs/dbraw/zinc/42/49/13/1054424913.db2.gz SCJJCRUNIXODAZ-SFHVURJKSA-N 2 0 339.527 4.445 20 10 EICDRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)CC1 ZINC000765767739 1054783626 /nfs/dbraw/zinc/78/36/26/1054783626.db2.gz HFWUMPCKHNDACH-KRWDZBQOSA-N 2 0 347.522 4.199 20 10 EICDRP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001202074214 1055037093 /nfs/dbraw/zinc/03/70/93/1055037093.db2.gz JXUXAELYYCVYEN-UHFFFAOYSA-N 2 0 330.516 4.146 20 10 EICDRP C[C@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1cc(F)ccc1O ZINC000379643759 1059708388 /nfs/dbraw/zinc/70/83/88/1059708388.db2.gz GBOBYXFWNHERPV-HOTGVXAUSA-N 2 0 330.447 4.093 20 10 EICDRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766476383 1060383893 /nfs/dbraw/zinc/38/38/93/1060383893.db2.gz XVZJYNVSAGCNCE-CUWPLCDZSA-N 2 0 329.532 4.200 20 10 EICDRP CCCN(CCC)c1ccc(C[NH2+]CC2CC[NH+](CC)CC2)cc1 ZINC000729682498 1032130143 /nfs/dbraw/zinc/13/01/43/1032130143.db2.gz WNWZZTDMHCGDRJ-UHFFFAOYSA-N 2 0 331.548 4.135 20 10 EICDRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000729682932 1032145598 /nfs/dbraw/zinc/14/55/98/1032145598.db2.gz UUMJXRSTCIXHJI-SFHVURJKSA-N 2 0 338.495 4.269 20 10 EICDRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(N(C)C)c(C)c2)CC1 ZINC001167077732 1019568401 /nfs/dbraw/zinc/56/84/01/1019568401.db2.gz MWPKONXERBLHNA-UHFFFAOYSA-N 2 0 331.548 4.005 20 10 EICDRP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000161644721 1028496178 /nfs/dbraw/zinc/49/61/78/1028496178.db2.gz ZSDJIOBIDJTUIB-SFHVURJKSA-N 2 0 329.532 4.202 20 10 EICDRP Cc1cc(C[NH2+]C2CC[NH+](C(C)C)CC2)c(C)n1-c1ccccc1 ZINC000323896039 1036845143 /nfs/dbraw/zinc/84/51/43/1036845143.db2.gz OPJGUGPVMBIKMZ-UHFFFAOYSA-N 2 0 325.500 4.057 20 10 EICDRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCCCCC2)cc1 ZINC000152451022 1042828066 /nfs/dbraw/zinc/82/80/66/1042828066.db2.gz SHKOLCABGPLIMF-RBUKOAKNSA-N 2 0 341.543 4.202 20 10 EICDRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCCCCC2)cc1 ZINC000152451114 1042828173 /nfs/dbraw/zinc/82/81/73/1042828173.db2.gz SHKOLCABGPLIMF-RTBURBONSA-N 2 0 341.543 4.202 20 10 EICDRP Cc1cc(O)c(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)cc1C(C)C ZINC000738088724 1045031397 /nfs/dbraw/zinc/03/13/97/1045031397.db2.gz HCMTZQZUHSDLHF-UHFFFAOYSA-N 2 0 332.532 4.376 20 10 EICDRP Cc1cc(O)c(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1C(C)C ZINC000738268977 1045048488 /nfs/dbraw/zinc/04/84/88/1045048488.db2.gz FOCUFPTVPRHVTB-LJQANCHMSA-N 2 0 330.516 4.274 20 10 EICDRP Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c(O)c1 ZINC000788796737 1047304280 /nfs/dbraw/zinc/30/42/80/1047304280.db2.gz IBGDKFRDFORILG-UYAOXDASSA-N 2 0 338.495 4.182 20 10 EICDRP Cc1cc(Cl)cc([C@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)c1O ZINC000808701054 1048079167 /nfs/dbraw/zinc/07/91/67/1048079167.db2.gz OTZMKKHIPRFOLL-AWEZNQCLSA-N 2 0 336.907 4.412 20 10 EICDRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cc(Br)ccc1O ZINC000817963792 1049068233 /nfs/dbraw/zinc/06/82/33/1049068233.db2.gz VBFLNWYQQPGFPL-NWDGAFQWSA-N 2 0 349.272 4.025 20 10 EICDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(N2CCCCCC2)cc1 ZINC000817985061 1049080230 /nfs/dbraw/zinc/08/02/30/1049080230.db2.gz GEQRFFMCHVTISK-OYNPSCLESA-N 2 0 341.543 4.106 20 10 EICDRP C[NH+]1C(C)(C)CC([NH2+]Cc2cc3ccccc3cc2O)CC1(C)C ZINC001171626322 1049768041 /nfs/dbraw/zinc/76/80/41/1049768041.db2.gz YHBUJUWKHOFQGR-UHFFFAOYSA-N 2 0 326.484 4.286 20 10 EICDRP Cc1cccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)c1O ZINC001171976516 1049837567 /nfs/dbraw/zinc/83/75/67/1049837567.db2.gz SHAFZBIGHPOAMN-FQEVSTJZSA-N 2 0 338.495 4.233 20 10 EICDRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccccc1O ZINC000183420583 1051116659 /nfs/dbraw/zinc/11/66/59/1051116659.db2.gz JSZCVJVYKKBOSD-SFHVURJKSA-N 2 0 338.495 4.475 20 10 EICDRP Cc1cc(C[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)ccc1N(C)C ZINC001190651666 1051244656 /nfs/dbraw/zinc/24/46/56/1051244656.db2.gz PKCMQYFWIVYDFF-NRFANRHFSA-N 2 0 343.559 4.005 20 10 EICDRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(N2CCCCC2)cc1 ZINC000774495497 1051616826 /nfs/dbraw/zinc/61/68/26/1051616826.db2.gz IWBVUZOOQGNQLT-GOSISDBHSA-N 2 0 341.543 4.202 20 10 EICDRP CC[C@@H]([NH2+]C1CC[NH+](CC2CCCCC2)CC1)c1ccccc1O ZINC000775497427 1051619216 /nfs/dbraw/zinc/61/92/16/1051619216.db2.gz QHEKMAGKXLMPRH-HXUWFJFHSA-N 2 0 330.516 4.478 20 10 EICDRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cc(OC)ccc2O)cc1 ZINC000273382023 1051619646 /nfs/dbraw/zinc/61/96/46/1051619646.db2.gz IKKBIMWGQZQSGC-MRXNPFEDSA-N 2 0 342.483 4.093 20 10 EICDRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1cc(F)ccc1O ZINC000184905656 1052302996 /nfs/dbraw/zinc/30/29/96/1052302996.db2.gz TZWNSKJCXMPEBJ-INIZCTEOSA-N 2 0 342.458 4.368 20 10 EICDRP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2ccc3ccccc3c2O)CC1 ZINC000184972831 1052335945 /nfs/dbraw/zinc/33/59/45/1052335945.db2.gz LENLXPKVICRMKE-MRXNPFEDSA-N 2 0 326.484 4.316 20 10 EICDRP C[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1cc2c(cc1O)CCCC2 ZINC000185649173 1052667669 /nfs/dbraw/zinc/66/76/69/1052667669.db2.gz ZMUMIUNMIPXPAL-INIZCTEOSA-N 2 0 342.527 4.329 20 10 EICDRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(O)c1C ZINC000794829132 1053439946 /nfs/dbraw/zinc/43/99/46/1053439946.db2.gz STQUVLSVKQMRIY-ICSRJNTNSA-N 2 0 338.495 4.182 20 10 EICDRP Cc1ccc(O)c([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC000186164920 1054055542 /nfs/dbraw/zinc/05/55/42/1054055542.db2.gz LKWWUWMOFQHMKY-LMDPOFIKSA-N 2 0 330.516 4.394 20 10 EICDRP Cc1cc(Cl)cc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)c1O ZINC000776075611 1054522541 /nfs/dbraw/zinc/52/25/41/1054522541.db2.gz CFPPYPBFYMNFEA-UHFFFAOYSA-N 2 0 346.902 4.484 20 10 EICDRP CCCN(CCC)c1ccc(C[NH2+]CCC2CC[NH+](C)CC2)cc1 ZINC000729682902 1032144465 /nfs/dbraw/zinc/14/44/65/1032144465.db2.gz REQMJDMREKRKDQ-UHFFFAOYSA-N 2 0 331.548 4.135 20 10 EICDRP CC[C@@H](c1ccccc1O)[N@H+](Cc1ccco1)C1CCN(C)CC1 ZINC000377859624 1022053778 /nfs/dbraw/zinc/05/37/78/1022053778.db2.gz IGHCRPWOLCKGNF-IBGZPJMESA-N 2 0 328.456 4.033 20 10 EICDRP CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000161644860 1028495403 /nfs/dbraw/zinc/49/54/03/1028495403.db2.gz ZSDJIOBIDJTUIB-GOSISDBHSA-N 2 0 329.532 4.202 20 10 EICDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N3CCCCC3)c(C)c2)[C@@H](C)C1 ZINC001167686135 1030996831 /nfs/dbraw/zinc/99/68/31/1030996831.db2.gz NUIJLGBUICNMJA-FPOVZHCZSA-N 2 0 343.559 4.147 20 10 EICDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(C)c(C)cc1O ZINC000727427128 1043219328 /nfs/dbraw/zinc/21/93/28/1043219328.db2.gz YMMGBUJJYBAYGA-UHFFFAOYSA-N 2 0 326.484 4.093 20 10 EICDRP CCN(CC)c1ccc(C[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000727644184 1043255465 /nfs/dbraw/zinc/25/54/65/1043255465.db2.gz RHAHBDGYVILRKC-UHFFFAOYSA-N 2 0 331.548 4.135 20 10 EICDRP CCCN(CCC)c1ccc(C[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC000916836778 1046377764 /nfs/dbraw/zinc/37/77/64/1046377764.db2.gz MUKXFJBUJQYBLG-UHFFFAOYSA-N 2 0 343.559 4.277 20 10 EICDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(Cl)ccc1O ZINC000809738844 1048511827 /nfs/dbraw/zinc/51/18/27/1048511827.db2.gz MKJODGGJNAKYFA-UHFFFAOYSA-N 2 0 332.875 4.129 20 10 EICDRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cc2c(cc1O)CCCC2 ZINC000817982881 1049077299 /nfs/dbraw/zinc/07/72/99/1049077299.db2.gz IYVTWYZURDGGMU-HRAATJIYSA-N 2 0 338.495 4.402 20 10 EICDRP CCN(C)c1ccc([C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000817981297 1049078101 /nfs/dbraw/zinc/07/81/01/1049078101.db2.gz IQELDLFYGJRSJA-UWJYYQICSA-N 2 0 325.500 4.274 20 10 EICDRP CC[NH+](CC)C1CCC([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC001173104954 1050305743 /nfs/dbraw/zinc/30/57/43/1050305743.db2.gz MXUXULPYAIOONF-UHFFFAOYSA-N 2 0 329.532 4.029 20 10 EICDRP Oc1ccc(-c2ccccc2)cc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000775025002 1050349317 /nfs/dbraw/zinc/34/93/17/1050349317.db2.gz RSYNNUBNSDPPIB-UHFFFAOYSA-N 2 0 336.479 4.023 20 10 EICDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(N3CCCCC3)c(C)c2)C[C@H]1C ZINC001191418187 1051452108 /nfs/dbraw/zinc/45/21/08/1051452108.db2.gz SDYYPGLDVCZTJY-TZIWHRDSSA-N 2 0 343.559 4.290 20 10 EICDRP C[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000764431873 1053100852 /nfs/dbraw/zinc/10/08/52/1053100852.db2.gz HGNZTBVMRNFONI-MRXNPFEDSA-N 2 0 335.511 4.054 20 10 EICDRP CN(C)c1ccc(/C=C/C[NH2+]CCC[N@H+](C)C2CCCCC2)cc1 ZINC001198907875 1054309763 /nfs/dbraw/zinc/30/97/63/1054309763.db2.gz IONZHBOZDMQHIR-VQHVLOKHSA-N 2 0 329.532 4.010 20 10 EICDRP Cc1ccc([C@@H](C)[NH2+]CC[C@@H](C)[N@H+](C)Cc2ccccc2)c(O)c1 ZINC000379627300 1059649324 /nfs/dbraw/zinc/64/93/24/1059649324.db2.gz HUAXTOVWLJUSJH-QZTJIDSGSA-N 2 0 326.484 4.262 20 10 EICDRP COc1ccc(O)c([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC000186165016 1023102221 /nfs/dbraw/zinc/10/22/21/1023102221.db2.gz YZZAHIDKSTWEOD-WWDZGPRUSA-N 2 0 346.515 4.095 20 10 EICDRP C[C@@H]([NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)c1ccccc1O ZINC000895460114 1044756836 /nfs/dbraw/zinc/75/68/36/1044756836.db2.gz JKZPCXNQIXFWSD-GTAWCEEGSA-N 2 0 336.479 4.096 20 10 EICDRP Cc1cc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c(O)c(C(C)(C)C)c1 ZINC000738071299 1045032765 /nfs/dbraw/zinc/03/27/65/1045032765.db2.gz KTVVDBVSTVCFOT-UHFFFAOYSA-N 2 0 344.543 4.306 20 10 EICDRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cccc(C2CC2)c1 ZINC000824462643 1047877462 /nfs/dbraw/zinc/87/74/62/1047877462.db2.gz JQKXIKXCDSOKFT-GOSISDBHSA-N 2 0 349.522 4.167 20 10 EICDRP CC[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1O ZINC000810235233 1048700602 /nfs/dbraw/zinc/70/06/02/1048700602.db2.gz NCJYUFDHSHIXNT-HNNXBMFYSA-N 2 0 344.421 4.184 20 10 EICDRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc3ccccc3c2O)CC1 ZINC000816493520 1048814776 /nfs/dbraw/zinc/81/47/76/1048814776.db2.gz FELNRLXQCYFPIC-UHFFFAOYSA-N 2 0 326.484 4.098 20 10 EICDRP CC(C)[NH2+]CCC[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000817952356 1049066929 /nfs/dbraw/zinc/06/69/29/1049066929.db2.gz DYXVEONYUDMVRQ-HXUWFJFHSA-N 2 0 326.484 4.044 20 10 EICDRP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc(N2CCCCCC2)cc1 ZINC000817965012 1049072464 /nfs/dbraw/zinc/07/24/64/1049072464.db2.gz MTNYEEAHGBFJLI-GHTZIAJQSA-N 2 0 329.532 4.107 20 10 EICDRP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817985278 1049079248 /nfs/dbraw/zinc/07/92/48/1049079248.db2.gz IURIMUAOTWEWTC-WMZOPIPTSA-N 2 0 345.506 4.141 20 10 EICDRP CC[NH+](CC)C1CCC([N@H+](C)Cc2ccc(N3CCCC3)cc2)CC1 ZINC001173111409 1050309901 /nfs/dbraw/zinc/30/99/01/1050309901.db2.gz FEPDRGYVMKIWQQ-UHFFFAOYSA-N 2 0 343.559 4.372 20 10 EICDRP COc1cc(C[NH2+]CCCCC[NH+]2CCCC2)c(O)c(C(C)(C)C)c1 ZINC001178811500 1050560895 /nfs/dbraw/zinc/56/08/95/1050560895.db2.gz USGPWLHLCIYFPS-UHFFFAOYSA-N 2 0 348.531 4.054 20 10 EICDRP CCc1cccc(C[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)c1O ZINC001180030984 1050860647 /nfs/dbraw/zinc/86/06/47/1050860647.db2.gz RTOCFUXICHEURV-ZWKOTPCHSA-N 2 0 330.516 4.041 20 10 EICDRP CC[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1cc(Cl)ccc1O ZINC000775511832 1051659700 /nfs/dbraw/zinc/65/97/00/1051659700.db2.gz KEJFRQLSSDKVKG-SFHVURJKSA-N 2 0 336.907 4.493 20 10 EICDRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000185016434 1052370445 /nfs/dbraw/zinc/37/04/45/1052370445.db2.gz ZNGISTCANPORHL-OAHLLOKOSA-N 2 0 330.447 4.222 20 10 EICDRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc(F)cc1[O-] ZINC000185241409 1052551399 /nfs/dbraw/zinc/55/13/99/1052551399.db2.gz NZHLVVFLVOWBKH-CQSZACIVSA-N 2 0 348.487 4.156 20 10 EICDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000765082260 1053437771 /nfs/dbraw/zinc/43/77/71/1053437771.db2.gz SKUIRKUCFDSMQE-SFHVURJKSA-N 2 0 339.527 4.445 20 10 EICDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(N3CCCCC3)c(F)c2)C1 ZINC000765293083 1053498994 /nfs/dbraw/zinc/49/89/94/1053498994.db2.gz ZUWILBHEYKQYFM-MSOLQXFVSA-N 2 0 347.522 4.199 20 10 EICDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)C1 ZINC000765292674 1053499688 /nfs/dbraw/zinc/49/96/88/1053499688.db2.gz WYMVORXCVBHMQA-UXHICEINSA-N 2 0 343.559 4.450 20 10 EICDRP C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc(N2CCCCC2)cc1 ZINC000873237692 1054512925 /nfs/dbraw/zinc/51/29/25/1054512925.db2.gz PGNKTHMQKOULRM-GOSISDBHSA-N 2 0 349.522 4.173 20 10 EICDRP C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001201946485 1054963135 /nfs/dbraw/zinc/96/31/35/1054963135.db2.gz FESZYIKSGKQCQJ-UYAOXDASSA-N 2 0 341.543 4.029 20 10 EICDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)C1 ZINC000765784606 1055302926 /nfs/dbraw/zinc/30/29/26/1055302926.db2.gz SJEQBRPAXWJYBT-VQTJNVASSA-N 2 0 343.559 4.448 20 10 EICDRP CC[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc(N(C)C)cc1 ZINC000160482595 1021961386 /nfs/dbraw/zinc/96/13/86/1021961386.db2.gz BCCZUOKNOOUACT-NRFANRHFSA-N 2 0 329.532 4.200 20 10 EICDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000310890157 1022578378 /nfs/dbraw/zinc/57/83/78/1022578378.db2.gz KHWGFWWBROGWSV-XMSQKQJNSA-N 2 0 338.495 4.263 20 10 EICDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000310890154 1022579680 /nfs/dbraw/zinc/57/96/80/1022579680.db2.gz KHWGFWWBROGWSV-AVRDEDQJSA-N 2 0 338.495 4.263 20 10 EICDRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001203413721 1023308051 /nfs/dbraw/zinc/30/80/51/1023308051.db2.gz CXQGNZFYNZPSDX-UHFFFAOYSA-N 2 0 329.532 4.029 20 10 EICDRP Cc1cc(CC[NH2+]C2CC[NH+](C(C)C)CC2)c(C)n1-c1ccccc1 ZINC000761573983 1042884422 /nfs/dbraw/zinc/88/44/22/1042884422.db2.gz UTSGSBCLIMKEGS-UHFFFAOYSA-N 2 0 339.527 4.099 20 10 EICDRP C[C@H]([NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1O ZINC001168023381 1044577414 /nfs/dbraw/zinc/57/74/14/1044577414.db2.gz VXOVCLHXSKLGSP-BZSNNMDCSA-N 2 0 338.495 4.484 20 10 EICDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(-c3ccccc3)ccc2O)C[C@H]1C ZINC000769469624 1045984792 /nfs/dbraw/zinc/98/47/92/1045984792.db2.gz BRJMWTDZIACZDY-UTKZUKDTSA-N 2 0 338.495 4.364 20 10 EICDRP CC[N@@H+](Cc1cc(C)ccc1O)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000769530885 1046009205 /nfs/dbraw/zinc/00/92/05/1046009205.db2.gz ODUFQEFLKQOXBW-FQEVSTJZSA-N 2 0 338.495 4.045 20 10 EICDRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)c1 ZINC000788596661 1047243413 /nfs/dbraw/zinc/24/34/13/1047243413.db2.gz ZQFHWDAITCXGGH-QGZVFWFLSA-N 2 0 326.484 4.312 20 10 EICDRP Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(O)c1 ZINC000815555348 1048508365 /nfs/dbraw/zinc/50/83/65/1048508365.db2.gz XERHEHICJTYHHT-GOSISDBHSA-N 2 0 338.495 4.456 20 10 EICDRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(N2CCCCC2)cc1 ZINC000844924664 1048549032 /nfs/dbraw/zinc/54/90/32/1048549032.db2.gz PIIDYOUVJKJQJM-MRXNPFEDSA-N 2 0 341.474 4.126 20 10 EICDRP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccc(N2CCCCC2)cc1 ZINC000817947493 1049064009 /nfs/dbraw/zinc/06/40/09/1049064009.db2.gz OMAZIKHKXPARLF-SFHVURJKSA-N 2 0 337.511 4.029 20 10 EICDRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccc(N2CCCCC2)cc1 ZINC000817975173 1049073748 /nfs/dbraw/zinc/07/37/48/1049073748.db2.gz JRKWOTGFUXZZTM-GUDVDZBRSA-N 2 0 329.532 4.093 20 10 EICDRP Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000817982174 1049078536 /nfs/dbraw/zinc/07/85/36/1049078536.db2.gz ZAPNKWYWRHCGQK-CTNGQTDRSA-N 2 0 338.495 4.188 20 10 EICDRP C[NH+]1CCN(c2ccc(C[NH2+]C3CCC4(CCCC4)CC3)cc2)CC1 ZINC001172725923 1049966727 /nfs/dbraw/zinc/96/67/27/1049966727.db2.gz ROAWCILHTGLARI-UHFFFAOYSA-N 2 0 341.543 4.031 20 10 EICDRP CCN(CC)c1ccc(C[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC001177289282 1050178417 /nfs/dbraw/zinc/17/84/17/1050178417.db2.gz CMYQDXVCWJOBIE-WOJBJXKFSA-N 2 0 345.575 4.381 20 10 EICDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000185062148 1052388121 /nfs/dbraw/zinc/38/81/21/1052388121.db2.gz NUHLSOZKNAFJEF-KRWDZBQOSA-N 2 0 326.484 4.393 20 10 EICDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2O)C1 ZINC000185358190 1052589283 /nfs/dbraw/zinc/58/92/83/1052589283.db2.gz GWPKKMWMIDPMFU-DLBZAZTESA-N 2 0 326.484 4.316 20 10 EICDRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccc2ccccc2c1O ZINC000850581514 1053331197 /nfs/dbraw/zinc/33/11/97/1053331197.db2.gz FZVFIRNKDHOLKB-MRXNPFEDSA-N 2 0 338.495 4.318 20 10 EICDRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(C)cc1O ZINC000794826708 1053440167 /nfs/dbraw/zinc/44/01/67/1053440167.db2.gz CXCYDADVWZBXHC-TZIWHRDSSA-N 2 0 338.495 4.263 20 10 EICDRP C[C@H](C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)C[NH+]1CCCC1 ZINC000765118962 1053444901 /nfs/dbraw/zinc/44/49/01/1053444901.db2.gz JLKLFJRCCHSNDL-RTBURBONSA-N 2 0 329.532 4.059 20 10 EICDRP C[C@@H](c1ccccc1)[N@H+](CC[C@H]1CCC[NH+]1C)Cc1ccccc1O ZINC000776002534 1054437841 /nfs/dbraw/zinc/43/78/41/1054437841.db2.gz FDLVKUNDHUMBEE-GHTZIAJQSA-N 2 0 338.495 4.440 20 10 EICDRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000780747379 1055256709 /nfs/dbraw/zinc/25/67/09/1055256709.db2.gz YMNTUNXGVKUCQN-KRWDZBQOSA-N 2 0 347.522 4.199 20 10 EICDRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765779860 1055281367 /nfs/dbraw/zinc/28/13/67/1055281367.db2.gz ZNQPMKFJYTWVSA-KRWDZBQOSA-N 2 0 347.522 4.199 20 10 EICDRP Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000310807626 1022391908 /nfs/dbraw/zinc/39/19/08/1022391908.db2.gz HZTJGHJQKNHAIZ-WSTZPKSXSA-N 2 0 338.495 4.262 20 10 EICDRP Cc1ccc([C@@H](C)[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)c(O)c1 ZINC000311001916 1022811278 /nfs/dbraw/zinc/81/12/78/1022811278.db2.gz JTMUDQQFUFLIHG-GCJKJVERSA-N 2 0 338.495 4.263 20 10 EICDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001168372450 1037038811 /nfs/dbraw/zinc/03/88/11/1037038811.db2.gz XSZSGPBWXALENR-OAQYLSRUSA-N 2 0 342.527 4.096 20 10 EICDRP Cc1cc(O)c(C[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)cc1C ZINC000738107831 1045042009 /nfs/dbraw/zinc/04/20/09/1045042009.db2.gz OQKFPQSDIKYFEG-RTBURBONSA-N 2 0 330.516 4.095 20 10 EICDRP Cc1cc(C)c([C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c(O)c1 ZINC000788609947 1047234581 /nfs/dbraw/zinc/23/45/81/1047234581.db2.gz KSENYQJRGVKGJK-KRWDZBQOSA-N 2 0 330.516 4.457 20 10 EICDRP Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(O)c1 ZINC000815555349 1048506896 /nfs/dbraw/zinc/50/68/96/1048506896.db2.gz XERHEHICJTYHHT-SFHVURJKSA-N 2 0 338.495 4.456 20 10 EICDRP CC[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)c1ccc(C(F)(F)F)cc1O ZINC000810207175 1048703809 /nfs/dbraw/zinc/70/38/09/1048703809.db2.gz DTBMBQAGPGAJLP-CQSZACIVSA-N 2 0 332.410 4.040 20 10 EICDRP C[N@H+](Cc1ccccc1O)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171988777 1049831596 /nfs/dbraw/zinc/83/15/96/1049831596.db2.gz UXWLQTVQOSTAPD-FQEVSTJZSA-N 2 0 338.495 4.267 20 10 EICDRP c1cc(N2CCCC2)ccc1C[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC001178412206 1050466445 /nfs/dbraw/zinc/46/64/45/1050466445.db2.gz GZAPZSJOQYNNDH-UHFFFAOYSA-N 2 0 341.543 4.031 20 10 EICDRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1ccccc1O ZINC000183495343 1051139510 /nfs/dbraw/zinc/13/95/10/1051139510.db2.gz RAJSCSIKNJWYTL-SFHVURJKSA-N 2 0 338.495 4.475 20 10 EICDRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(C)cc1O ZINC000794826706 1053440202 /nfs/dbraw/zinc/44/02/02/1053440202.db2.gz CXCYDADVWZBXHC-PZJWPPBQSA-N 2 0 338.495 4.263 20 10 EICDRP Cc1cc(O)c(C[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)c(Cl)c1 ZINC001199320978 1054392414 /nfs/dbraw/zinc/39/24/14/1054392414.db2.gz SLCNHSFOWGKFEQ-HZPDHXFCSA-N 2 0 338.923 4.202 20 10 EICDRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)C1 ZINC000765784603 1055302511 /nfs/dbraw/zinc/30/25/11/1055302511.db2.gz SJEQBRPAXWJYBT-PMACEKPBSA-N 2 0 343.559 4.448 20 10 EICDRP CC[NH+]1CCC(CC[NH2+]Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000742377162 1058602279 /nfs/dbraw/zinc/60/22/79/1058602279.db2.gz IUALSCBPKWRRES-UHFFFAOYSA-N 2 0 338.495 4.271 20 10 EICDRP CCN(C)c1ccc([C@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000160466203 1021880812 /nfs/dbraw/zinc/88/08/12/1021880812.db2.gz MBSSXGOAINIPQT-KRWDZBQOSA-N 2 0 329.532 4.200 20 10 EICDRP Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(O)c1 ZINC000311073416 1022866568 /nfs/dbraw/zinc/86/65/68/1022866568.db2.gz KNNOACVXAZUYKK-CMKODMSKSA-N 2 0 338.495 4.262 20 10 EICDRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccc(F)cc1[O-] ZINC000184905469 1022968099 /nfs/dbraw/zinc/96/80/99/1022968099.db2.gz QRHSVCMHDSGVPP-MRXNPFEDSA-N 2 0 342.458 4.368 20 10 EICDRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1cc(F)ccc1O ZINC000311222992 1023006436 /nfs/dbraw/zinc/00/64/36/1023006436.db2.gz VSSLZPKTRBHDSV-FUHWJXTLSA-N 2 0 342.458 4.094 20 10 EICDRP C[C@H]1CC([N@H+](C)Cc2ccccc2O)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168064917 1029636405 /nfs/dbraw/zinc/63/64/05/1029636405.db2.gz SFLBKFUGQSOQTD-ROUUACIJSA-N 2 0 338.495 4.266 20 10 EICDRP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccc2ccccc2c1O ZINC000323861760 1035719157 /nfs/dbraw/zinc/71/91/57/1035719157.db2.gz PAMUCUUFSBLOCP-IAGOWNOFSA-N 2 0 326.484 4.461 20 10 EICDRP CCC[NH+]1CCC([NH2+]Cc2cc(C)n(-c3ccccc3)c2C)CC1 ZINC000323897673 1036842470 /nfs/dbraw/zinc/84/24/70/1036842470.db2.gz OXKHIFQDKSWHAC-UHFFFAOYSA-N 2 0 325.500 4.058 20 10 EICDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1c(O)ccc2ccncc21 ZINC000727425904 1043218843 /nfs/dbraw/zinc/21/88/43/1043218843.db2.gz BTXCNRSVOHWGPG-UHFFFAOYSA-N 2 0 349.478 4.024 20 10 EICDRP Cc1cccc(C[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)c1O ZINC001168031178 1044812487 /nfs/dbraw/zinc/81/24/87/1044812487.db2.gz YAWIAGUTFPNEBL-ROUUACIJSA-N 2 0 338.495 4.232 20 10 EICDRP CC(C)[N@H+](C)CC1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000738089810 1045032444 /nfs/dbraw/zinc/03/24/44/1045032444.db2.gz MUFNJQOPAQRVDQ-UHFFFAOYSA-N 2 0 326.484 4.098 20 10 EICDRP Cc1ccc(O)c(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)c1 ZINC000769314835 1045917033 /nfs/dbraw/zinc/91/70/33/1045917033.db2.gz QTKGXRAXTYSZNA-UHFFFAOYSA-N 2 0 338.495 4.045 20 10 EICDRP Cc1cc(C)c([C@@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)c(O)c1 ZINC000815587096 1048526159 /nfs/dbraw/zinc/52/61/59/1048526159.db2.gz ZHCAVDQZBXEDAN-LMDPOFIKSA-N 2 0 330.516 4.457 20 10 EICDRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc(Br)cc1O ZINC000817962548 1049070781 /nfs/dbraw/zinc/07/07/81/1049070781.db2.gz KAZMONNIHMHJKZ-NWDGAFQWSA-N 2 0 349.272 4.025 20 10 EICDRP CC1(C[NH2+][C@H](CCc2ccccc2)c2ccccc2O)CC[NH2+]CC1 ZINC000817965217 1049073084 /nfs/dbraw/zinc/07/30/84/1049073084.db2.gz RJLOVPQMYSUQBG-HXUWFJFHSA-N 2 0 338.495 4.045 20 10 EICDRP CC[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(N(C)C)cc1 ZINC000817980776 1049078045 /nfs/dbraw/zinc/07/80/45/1049078045.db2.gz DJUDTTUAXUZAPL-LEWJYISDSA-N 2 0 325.500 4.274 20 10 EICDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(N2CCCCCC2)cc1 ZINC000817985062 1049079668 /nfs/dbraw/zinc/07/96/68/1049079668.db2.gz GEQRFFMCHVTISK-ZIBCJSCZSA-N 2 0 341.543 4.106 20 10 EICDRP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)c1 ZINC000813331417 1049752480 /nfs/dbraw/zinc/75/24/80/1049752480.db2.gz ONUFDYVGTLVIEY-RYRKJORJSA-N 2 0 346.515 4.095 20 10 EICDRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000324804416 1049783660 /nfs/dbraw/zinc/78/36/60/1049783660.db2.gz BAXBMUMUSISJAG-KRWDZBQOSA-N 2 0 326.484 4.393 20 10 EICDRP CC(C)[NH+]1CCC([NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000180403662 1049889622 /nfs/dbraw/zinc/88/96/22/1049889622.db2.gz RJANWXPUFFNJLK-SFHVURJKSA-N 2 0 329.532 4.200 20 10 EICDRP CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CCN2C2CCCCCC2)cc1 ZINC001179386099 1050686832 /nfs/dbraw/zinc/68/68/32/1050686832.db2.gz HJWMHLHTIQSRMQ-RHVSLNNASA-N 2 0 341.543 4.153 20 10 EICDRP C[C@H]([NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C)c1ccccc1O ZINC000183563098 1051168667 /nfs/dbraw/zinc/16/86/67/1051168667.db2.gz LGPHDRHNUYFWMY-KURKYZTESA-N 2 0 338.495 4.199 20 10 EICDRP CC(C)C[NH+]1CCC([NH2+][C@@H](C)c2ccc3ccccc3c2O)CC1 ZINC000184972812 1052336008 /nfs/dbraw/zinc/33/60/08/1052336008.db2.gz LENLXPKVICRMKE-INIZCTEOSA-N 2 0 326.484 4.316 20 10 EICDRP Cc1ccc(O)c([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c1 ZINC000185241362 1052551051 /nfs/dbraw/zinc/55/10/51/1052551051.db2.gz HCVONTWCOWWZLN-INIZCTEOSA-N 2 0 344.524 4.325 20 10 EICDRP C[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)C[NH+]1CCCCC1 ZINC000325126357 1052985044 /nfs/dbraw/zinc/98/50/44/1052985044.db2.gz DAYPZMLTPZFYMW-IRXDYDNUSA-N 2 0 326.484 4.318 20 10 EICDRP C[C@@H](C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)C[NH+]1CCCC1 ZINC000765118957 1053445014 /nfs/dbraw/zinc/44/50/14/1053445014.db2.gz JLKLFJRCCHSNDL-OALUTQOASA-N 2 0 329.532 4.059 20 10 EICDRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc2ccccc2c1O ZINC000853240638 1053657435 /nfs/dbraw/zinc/65/74/35/1053657435.db2.gz PTGKTYFXBASQFC-AEFFLSMTSA-N 2 0 338.495 4.318 20 10 EICDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000743390210 1058967247 /nfs/dbraw/zinc/96/72/47/1058967247.db2.gz OKDUXVDHIVCRDD-QGZVFWFLSA-N 2 0 332.532 4.162 20 10 EICDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000743390208 1058968966 /nfs/dbraw/zinc/96/89/66/1058968966.db2.gz OKDUXVDHIVCRDD-KRWDZBQOSA-N 2 0 332.532 4.162 20 10 EICDRP CCCN(CCC)c1ccc(C[NH2+]C2CC[NH+](CCC)CC2)cc1 ZINC000743759843 1059101626 /nfs/dbraw/zinc/10/16/26/1059101626.db2.gz UHMWMQUAMYGIRX-UHFFFAOYSA-N 2 0 331.548 4.277 20 10 EICDRP CC(C)[NH+](CCC[NH2+]Cc1ccc(N2CCCCC2)cc1)C(C)C ZINC000746053952 1059994721 /nfs/dbraw/zinc/99/47/21/1059994721.db2.gz VPOLWSWMTZYJQN-UHFFFAOYSA-N 2 0 331.548 4.275 20 10 EICDRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766476384 1060386026 /nfs/dbraw/zinc/38/60/26/1060386026.db2.gz XVZJYNVSAGCNCE-DSKINZAPSA-N 2 0 329.532 4.200 20 10 EICDRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1cc(F)ccc1O ZINC000756364097 1022393938 /nfs/dbraw/zinc/39/39/38/1022393938.db2.gz HXZFOEPJWDVMJT-INIZCTEOSA-N 2 0 342.458 4.368 20 10 EICDRP CCc1cc(C[N@H+](C)CC2CC[NH+](C)CC2)c(O)c(C(C)(C)C)c1 ZINC000728906915 1026607825 /nfs/dbraw/zinc/60/78/25/1026607825.db2.gz MINYFXJQQNNEFC-UHFFFAOYSA-N 2 0 332.532 4.026 20 10 EICDRP C[C@@H]1CC([N@H+](C)Cc2ccccc2O)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168064915 1029635479 /nfs/dbraw/zinc/63/54/79/1029635479.db2.gz SFLBKFUGQSOQTD-QZTJIDSGSA-N 2 0 338.495 4.266 20 10 EICDRP CC[C@@H]([NH2+]Cc1ccc(-n2ccnc2)c(F)c1)c1ccc(C)cc1O ZINC000280142170 1035176556 /nfs/dbraw/zinc/17/65/56/1035176556.db2.gz PRKSYMKLEHCCBM-GOSISDBHSA-N 2 0 339.414 4.266 20 10 EICDRP C[NH+](C)CC[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)C(C)(C)C ZINC000734849862 1044702205 /nfs/dbraw/zinc/70/22/05/1044702205.db2.gz QMGYPXDJVAPWGI-FQEVSTJZSA-N 2 0 331.548 4.133 20 10 EICDRP Cc1cccc(C[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)c1O ZINC001168031163 1044812611 /nfs/dbraw/zinc/81/26/11/1044812611.db2.gz YAWIAGUTFPNEBL-QZTJIDSGSA-N 2 0 338.495 4.232 20 10 EICDRP CCCN(CCC)c1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000915682842 1045448183 /nfs/dbraw/zinc/44/81/83/1045448183.db2.gz SAVUBUVMSYZVMF-TZIWHRDSSA-N 2 0 329.532 4.029 20 10 EICDRP C[NH+](C)CCC1CC[NH+](Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000768997165 1045873366 /nfs/dbraw/zinc/87/33/66/1045873366.db2.gz AJONOPLBJGTCAI-UHFFFAOYSA-N 2 0 338.495 4.223 20 10 EICDRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1cc2c(cc1O)CCCC2 ZINC000815647474 1048571328 /nfs/dbraw/zinc/57/13/28/1048571328.db2.gz LJTFYQXQWGFKBD-QGZVFWFLSA-N 2 0 330.516 4.188 20 10 EICDRP C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)[C@@H]1CCC[NH2+]C1 ZINC000817946630 1049061687 /nfs/dbraw/zinc/06/16/87/1049061687.db2.gz BVPZZCHMVBXFRU-NLWGTHIKSA-N 2 0 329.532 4.106 20 10 EICDRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(N2CCCCCC2)cc1 ZINC000817965036 1049072909 /nfs/dbraw/zinc/07/29/09/1049072909.db2.gz NUQNJWOGTCTURM-SFHVURJKSA-N 2 0 329.532 4.107 20 10 EICDRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cc2c(cc1O)CCCC2 ZINC000817982884 1049077843 /nfs/dbraw/zinc/07/78/43/1049077843.db2.gz IYVTWYZURDGGMU-KKSFZXQISA-N 2 0 338.495 4.402 20 10 EICDRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(N2CCCCCC2)cc1 ZINC000817980060 1049078290 /nfs/dbraw/zinc/07/82/90/1049078290.db2.gz IONGKNRLNQPYCT-QUCCMNQESA-N 2 0 329.532 4.250 20 10 EICDRP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)c1ccc(N(C)C)cc1 ZINC000773074669 1049565163 /nfs/dbraw/zinc/56/51/63/1049565163.db2.gz GYQNUYMWLKFRTM-WIYYLYMNSA-N 2 0 331.548 4.161 20 10 EICDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(Cl)c(Cl)cc2[O-])C1 ZINC000774160786 1051488388 /nfs/dbraw/zinc/48/83/88/1051488388.db2.gz BDMWMNYXOOHWDL-QWHCGFSZSA-N 2 0 345.314 4.470 20 10 EICDRP C[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1cc2c(cc1O)CCCC2 ZINC000185649195 1052667197 /nfs/dbraw/zinc/66/71/97/1052667197.db2.gz ZMUMIUNMIPXPAL-MRXNPFEDSA-N 2 0 342.527 4.329 20 10 EICDRP C[C@H]([NH2+]CCC[NH+]1CCCCC1)c1ccc(N2CCCCC2)cc1 ZINC000764663223 1053248264 /nfs/dbraw/zinc/24/82/64/1053248264.db2.gz QTKIXKQDZWJPMQ-IBGZPJMESA-N 2 0 329.532 4.204 20 10 EICDRP CC(C)[N@H+](C)[C@H]1c2ccccc2[C@@H]2C[NH+](Cc3ccccc3O)C[C@@H]21 ZINC001203555810 1055097951 /nfs/dbraw/zinc/09/79/51/1055097951.db2.gz GPFIMBFLFPXEJZ-ONTIZHBOSA-N 2 0 336.479 4.003 20 10 EICDRP CC[C@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)c1ccc(N(C)C)cc1 ZINC000765777778 1055272729 /nfs/dbraw/zinc/27/27/29/1055272729.db2.gz YXRLHZRHEJSOSQ-QFIPXVFZSA-N 2 0 339.527 4.445 20 10 EICDRP CC[C@H](c1ccccc1O)[N@H+](Cc1ccco1)C1CCN(C)CC1 ZINC000377859625 1022055217 /nfs/dbraw/zinc/05/52/17/1022055217.db2.gz IGHCRPWOLCKGNF-LJQANCHMSA-N 2 0 328.456 4.033 20 10 EICDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCN(C)[C@H]2c2cccs2)c1 ZINC000363870732 1022875252 /nfs/dbraw/zinc/87/52/52/1022875252.db2.gz YHOKJFBPHPSZNU-YZVOILCLSA-N 2 0 330.497 4.106 20 10 EICDRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1cc(F)ccc1O ZINC000311222993 1023007679 /nfs/dbraw/zinc/00/76/79/1023007679.db2.gz VSSLZPKTRBHDSV-SJLPKXTDSA-N 2 0 342.458 4.094 20 10 EICDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000192927064 1029648009 /nfs/dbraw/zinc/64/80/09/1029648009.db2.gz RKIYOHYCGRQKHI-MRXNPFEDSA-N 2 0 342.483 4.093 20 10 EICDRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)c(O)c1C ZINC000273609203 1037524056 /nfs/dbraw/zinc/52/40/56/1037524056.db2.gz VGXBECNYAMLDFC-HNNXBMFYSA-N 2 0 330.447 4.061 20 10 EICDRP Cc1cc(O)c(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)cc1C ZINC000174313066 1038910011 /nfs/dbraw/zinc/91/00/11/1038910011.db2.gz GCDVBPINJTURLU-UHFFFAOYSA-N 2 0 326.484 4.139 20 10 EICDRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(N(C)C)cc1 ZINC000162910044 1043181339 /nfs/dbraw/zinc/18/13/39/1043181339.db2.gz VZBVQKCABIMUGT-SFHVURJKSA-N 2 0 337.511 4.199 20 10 EICDRP C[C@H]([NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)c1ccccc1O ZINC000895460115 1044758022 /nfs/dbraw/zinc/75/80/22/1044758022.db2.gz JKZPCXNQIXFWSD-LEAZDLGRSA-N 2 0 336.479 4.096 20 10 EICDRP C[NH+](C)C[C@H]1CC[N@H+](Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)C1 ZINC000738228244 1045046039 /nfs/dbraw/zinc/04/60/39/1045046039.db2.gz USJIRVWIGVBVEK-MRXNPFEDSA-N 2 0 346.559 4.371 20 10 EICDRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000154853789 1047702678 /nfs/dbraw/zinc/70/26/78/1047702678.db2.gz JWPGNFDMJXYPSV-SFHVURJKSA-N 2 0 339.527 4.444 20 10 EICDRP COc1ccc(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)c(O)c1 ZINC000824320114 1047853763 /nfs/dbraw/zinc/85/37/63/1047853763.db2.gz DIAXTDWQZVAHIM-UHFFFAOYSA-N 2 0 348.531 4.170 20 10 EICDRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000824914735 1047984093 /nfs/dbraw/zinc/98/40/93/1047984093.db2.gz XRFVITVMCZHUSF-UHFFFAOYSA-N 2 0 326.484 4.269 20 10 EICDRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc3ccccc3c2O)c1 ZINC000816548255 1048827964 /nfs/dbraw/zinc/82/79/64/1048827964.db2.gz AWOVILUWALJVRN-UHFFFAOYSA-N 2 0 334.463 4.287 20 10 EICDRP COc1cccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1O ZINC000846141493 1048830225 /nfs/dbraw/zinc/83/02/25/1048830225.db2.gz KFAAMTHNZYXZSI-MRXNPFEDSA-N 2 0 342.483 4.092 20 10 EICDRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(N2CCCCC2)cc1 ZINC000817585988 1049017229 /nfs/dbraw/zinc/01/72/29/1049017229.db2.gz KKIBPIFCQRMKJS-QHGAOEGBSA-N 2 0 329.532 4.200 20 10 EICDRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(N2CCCCCC2)cc1 ZINC000817946629 1049061819 /nfs/dbraw/zinc/06/18/19/1049061819.db2.gz BVPZZCHMVBXFRU-CMKODMSKSA-N 2 0 329.532 4.106 20 10 EICDRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(Br)cc2O)cc1 ZINC000817962549 1049069047 /nfs/dbraw/zinc/06/90/47/1049069047.db2.gz KAZMONNIHMHJKZ-RYUDHWBXSA-N 2 0 349.272 4.025 20 10 EICDRP CCN(C)c1ccc([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000817981294 1049078778 /nfs/dbraw/zinc/07/87/78/1049078778.db2.gz IQELDLFYGJRSJA-DYESRHJHSA-N 2 0 325.500 4.274 20 10 EICDRP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N2CCCCCC2)cc1 ZINC000817987209 1049080744 /nfs/dbraw/zinc/08/07/44/1049080744.db2.gz YHBIBALJIAECOQ-ICSRJNTNSA-N 2 0 341.543 4.392 20 10 EICDRP CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cc1 ZINC000773076552 1049566651 /nfs/dbraw/zinc/56/66/51/1049566651.db2.gz ODOMQSSITKGDTM-OALUTQOASA-N 2 0 331.548 4.161 20 10 EICDRP CCCN(c1ccc(C[NH3+])cc1)C1CC[NH+](C2CCCCC2)CC1 ZINC000775140306 1050604459 /nfs/dbraw/zinc/60/44/59/1050604459.db2.gz LOXZIVXBRNJCPA-UHFFFAOYSA-N 2 0 329.532 4.159 20 10 EICDRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cc(OC)ccc2O)cc1 ZINC000273382018 1051620215 /nfs/dbraw/zinc/62/02/15/1051620215.db2.gz IKKBIMWGQZQSGC-INIZCTEOSA-N 2 0 342.483 4.093 20 10 EICDRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2O)C1 ZINC000185358211 1052588402 /nfs/dbraw/zinc/58/84/02/1052588402.db2.gz GWPKKMWMIDPMFU-IRXDYDNUSA-N 2 0 326.484 4.316 20 10 EICDRP CC[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(N(C)C)cc1 ZINC000120913574 1053639976 /nfs/dbraw/zinc/63/99/76/1053639976.db2.gz PEVUASLAMZCUIU-NRFANRHFSA-N 2 0 343.490 4.194 20 10 EICDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000123989772 1054425265 /nfs/dbraw/zinc/42/52/65/1054425265.db2.gz SCJJCRUNIXODAZ-GOSISDBHSA-N 2 0 339.527 4.445 20 10 EICDRP CC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)CC1 ZINC000765768570 1054811966 /nfs/dbraw/zinc/81/19/66/1054811966.db2.gz IDMBUYAEDMELTR-LJQANCHMSA-N 2 0 343.559 4.450 20 10 EICDRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000780747380 1055256201 /nfs/dbraw/zinc/25/62/01/1055256201.db2.gz YMNTUNXGVKUCQN-QGZVFWFLSA-N 2 0 347.522 4.199 20 10 EICDRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(N2CCCCCC2)cc1 ZINC000765778802 1055271888 /nfs/dbraw/zinc/27/18/88/1055271888.db2.gz LVINDEJPVJXISV-IBGZPJMESA-N 2 0 343.559 4.450 20 10 EICDRP CCN(Cc1ccccc1)c1ccc(C[NH2+][C@@H](C)CC[NH+](C)C)cc1 ZINC000744267735 1059360915 /nfs/dbraw/zinc/36/09/15/1059360915.db2.gz UBKDNEVHYOZVRQ-IBGZPJMESA-N 2 0 339.527 4.143 20 10 EICDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCN(C)[C@@H]2c2cccs2)c1 ZINC000363870726 1022875404 /nfs/dbraw/zinc/87/54/04/1022875404.db2.gz YHOKJFBPHPSZNU-DOXZYTNZSA-N 2 0 330.497 4.106 20 10 EICDRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000840808553 1029396236 /nfs/dbraw/zinc/39/62/36/1029396236.db2.gz MGTWNXLVQKGUDY-RBUKOAKNSA-N 2 0 329.532 4.059 20 10 EICDRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(N2CCCCCC2)cc1 ZINC000158186693 1035659242 /nfs/dbraw/zinc/65/92/42/1035659242.db2.gz IJMADYJRUCMWKC-RTBURBONSA-N 2 0 329.532 4.059 20 10 EICDRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCCCCC2)cc1 ZINC000152450938 1042828076 /nfs/dbraw/zinc/82/80/76/1042828076.db2.gz SHKOLCABGPLIMF-MOPGFXCFSA-N 2 0 341.543 4.202 20 10 EICDRP C[C@H]([NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1O ZINC001168023384 1044580779 /nfs/dbraw/zinc/58/07/79/1044580779.db2.gz VXOVCLHXSKLGSP-DMUMMCEESA-N 2 0 338.495 4.484 20 10 EICDRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000768301821 1045783873 /nfs/dbraw/zinc/78/38/73/1045783873.db2.gz BWPZDHFPAACRNU-UHFFFAOYSA-N 2 0 343.559 4.231 20 10 EICDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cc2ccccc2o1 ZINC000786159440 1046813302 /nfs/dbraw/zinc/81/33/02/1046813302.db2.gz FGRGWYQTAADDRK-KRWDZBQOSA-N 2 0 349.478 4.035 20 10 EICDRP C[N@H+](Cc1cc(-c2ccccc2)ccc1O)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000809705497 1048487633 /nfs/dbraw/zinc/48/76/33/1048487633.db2.gz WGYQRUIXNAGJPA-WCRBZPEASA-N 2 0 336.479 4.116 20 10 EICDRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccc2ccccc2c1O ZINC000815647382 1048571262 /nfs/dbraw/zinc/57/12/62/1048571262.db2.gz IXEVMEXMRSPPMB-KRWDZBQOSA-N 2 0 326.484 4.462 20 10 EICDRP CC[C@H]([NH2+]CC(C)(C)C[NH+](C)C)c1ccc(C(F)(F)F)cc1O ZINC000810207173 1048702638 /nfs/dbraw/zinc/70/26/38/1048702638.db2.gz DTBMBQAGPGAJLP-AWEZNQCLSA-N 2 0 332.410 4.040 20 10 EICDRP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)c1 ZINC000845973103 1048771537 /nfs/dbraw/zinc/77/15/37/1048771537.db2.gz XJTMCZFEYXTUCF-TWOQFEAHSA-N 2 0 346.515 4.095 20 10 EICDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846136996 1048828949 /nfs/dbraw/zinc/82/89/49/1048828949.db2.gz PLAMZXOCQNZNOH-INIZCTEOSA-N 2 0 342.483 4.093 20 10 EICDRP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc(N2CCCCCC2)cc1 ZINC000817965013 1049073170 /nfs/dbraw/zinc/07/31/70/1049073170.db2.gz MTNYEEAHGBFJLI-NQIIRXRSSA-N 2 0 329.532 4.107 20 10 EICDRP C[C@H](CCCC[NH3+])[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000817975747 1049073703 /nfs/dbraw/zinc/07/37/03/1049073703.db2.gz ATWCWMBUVCBNTO-YLJYHZDGSA-N 2 0 326.484 4.173 20 10 EICDRP C[C@@H](CCCC[NH3+])[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000817975744 1049074391 /nfs/dbraw/zinc/07/43/91/1049074391.db2.gz ATWCWMBUVCBNTO-FXAWDEMLSA-N 2 0 326.484 4.173 20 10 EICDRP CC[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(N(C)C)cc1 ZINC000817980781 1049078202 /nfs/dbraw/zinc/07/82/02/1049078202.db2.gz DJUDTTUAXUZAPL-RTWAWAEBSA-N 2 0 325.500 4.274 20 10 EICDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cc1 ZINC000773076562 1049567793 /nfs/dbraw/zinc/56/77/93/1049567793.db2.gz ODOMQSSITKGDTM-RTBURBONSA-N 2 0 331.548 4.161 20 10 EICDRP C[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc(N(C)C)cc1 ZINC000773098137 1049580277 /nfs/dbraw/zinc/58/02/77/1049580277.db2.gz KJELOHVCVKKYOH-HOHBBMLPSA-N 2 0 343.559 4.446 20 10 EICDRP Cc1cc(C[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)ccc1N(C)C ZINC001190651672 1051244405 /nfs/dbraw/zinc/24/44/05/1051244405.db2.gz PKCMQYFWIVYDFF-OAQYLSRUSA-N 2 0 343.559 4.005 20 10 EICDRP CC[C@@H]([NH2+]Cc1ccc(-n2ccnc2)cc1)c1cc(Cl)ccc1O ZINC000775490300 1051576426 /nfs/dbraw/zinc/57/64/26/1051576426.db2.gz VPTNUPXHJUNCJR-GOSISDBHSA-N 2 0 341.842 4.472 20 10 EICDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000185062293 1052388663 /nfs/dbraw/zinc/38/86/63/1052388663.db2.gz OISOSOLMZXNKFZ-QGZVFWFLSA-N 2 0 326.484 4.393 20 10 EICDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(N3CCCCC3)c(F)c2)C1 ZINC000765293084 1053499104 /nfs/dbraw/zinc/49/91/04/1053499104.db2.gz ZUWILBHEYKQYFM-QZTJIDSGSA-N 2 0 347.522 4.199 20 10 EICDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)C1 ZINC000765293085 1053499665 /nfs/dbraw/zinc/49/96/65/1053499665.db2.gz ZUWILBHEYKQYFM-ROUUACIJSA-N 2 0 347.522 4.199 20 10 EICDRP Cc1cccc(C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)c1O ZINC000775734458 1053711178 /nfs/dbraw/zinc/71/11/78/1053711178.db2.gz QHWDEIDIZAKAAE-SFHVURJKSA-N 2 0 330.516 4.177 20 10 EICDRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000858490320 1054498372 /nfs/dbraw/zinc/49/83/72/1054498372.db2.gz GFFVUCAMFHEDHI-RBUKOAKNSA-N 2 0 329.532 4.059 20 10 EICDRP C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001201946482 1054963006 /nfs/dbraw/zinc/96/30/06/1054963006.db2.gz FESZYIKSGKQCQJ-AZUAARDMSA-N 2 0 341.543 4.029 20 10 EICDRP Cc1cc(O)c(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1C(C)C ZINC000742169548 1058531721 /nfs/dbraw/zinc/53/17/21/1058531721.db2.gz SOASFORPSCJXLK-GOSISDBHSA-N 2 0 330.516 4.132 20 10 EICDRP CCc1cc(C[N@H+]2CC[C@H](C[NH+](CC)CC)C2)c(O)c(C(C)(C)C)c1 ZINC000743387006 1058969229 /nfs/dbraw/zinc/96/92/29/1058969229.db2.gz CGFLQFASZGHNEC-GOSISDBHSA-N 2 0 346.559 4.416 20 10 EICDRP Cc1ccc([C@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)c(O)c1 ZINC000379627303 1059650195 /nfs/dbraw/zinc/65/01/95/1059650195.db2.gz HUAXTOVWLJUSJH-ROUUACIJSA-N 2 0 326.484 4.262 20 10 EICDRP CCC[NH+]1CCC(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000729682363 1032130302 /nfs/dbraw/zinc/13/03/02/1032130302.db2.gz SXRKGVMXIMSIRS-UHFFFAOYSA-N 2 0 338.495 4.271 20 10 EICDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000729682930 1032144343 /nfs/dbraw/zinc/14/43/43/1032144343.db2.gz UUMJXRSTCIXHJI-GOSISDBHSA-N 2 0 338.495 4.269 20 10 EICDRP Cc1ccc(O)c(C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)c1 ZINC000311203217 1023000709 /nfs/dbraw/zinc/00/07/09/1023000709.db2.gz ILHRHRSHLCMULY-HXUWFJFHSA-N 2 0 338.495 4.093 20 10 EICDRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000161715619 1028749331 /nfs/dbraw/zinc/74/93/31/1028749331.db2.gz ZFRAYGBPSBKGGE-SFHVURJKSA-N 2 0 339.527 4.444 20 10 EICDRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000840808555 1029397403 /nfs/dbraw/zinc/39/74/03/1029397403.db2.gz MGTWNXLVQKGUDY-RTBURBONSA-N 2 0 329.532 4.059 20 10 EICDRP C[C@@H]1C[C@@H]([NH+](C)Cc2ccccc2O)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168064916 1029635717 /nfs/dbraw/zinc/63/57/17/1029635717.db2.gz SFLBKFUGQSOQTD-RMFSNUHRSA-N 2 0 338.495 4.266 20 10 EICDRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccccc1O ZINC000248390964 1033846201 /nfs/dbraw/zinc/84/62/01/1033846201.db2.gz UNQUMBBENRJMAS-ZWKOTPCHSA-N 2 0 338.495 4.475 20 10 EICDRP CC[C@@H]([NH2+]Cc1ccccc1C[NH+](CC)CC)c1ccccc1O ZINC000192927121 1041076320 /nfs/dbraw/zinc/07/63/20/1041076320.db2.gz GCWOWVOPWKECDO-HXUWFJFHSA-N 2 0 326.484 4.475 20 10 EICDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000769509367 1046002649 /nfs/dbraw/zinc/00/26/49/1046002649.db2.gz XAKQOZBGXXJEOL-SFHVURJKSA-N 2 0 338.495 4.223 20 10 EICDRP Cc1cc(O)c(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1C(C)C ZINC000772828685 1046163659 /nfs/dbraw/zinc/16/36/59/1046163659.db2.gz PFAGSLWRNNNNGB-UTKZUKDTSA-N 2 0 342.527 4.273 20 10 EICDRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1c(O)cccc1Cl ZINC000809739607 1048509283 /nfs/dbraw/zinc/50/92/83/1048509283.db2.gz PPTPEMLDYDRVMR-UHFFFAOYSA-N 2 0 332.875 4.129 20 10 EICDRP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817985275 1049079441 /nfs/dbraw/zinc/07/94/41/1049079441.db2.gz IURIMUAOTWEWTC-AEFFLSMTSA-N 2 0 345.506 4.141 20 10 EICDRP CC[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccccc1O ZINC000775524056 1051700105 /nfs/dbraw/zinc/70/01/05/1051700105.db2.gz PFNMYCIXBFPYMA-AFMYVXGZSA-N 2 0 330.516 4.476 20 10 EICDRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc2ccccc2c1O ZINC000184936969 1052319446 /nfs/dbraw/zinc/31/94/46/1052319446.db2.gz JTPHRLAXKZVAHH-MRXNPFEDSA-N 2 0 334.463 4.458 20 10 EICDRP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc2c(cc1O)CCCC2 ZINC000185941612 1052829301 /nfs/dbraw/zinc/82/93/01/1052829301.db2.gz HZQXGSZXMRPVRP-OAHLLOKOSA-N 2 0 330.516 4.185 20 10 EICDRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(O)c1C ZINC000794829134 1053440402 /nfs/dbraw/zinc/44/04/02/1053440402.db2.gz STQUVLSVKQMRIY-QUCCMNQESA-N 2 0 338.495 4.182 20 10 EICDRP C[C@H](C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)C[NH+]1CCCC1 ZINC000765118955 1053444520 /nfs/dbraw/zinc/44/45/20/1053444520.db2.gz JLKLFJRCCHSNDL-MOPGFXCFSA-N 2 0 329.532 4.059 20 10 EICDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)C1 ZINC000765292653 1053498725 /nfs/dbraw/zinc/49/87/25/1053498725.db2.gz WYMVORXCVBHMQA-PMACEKPBSA-N 2 0 343.559 4.450 20 10 EICDRP C[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1cc(F)ccc1O ZINC000186165211 1054048188 /nfs/dbraw/zinc/04/81/88/1054048188.db2.gz XOTCZYJDSMAUHC-FAEJEUNOSA-N 2 0 334.479 4.225 20 10 EICDRP CCCC[NH+]1CCC([NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000122962860 1054065568 /nfs/dbraw/zinc/06/55/68/1054065568.db2.gz GREOQJNUXYUYHZ-UHFFFAOYSA-N 2 0 329.532 4.031 20 10 EICDRP Cc1ccc(O)c([C@H](C)[NH2+]CC[C@H](C)[N@H+](C)Cc2ccccc2)c1 ZINC000379616838 1059609046 /nfs/dbraw/zinc/60/90/46/1059609046.db2.gz CZNJSIYIEVTEOP-ROUUACIJSA-N 2 0 326.484 4.262 20 10 EICDRP C[C@@H]([NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1)c1cc(F)ccc1O ZINC000379643761 1059708593 /nfs/dbraw/zinc/70/85/93/1059708593.db2.gz GBOBYXFWNHERPV-HZPDHXFCSA-N 2 0 330.447 4.093 20 10 EICDRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000310963866 1032741124 /nfs/dbraw/zinc/74/11/24/1032741124.db2.gz BJISQJOQIZGYLG-QUCCMNQESA-N 2 0 338.495 4.345 20 10 EICDRP CCN(Cc1ccccc1)c1ccc(C[NH2+]CCn2ccnc2C)cc1 ZINC000748095561 1020304042 /nfs/dbraw/zinc/30/40/42/1020304042.db2.gz IRQFTVUNMXVVFM-UHFFFAOYSA-N 2 0 348.494 4.008 20 10 EICDRP Cc1ccc([C@H](C)[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)c(O)c1 ZINC000311001915 1022810967 /nfs/dbraw/zinc/81/09/67/1022810967.db2.gz JTMUDQQFUFLIHG-AVRDEDQJSA-N 2 0 338.495 4.263 20 10 EICDRP CC[NH+](CC)Cc1cc(N2C(C)(C)CC([NH3+])CC2(C)C)ccc1OC ZINC001167626301 1027492425 /nfs/dbraw/zinc/49/24/25/1027492425.db2.gz DRNAYRAVUPOVFS-UHFFFAOYSA-N 2 0 347.547 4.022 20 10 EICDRP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccc2ccccc2c1O ZINC000323861758 1035718976 /nfs/dbraw/zinc/71/89/76/1035718976.db2.gz PAMUCUUFSBLOCP-DLBZAZTESA-N 2 0 326.484 4.461 20 10 EICDRP CCC[NH+]1CCC([NH2+]CCc2cc(C)n(-c3ccccc3)c2C)CC1 ZINC000761571227 1042884955 /nfs/dbraw/zinc/88/49/55/1042884955.db2.gz FUPWCIGICPKJOK-UHFFFAOYSA-N 2 0 339.527 4.101 20 10 EICDRP Cc1cc(O)c(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1C(C)C ZINC000738268975 1045047816 /nfs/dbraw/zinc/04/78/16/1045047816.db2.gz FOCUFPTVPRHVTB-IBGZPJMESA-N 2 0 330.516 4.274 20 10 EICDRP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1ccc2ccccc2c1O ZINC000790749524 1045572467 /nfs/dbraw/zinc/57/24/67/1045572467.db2.gz HNEQRHKYGHRZMX-MRXNPFEDSA-N 2 0 326.484 4.318 20 10 EICDRP c1cc(N2CCCCC2)ccc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000815151767 1048350852 /nfs/dbraw/zinc/35/08/52/1048350852.db2.gz SOVFGAWTUZYQBL-UHFFFAOYSA-N 2 0 329.532 4.033 20 10 EICDRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000844924435 1048548436 /nfs/dbraw/zinc/54/84/36/1048548436.db2.gz LMJGCHIBVLICHI-SFHVURJKSA-N 2 0 337.511 4.247 20 10 EICDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2cccc(OC)c2O)c1 ZINC000846141600 1048830562 /nfs/dbraw/zinc/83/05/62/1048830562.db2.gz QXGIPPAPCWSEKZ-MRXNPFEDSA-N 2 0 342.483 4.093 20 10 EICDRP Oc1c(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc2ccccc21 ZINC000816594427 1048832257 /nfs/dbraw/zinc/83/22/57/1048832257.db2.gz CTLYIHSHUBKNNI-LJQANCHMSA-N 2 0 346.474 4.157 20 10 EICDRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccc(N2CCCCC2)cc1 ZINC000817975169 1049074601 /nfs/dbraw/zinc/07/46/01/1049074601.db2.gz JRKWOTGFUXZZTM-FHWLQOOXSA-N 2 0 329.532 4.093 20 10 EICDRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(N2CCCCCC2)cc1 ZINC000817980062 1049076987 /nfs/dbraw/zinc/07/69/87/1049076987.db2.gz IONGKNRLNQPYCT-UYAOXDASSA-N 2 0 329.532 4.250 20 10 EICDRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cc2c(cc1O)CCCC2 ZINC000817982883 1049077941 /nfs/dbraw/zinc/07/79/41/1049077941.db2.gz IYVTWYZURDGGMU-IIBYNOLFSA-N 2 0 338.495 4.402 20 10 EICDRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc(N2CCCCCC2)cc1 ZINC000817985059 1049080382 /nfs/dbraw/zinc/08/03/82/1049080382.db2.gz GEQRFFMCHVTISK-FYZZASKESA-N 2 0 341.543 4.106 20 10 EICDRP CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cc1 ZINC000773076549 1049567975 /nfs/dbraw/zinc/56/79/75/1049567975.db2.gz ODOMQSSITKGDTM-MOPGFXCFSA-N 2 0 331.548 4.161 20 10 EICDRP Oc1ccccc1C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172060499 1049841997 /nfs/dbraw/zinc/84/19/97/1049841997.db2.gz ATEKAMYXYASFHP-MZADTFQBSA-N 2 0 336.479 4.068 20 10 EICDRP CC[NH+](CC)C1CCC([NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001173101084 1050303549 /nfs/dbraw/zinc/30/35/49/1050303549.db2.gz CQOFLPPJIUWHLP-UHFFFAOYSA-N 2 0 343.559 4.420 20 10 EICDRP CCCN(c1ccc(C[NH3+])cc1)C1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1 ZINC001181444870 1051225636 /nfs/dbraw/zinc/22/56/36/1051225636.db2.gz HRNTZMWSLVZWRS-PGRDOPGGSA-N 2 0 343.559 4.405 20 10 EICDRP CC[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1cc(Cl)ccc1O ZINC000775511830 1051660198 /nfs/dbraw/zinc/66/01/98/1051660198.db2.gz KEJFRQLSSDKVKG-GOSISDBHSA-N 2 0 336.907 4.493 20 10 EICDRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000765773254 1054886407 /nfs/dbraw/zinc/88/64/07/1054886407.db2.gz ZIDCBXIBILJZJJ-SFHVURJKSA-N 2 0 329.532 4.059 20 10 EICDRP Cc1cccc(C[NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)c1O ZINC000776251835 1055057298 /nfs/dbraw/zinc/05/72/98/1055057298.db2.gz DLHXMIFIXDHADO-AZUAARDMSA-N 2 0 338.495 4.091 20 10 EICDRP CCN(C)c1ccc([C@H](C)[NH2+]Cc2cccc(C[N@H+](C)CC)c2)cc1 ZINC000765776411 1055113678 /nfs/dbraw/zinc/11/36/78/1055113678.db2.gz PSVPTUAHVJKOLH-SFHVURJKSA-N 2 0 339.527 4.445 20 10 EICDRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(N2CCCCCC2)cc1 ZINC000765778804 1055273156 /nfs/dbraw/zinc/27/31/56/1055273156.db2.gz LVINDEJPVJXISV-LJQANCHMSA-N 2 0 343.559 4.450 20 10 EICDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)C1 ZINC000765784608 1055303271 /nfs/dbraw/zinc/30/32/71/1055303271.db2.gz SJEQBRPAXWJYBT-WOJBJXKFSA-N 2 0 343.559 4.448 20 10 EICDRP C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311038625 1022826225 /nfs/dbraw/zinc/82/62/25/1022826225.db2.gz DSSMFDLBNLQJJP-SOLBZPMBSA-N 2 0 342.458 4.093 20 10 EICDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCN(C)[C@H]2c2cccs2)c1 ZINC000363870730 1022875159 /nfs/dbraw/zinc/87/51/59/1022875159.db2.gz YHOKJFBPHPSZNU-QMTMVMCOSA-N 2 0 330.497 4.106 20 10 EICDRP C[C@@H]([NH2+]C1CCN([C@@H](C)c2ccccc2)CC1)c1ccc(F)cc1[O-] ZINC000185469420 1023045297 /nfs/dbraw/zinc/04/52/97/1023045297.db2.gz VQBLCFOMKHZVQV-CVEARBPZSA-N 2 0 342.458 4.408 20 10 EICDRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(N(C)C)cc1 ZINC000162910164 1025146881 /nfs/dbraw/zinc/14/68/81/1025146881.db2.gz VZBVQKCABIMUGT-GOSISDBHSA-N 2 0 337.511 4.199 20 10 EICDRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000192927047 1029648297 /nfs/dbraw/zinc/64/82/97/1029648297.db2.gz RKIYOHYCGRQKHI-INIZCTEOSA-N 2 0 342.483 4.093 20 10 EICDRP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(N(C)C)cc1 ZINC000157523044 1037637883 /nfs/dbraw/zinc/63/78/83/1037637883.db2.gz XDRYLHGORHUOES-KRWDZBQOSA-N 2 0 329.532 4.200 20 10 EICDRP CCc1cc(C[NH+]2CCC(C[NH+](C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000738077023 1045031935 /nfs/dbraw/zinc/03/19/35/1045031935.db2.gz QJUBMVKHHJEXEM-UHFFFAOYSA-N 2 0 332.532 4.026 20 10 EICDRP Cc1cc(O)c(C[NH+]2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)cc1C ZINC000738107826 1045040660 /nfs/dbraw/zinc/04/06/60/1045040660.db2.gz OQKFPQSDIKYFEG-OALUTQOASA-N 2 0 330.516 4.095 20 10 EICDRP CCCN(CCC)c1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000915682839 1045446681 /nfs/dbraw/zinc/44/66/81/1045446681.db2.gz SAVUBUVMSYZVMF-CTNGQTDRSA-N 2 0 329.532 4.029 20 10 EICDRP Cc1cc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c(C)n1-c1cccc(C)c1 ZINC000915683210 1045448103 /nfs/dbraw/zinc/44/81/03/1045448103.db2.gz PDZIYIFKXAZKBO-NHCUHLMSSA-N 2 0 337.511 4.119 20 10 EICDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(-c3ccccc3)ccc2O)C[C@H]1C ZINC000769469619 1045987345 /nfs/dbraw/zinc/98/73/45/1045987345.db2.gz BRJMWTDZIACZDY-DYESRHJHSA-N 2 0 338.495 4.364 20 10 EICDRP Cc1cc(C)c([C@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)c(O)c1 ZINC000815587097 1048525000 /nfs/dbraw/zinc/52/50/00/1048525000.db2.gz ZHCAVDQZBXEDAN-VIQWUECVSA-N 2 0 330.516 4.457 20 10 EICDRP CCCn1ccnc1CCC[N@H+](C)Cc1ccc2ccccc2c1O ZINC000816611798 1048843497 /nfs/dbraw/zinc/84/34/97/1048843497.db2.gz XJAOSRMZZCJYOY-UHFFFAOYSA-N 2 0 337.467 4.217 20 10 EICDRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(Br)cc2O)cc1 ZINC000817962547 1049068433 /nfs/dbraw/zinc/06/84/33/1049068433.db2.gz KAZMONNIHMHJKZ-NEPJUHHUSA-N 2 0 349.272 4.025 20 10 EICDRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cc(Br)ccc2O)cc1 ZINC000817963793 1049070343 /nfs/dbraw/zinc/07/03/43/1049070343.db2.gz VBFLNWYQQPGFPL-RYUDHWBXSA-N 2 0 349.272 4.025 20 10 EICDRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(N2CCCCCC2)cc1 ZINC000817980054 1049077250 /nfs/dbraw/zinc/07/72/50/1049077250.db2.gz IONGKNRLNQPYCT-ICSRJNTNSA-N 2 0 329.532 4.250 20 10 EICDRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(N2CCCCCC2)cc1 ZINC000817980052 1049078217 /nfs/dbraw/zinc/07/82/17/1049078217.db2.gz IONGKNRLNQPYCT-AZUAARDMSA-N 2 0 329.532 4.250 20 10 EICDRP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000817985018 1049079117 /nfs/dbraw/zinc/07/91/17/1049079117.db2.gz FNJJSHTVNGUJOF-PKOBYXMFSA-N 2 0 327.516 4.002 20 10 EICDRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc(N2CCCCCC2)cc1 ZINC000817985060 1049080950 /nfs/dbraw/zinc/08/09/50/1049080950.db2.gz GEQRFFMCHVTISK-MJUUVYJYSA-N 2 0 341.543 4.106 20 10 EICDRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817985277 1049081061 /nfs/dbraw/zinc/08/10/61/1049081061.db2.gz IURIMUAOTWEWTC-SJLPKXTDSA-N 2 0 345.506 4.141 20 10 EICDRP CC[N@H+](CCC[NH2+]C/C=C\c1ccc(N(C)C)cc1)C1CCCCC1 ZINC001179090692 1050630355 /nfs/dbraw/zinc/63/03/55/1050630355.db2.gz IBFAXHVDJXCKBO-NTMALXAHSA-N 2 0 343.559 4.400 20 10 EICDRP CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CCN2C2CCCCCC2)cc1 ZINC001179386097 1050686186 /nfs/dbraw/zinc/68/61/86/1050686186.db2.gz HJWMHLHTIQSRMQ-DORXLWPQSA-N 2 0 341.543 4.153 20 10 EICDRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccc(OC)c(C)c2)c1 ZINC000069716276 1050773154 /nfs/dbraw/zinc/77/31/54/1050773154.db2.gz LSQNRXIJZINNJV-UHFFFAOYSA-N 2 0 326.484 4.135 20 10 EICDRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc(Cl)c(Cl)cc2[O-])C1 ZINC000774160784 1051488481 /nfs/dbraw/zinc/48/84/81/1051488481.db2.gz BDMWMNYXOOHWDL-CHWSQXEVSA-N 2 0 345.314 4.470 20 10 EICDRP Cc1c2ccccc2n(C)c1C[NH2+]CCCC[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC001199319419 1054391201 /nfs/dbraw/zinc/39/12/01/1054391201.db2.gz BAVASSRUQDEZSC-ROUUACIJSA-N 2 0 341.543 4.334 20 10 EICDRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(N2CCCCC2)cc1 ZINC000125281007 1054761070 /nfs/dbraw/zinc/76/10/70/1054761070.db2.gz QWQDFQPSGOOKHG-SFHVURJKSA-N 2 0 329.532 4.059 20 10 EICDRP C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001201946483 1054962166 /nfs/dbraw/zinc/96/21/66/1054962166.db2.gz FESZYIKSGKQCQJ-ICSRJNTNSA-N 2 0 341.543 4.029 20 10 EICDRP CCc1cc(C[NH+]2CC[C@H](C[N@@H+](C)CC)C2)c(O)c(C(C)(C)C)c1 ZINC000743398459 1058981016 /nfs/dbraw/zinc/98/10/16/1058981016.db2.gz FPTOGZBAQLBEPU-QGZVFWFLSA-N 2 0 332.532 4.026 20 10 EICDRP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc2ccccc2c1O ZINC000193929122 1032186739 /nfs/dbraw/zinc/18/67/39/1032186739.db2.gz VCLANZVWTVSCRP-HNNXBMFYSA-N 2 0 326.484 4.459 20 10 EICDRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000325580894 1021027191 /nfs/dbraw/zinc/02/71/91/1021027191.db2.gz NXEFDQWODMHHCP-HNNXBMFYSA-N 2 0 330.447 4.224 20 10 EICDRP CC[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc(N(C)C)cc1 ZINC000160482730 1021961507 /nfs/dbraw/zinc/96/15/07/1021961507.db2.gz BCCZUOKNOOUACT-OAQYLSRUSA-N 2 0 329.532 4.200 20 10 EICDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000310807620 1022393424 /nfs/dbraw/zinc/39/34/24/1022393424.db2.gz HZTJGHJQKNHAIZ-CMKODMSKSA-N 2 0 338.495 4.262 20 10 EICDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000310901391 1022570616 /nfs/dbraw/zinc/57/06/16/1022570616.db2.gz MVAMSXCFCWQUQB-QUCCMNQESA-N 2 0 338.495 4.263 20 10 EICDRP Cc1ccc([C@H](C)[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)c(O)c1 ZINC000311001917 1022811975 /nfs/dbraw/zinc/81/19/75/1022811975.db2.gz JTMUDQQFUFLIHG-PGRDOPGGSA-N 2 0 338.495 4.263 20 10 EICDRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(N2CCCCCC2)cc1 ZINC000158186231 1026554580 /nfs/dbraw/zinc/55/45/80/1026554580.db2.gz IJMADYJRUCMWKC-OALUTQOASA-N 2 0 329.532 4.059 20 10 EICDRP Cc1c2ccccc2n(C)c1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000475192885 1029406113 /nfs/dbraw/zinc/40/61/13/1029406113.db2.gz HGNNJDPMOPFQBR-UHFFFAOYSA-N 2 0 339.527 4.373 20 10 EICDRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)C1 ZINC000163281351 1029980687 /nfs/dbraw/zinc/98/06/87/1029980687.db2.gz PYDNASLGUYXKOY-RBUKOAKNSA-N 2 0 329.532 4.059 20 10 EICDRP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccc2ccccc2c1O ZINC000323861762 1035717938 /nfs/dbraw/zinc/71/79/38/1035717938.db2.gz PAMUCUUFSBLOCP-IRXDYDNUSA-N 2 0 326.484 4.461 20 10 EICDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(-c3ccccc3)ccc2O)C[C@@H]1C ZINC000769469623 1045984979 /nfs/dbraw/zinc/98/49/79/1045984979.db2.gz BRJMWTDZIACZDY-LAUBAEHRSA-N 2 0 338.495 4.364 20 10 EICDRP C[NH+](C)CCCC1CC[NH+](Cc2ccc3ccccc3c2O)CC1 ZINC000816515934 1048824731 /nfs/dbraw/zinc/82/47/31/1048824731.db2.gz PLTYJXNVHROBCB-UHFFFAOYSA-N 2 0 326.484 4.099 20 10 EICDRP Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000817982175 1049077277 /nfs/dbraw/zinc/07/72/77/1049077277.db2.gz ZAPNKWYWRHCGQK-FPOVZHCZSA-N 2 0 338.495 4.188 20 10 EICDRP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N2CCCCCC2)cc1 ZINC000817987210 1049080853 /nfs/dbraw/zinc/08/08/53/1049080853.db2.gz YHBIBALJIAECOQ-QUCCMNQESA-N 2 0 341.543 4.392 20 10 EICDRP CC[NH+](CC)CCCC1CC[NH+](Cc2ccc(Cl)cc2O)CC1 ZINC001180820972 1051085133 /nfs/dbraw/zinc/08/51/33/1051085133.db2.gz UUPFYWWWYPDHFC-UHFFFAOYSA-N 2 0 338.923 4.380 20 10 EICDRP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(C)cc1O ZINC000794819314 1053434567 /nfs/dbraw/zinc/43/45/67/1053434567.db2.gz UQHLJOPMNHZVLW-ZWOKBUDYSA-N 2 0 330.516 4.394 20 10 EICDRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(C)cc1O ZINC000794826704 1053439652 /nfs/dbraw/zinc/43/96/52/1053439652.db2.gz CXCYDADVWZBXHC-FPOVZHCZSA-N 2 0 338.495 4.263 20 10 EICDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)C1 ZINC000765292681 1053498640 /nfs/dbraw/zinc/49/86/40/1053498640.db2.gz WYMVORXCVBHMQA-WOJBJXKFSA-N 2 0 343.559 4.450 20 10 EICDRP C[C@H]1C[C@H]([NH2+]Cc2ccc(N(C)C3CCCCC3)cc2)CC[N@@H+]1C ZINC000765446023 1053551672 /nfs/dbraw/zinc/55/16/72/1053551672.db2.gz PEYOMIRFWBLMGB-PKOBYXMFSA-N 2 0 329.532 4.028 20 10 EICDRP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC001199329190 1054392365 /nfs/dbraw/zinc/39/23/65/1054392365.db2.gz PIDLSDGQBVUVHR-PMACEKPBSA-N 2 0 343.559 4.135 20 10 EICDRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)CC1 ZINC000765768550 1054806976 /nfs/dbraw/zinc/80/69/76/1054806976.db2.gz IDMBUYAEDMELTR-IBGZPJMESA-N 2 0 343.559 4.450 20 10 EICDRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766476387 1060386584 /nfs/dbraw/zinc/38/65/84/1060386584.db2.gz XVZJYNVSAGCNCE-HFSMHLIXSA-N 2 0 329.532 4.200 20 10 EICDRP CC[C@H]([NH2+]C[C@@]1(C)CC[N@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000310942361 1022669585 /nfs/dbraw/zinc/66/95/85/1022669585.db2.gz WOHGNINCJZPJFJ-RBBKRZOGSA-N 2 0 338.495 4.345 20 10 EICDRP Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000310807617 1023441609 /nfs/dbraw/zinc/44/16/09/1023441609.db2.gz HZTJGHJQKNHAIZ-BJLQDIEVSA-N 2 0 338.495 4.262 20 10 EICDRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001167825985 1025616303 /nfs/dbraw/zinc/61/63/03/1025616303.db2.gz LYAIXVVZGLUWOU-LJQANCHMSA-N 2 0 331.548 4.229 20 10 EICDRP CCN(Cc1ccccc1)c1ccc(C[NH2+]CCCn2ccnc2)cc1 ZINC000060806683 1036490850 /nfs/dbraw/zinc/49/08/50/1036490850.db2.gz JCTVLTHTVBIFMB-UHFFFAOYSA-N 2 0 348.494 4.090 20 10 EICDRP Cc1cc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c(C)n1-c1cccc(C)c1 ZINC000915683211 1045447598 /nfs/dbraw/zinc/44/75/98/1045447598.db2.gz PDZIYIFKXAZKBO-RTWAWAEBSA-N 2 0 337.511 4.119 20 10 EICDRP CCCN(CCC)c1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000915682840 1045447835 /nfs/dbraw/zinc/44/78/35/1045447835.db2.gz SAVUBUVMSYZVMF-FPOVZHCZSA-N 2 0 329.532 4.029 20 10 EICDRP C[NH+]1CCN(c2ccc(C[NH2+][C@@H](CC3CC3)c3ccccc3)cc2)CC1 ZINC000771840032 1046500036 /nfs/dbraw/zinc/50/00/36/1046500036.db2.gz DBTPSFCXMLBVDI-QHCPKHFHSA-N 2 0 349.522 4.069 20 10 EICDRP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(C(F)(F)F)cc1O ZINC000824988784 1048016198 /nfs/dbraw/zinc/01/61/98/1048016198.db2.gz SUUGXHKIHJHXIF-HUORLRHWSA-N 2 0 342.405 4.077 20 10 EICDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2ccc(C(F)(F)F)cc2O)C1 ZINC000810212444 1048682986 /nfs/dbraw/zinc/68/29/86/1048682986.db2.gz BCUAUCKZNUHZJU-BBRMVZONSA-N 2 0 344.421 4.184 20 10 EICDRP CC[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1O ZINC000810215204 1048684769 /nfs/dbraw/zinc/68/47/69/1048684769.db2.gz AKYCSVRBFZVSNX-MRXNPFEDSA-N 2 0 344.421 4.184 20 10 EICDRP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)c1 ZINC000845973101 1048773926 /nfs/dbraw/zinc/77/39/26/1048773926.db2.gz XJTMCZFEYXTUCF-GQIGUUNPSA-N 2 0 346.515 4.095 20 10 EICDRP C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)[C@H]1CCC[NH2+]C1 ZINC000817946631 1049063712 /nfs/dbraw/zinc/06/37/12/1049063712.db2.gz BVPZZCHMVBXFRU-NSHGMRRFSA-N 2 0 329.532 4.106 20 10 EICDRP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc(N2CCCCCC2)cc1 ZINC000817965015 1049071848 /nfs/dbraw/zinc/07/18/48/1049071848.db2.gz MTNYEEAHGBFJLI-WIYYLYMNSA-N 2 0 329.532 4.107 20 10 EICDRP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N2CCCCCC2)cc1 ZINC000817987208 1049079323 /nfs/dbraw/zinc/07/93/23/1049079323.db2.gz YHBIBALJIAECOQ-AZUAARDMSA-N 2 0 341.543 4.392 20 10 EICDRP Cc1c2ccccc2n(C)c1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC001177679516 1050276035 /nfs/dbraw/zinc/27/60/35/1050276035.db2.gz RXPTZEOZMOJWAQ-UHFFFAOYSA-N 2 0 327.516 4.233 20 10 EICDRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1ccccc1O ZINC000183420600 1051116568 /nfs/dbraw/zinc/11/65/68/1051116568.db2.gz JSZCVJVYKKBOSD-GOSISDBHSA-N 2 0 338.495 4.475 20 10 EICDRP CC[C@H]([NH2+]Cc1ccc(-n2ccnc2)cc1)c1cc(Cl)ccc1O ZINC000775490301 1051575679 /nfs/dbraw/zinc/57/56/79/1051575679.db2.gz VPTNUPXHJUNCJR-SFHVURJKSA-N 2 0 341.842 4.472 20 10 EICDRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c(O)c1C ZINC000794829135 1053439747 /nfs/dbraw/zinc/43/97/47/1053439747.db2.gz STQUVLSVKQMRIY-UYAOXDASSA-N 2 0 338.495 4.182 20 10 EICDRP CC[N@H+](CCC1CC[NH+](Cc2cccc(C)c2O)CC1)CC1CC1 ZINC000775758874 1053840469 /nfs/dbraw/zinc/84/04/69/1053840469.db2.gz DODDPHFERGUVLO-UHFFFAOYSA-N 2 0 330.516 4.035 20 10 EICDRP Cc1c2ccccc2n(C)c1C[NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC001199319416 1054390250 /nfs/dbraw/zinc/39/02/50/1054390250.db2.gz BAVASSRUQDEZSC-QZTJIDSGSA-N 2 0 341.543 4.334 20 10 EICDRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000858490318 1054498305 /nfs/dbraw/zinc/49/83/05/1054498305.db2.gz GFFVUCAMFHEDHI-MOPGFXCFSA-N 2 0 329.532 4.059 20 10 EICDRP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc(N2CCCCC2)cc1 ZINC000873237697 1054511456 /nfs/dbraw/zinc/51/14/56/1054511456.db2.gz PGNKTHMQKOULRM-SFHVURJKSA-N 2 0 349.522 4.173 20 10 EICDRP CCN(Cc1ccccc1)c1ccc(C[NH2+]CC2=CC[N@H+](C)CC2)cc1 ZINC000776258794 1055077506 /nfs/dbraw/zinc/07/75/06/1055077506.db2.gz VTJHTUCNSRDGIC-UHFFFAOYSA-N 2 0 349.522 4.065 20 10 EICDRP Cc1cc(O)c(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1C(C)C ZINC000742169549 1058529196 /nfs/dbraw/zinc/52/91/96/1058529196.db2.gz SOASFORPSCJXLK-SFHVURJKSA-N 2 0 330.516 4.132 20 10 EICDRP CCc1cc(C[NH+]2CC[C@@H](C[N@@H+](C)CC)C2)c(O)c(C(C)(C)C)c1 ZINC000743398458 1058978760 /nfs/dbraw/zinc/97/87/60/1058978760.db2.gz FPTOGZBAQLBEPU-KRWDZBQOSA-N 2 0 332.532 4.026 20 10 EICDRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(N2CCCCC2)cc1 ZINC000766476386 1060385870 /nfs/dbraw/zinc/38/58/70/1060385870.db2.gz XVZJYNVSAGCNCE-FBBABVLZSA-N 2 0 329.532 4.200 20 10 EICDRP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)ccc1O ZINC000311038626 1022825957 /nfs/dbraw/zinc/82/59/57/1022825957.db2.gz DSSMFDLBNLQJJP-XYJFISCASA-N 2 0 342.458 4.093 20 10 EICDRP Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)c1 ZINC000185192147 1023018597 /nfs/dbraw/zinc/01/85/97/1023018597.db2.gz IDFSNPNXKLRXNF-QGZVFWFLSA-N 2 0 326.484 4.392 20 10 EICDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+]C1CCC([NH+](C)C)CC1 ZINC001168315906 1038826318 /nfs/dbraw/zinc/82/63/18/1038826318.db2.gz QJTYGQMCBLILFF-PMTKGXAQSA-N 2 0 330.516 4.095 20 10 EICDRP c1cc(N2CCCCC2)ccc1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC000733326730 1044187366 /nfs/dbraw/zinc/18/73/66/1044187366.db2.gz WIONSAPESGCQSR-UHFFFAOYSA-N 2 0 343.559 4.423 20 10 EICDRP C[C@@H]([NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)c1ccccc1O ZINC000895460116 1044758774 /nfs/dbraw/zinc/75/87/74/1044758774.db2.gz JKZPCXNQIXFWSD-MDNKFWRPSA-N 2 0 336.479 4.096 20 10 EICDRP C[C@@H]([NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1)c1ccccc1O ZINC001168030475 1044794972 /nfs/dbraw/zinc/79/49/72/1044794972.db2.gz VXOVCLHXSKLGSP-OKZBNKHCSA-N 2 0 338.495 4.484 20 10 EICDRP C[NH+](C)CC1CC[NH+](Cc2cc3oc4ccccc4c3cc2O)CC1 ZINC000738075589 1045031145 /nfs/dbraw/zinc/03/11/45/1045031145.db2.gz FSFHMXBPNCXEEZ-UHFFFAOYSA-N 2 0 338.451 4.065 20 10 EICDRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(-c3ccccc3)ccc2O)[C@@H](C)C1 ZINC000769482763 1045969164 /nfs/dbraw/zinc/96/91/64/1045969164.db2.gz DYWYWNIQRSLXSU-LAUBAEHRSA-N 2 0 338.495 4.221 20 10 EICDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)c1O ZINC000808701055 1048080584 /nfs/dbraw/zinc/08/05/84/1048080584.db2.gz OTZMKKHIPRFOLL-CQSZACIVSA-N 2 0 336.907 4.412 20 10 EICDRP Oc1ccc(-c2ccccc2)cc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000815151819 1048349479 /nfs/dbraw/zinc/34/94/79/1048349479.db2.gz UVTXLIOGNWHNLK-UHFFFAOYSA-N 2 0 338.495 4.415 20 10 EICDRP Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]CCC1CC[NH2+]CC1 ZINC000844926557 1048549808 /nfs/dbraw/zinc/54/98/08/1048549808.db2.gz WIXBJNUQLPUJOQ-OAQYLSRUSA-N 2 0 338.495 4.045 20 10 EICDRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](CC)c2ccc(C(F)(F)F)cc2O)C1 ZINC000810212447 1048682779 /nfs/dbraw/zinc/68/27/79/1048682779.db2.gz BCUAUCKZNUHZJU-XJKSGUPXSA-N 2 0 344.421 4.184 20 10 EICDRP CC[C@H]([NH2+]CC1CC[NH+](CC)CC1)c1ccc(C(F)(F)F)cc1O ZINC000810215653 1048684366 /nfs/dbraw/zinc/68/43/66/1048684366.db2.gz IZHHMFVECAPVSH-INIZCTEOSA-N 2 0 344.421 4.184 20 10 EICDRP CC[C@@H]([NH2+]CC1CC[NH+](CC)CC1)c1ccc(C(F)(F)F)cc1O ZINC000810215654 1048684670 /nfs/dbraw/zinc/68/46/70/1048684670.db2.gz IZHHMFVECAPVSH-MRXNPFEDSA-N 2 0 344.421 4.184 20 10 EICDRP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)c1 ZINC000845973100 1048772126 /nfs/dbraw/zinc/77/21/26/1048772126.db2.gz XJTMCZFEYXTUCF-FTRWYGJKSA-N 2 0 346.515 4.095 20 10 EICDRP COc1cccc([C@H](C)[NH2+]C2CC[NH+](CC3CCCCC3)CC2)c1O ZINC000846143329 1048831585 /nfs/dbraw/zinc/83/15/85/1048831585.db2.gz ZKDUHVBEOJLJSE-INIZCTEOSA-N 2 0 346.515 4.096 20 10 EICDRP CC[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(C(F)(F)F)cc1O ZINC000817984941 1049080451 /nfs/dbraw/zinc/08/04/51/1049080451.db2.gz CREFYLTWQPJZQD-DZGCQCFKSA-N 2 0 342.405 4.126 20 10 EICDRP C[C@H]([NH3+])c1ccc(N([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)cc1 ZINC001170645365 1049296694 /nfs/dbraw/zinc/29/66/94/1049296694.db2.gz DJJGNSVTNVOHAD-FDPRUJNXSA-N 2 0 349.522 4.339 20 10 EICDRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1ccccc1O ZINC000183396668 1051108884 /nfs/dbraw/zinc/10/88/84/1051108884.db2.gz VLENPYVVIXOUSD-SFHVURJKSA-N 2 0 338.495 4.475 20 10 EICDRP CCCN(c1ccc(C[NH3+])cc1)C1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1 ZINC001181444868 1051226658 /nfs/dbraw/zinc/22/66/58/1051226658.db2.gz HRNTZMWSLVZWRS-AVRDEDQJSA-N 2 0 343.559 4.405 20 10 EICDRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000185016411 1052369965 /nfs/dbraw/zinc/36/99/65/1052369965.db2.gz ZNGISTCANPORHL-HNNXBMFYSA-N 2 0 330.447 4.222 20 10 EICDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000185062165 1052388778 /nfs/dbraw/zinc/38/87/78/1052388778.db2.gz NUHLSOZKNAFJEF-QGZVFWFLSA-N 2 0 326.484 4.393 20 10 EICDRP C[C@@H]([NH2+]CCCCNc1ccccn1)c1ccc2ccccc2c1O ZINC000185325619 1052582797 /nfs/dbraw/zinc/58/27/97/1052582797.db2.gz PAOHGWWOGZZBIT-MRXNPFEDSA-N 2 0 335.451 4.483 20 10 EICDRP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccc2ccccc2c1O ZINC000850581513 1053331686 /nfs/dbraw/zinc/33/16/86/1053331686.db2.gz FZVFIRNKDHOLKB-INIZCTEOSA-N 2 0 338.495 4.318 20 10 EICDRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(C)cc1O ZINC000794826702 1053440181 /nfs/dbraw/zinc/44/01/81/1053440181.db2.gz CXCYDADVWZBXHC-CTNGQTDRSA-N 2 0 338.495 4.263 20 10 EICDRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(Cl)ccc1O ZINC000794827575 1053440311 /nfs/dbraw/zinc/44/03/11/1053440311.db2.gz KXMJLTBMFQSIDQ-DOTOQJQBSA-N 2 0 344.886 4.218 20 10 EICDRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(N(C)C)cc1 ZINC000123016980 1054077255 /nfs/dbraw/zinc/07/72/55/1054077255.db2.gz KTURABOMDZCDJG-GOSISDBHSA-N 2 0 337.511 4.199 20 10 EICDRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000858490319 1054499099 /nfs/dbraw/zinc/49/90/99/1054499099.db2.gz GFFVUCAMFHEDHI-OALUTQOASA-N 2 0 329.532 4.059 20 10 EICDRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)C1 ZINC000765784605 1055303659 /nfs/dbraw/zinc/30/36/59/1055303659.db2.gz SJEQBRPAXWJYBT-UXHICEINSA-N 2 0 343.559 4.448 20 10 EICDRP CC[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000310799477 1032522860 /nfs/dbraw/zinc/52/28/60/1032522860.db2.gz GKCCAZLLRIWOCX-CUWPLCDZSA-N 2 0 338.495 4.344 20 10 EICDRP CC[C@@H]([NH2+]Cc1ccc(C[NH+](CC)CC)cc1)c1ccccc1O ZINC000323947569 1039061560 /nfs/dbraw/zinc/06/15/60/1039061560.db2.gz MPHWITJDOIADLY-HXUWFJFHSA-N 2 0 326.484 4.475 20 10 EICDRP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)ccc1O ZINC000311038126 1039863250 /nfs/dbraw/zinc/86/32/50/1039863250.db2.gz DSSMFDLBNLQJJP-BQFCYCMXSA-N 2 0 342.458 4.093 20 10 EICDRP Cc1nccn1CCCC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000742373884 1045655304 /nfs/dbraw/zinc/65/53/04/1045655304.db2.gz TWJBAMAHHZRTPR-UHFFFAOYSA-N 2 0 335.451 4.134 20 10 EICDRP Cc1cc(O)c(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1C(C)C ZINC000772828686 1046163297 /nfs/dbraw/zinc/16/32/97/1046163297.db2.gz PFAGSLWRNNNNGB-UWJYYQICSA-N 2 0 342.527 4.273 20 10 EICDRP CC1CC[NH+](CCCC[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816535377 1048825323 /nfs/dbraw/zinc/82/53/23/1048825323.db2.gz NEWRUJOWIMMFBT-UHFFFAOYSA-N 2 0 326.484 4.147 20 10 EICDRP Oc1c(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)ccc2ccccc21 ZINC000816561657 1048836172 /nfs/dbraw/zinc/83/61/72/1048836172.db2.gz GSDTYLYBEMKBKK-UHFFFAOYSA-N 2 0 346.474 4.431 20 10 EICDRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(N2CCCCC2)cc1 ZINC000817585986 1049016775 /nfs/dbraw/zinc/01/67/75/1049016775.db2.gz KKIBPIFCQRMKJS-KKXNLOMOSA-N 2 0 329.532 4.200 20 10 EICDRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc(N2CCCCCC2)cc1 ZINC000817946628 1049060673 /nfs/dbraw/zinc/06/06/73/1049060673.db2.gz BVPZZCHMVBXFRU-BJLQDIEVSA-N 2 0 329.532 4.106 20 10 EICDRP CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000817981296 1049076490 /nfs/dbraw/zinc/07/64/90/1049076490.db2.gz IQELDLFYGJRSJA-UTKZUKDTSA-N 2 0 325.500 4.274 20 10 EICDRP C[C@@H]1C[C@@H]([NH2+][C@H](CCC[NH3+])c2ccccc2)c2c1c(F)ccc2O ZINC000817983248 1049078336 /nfs/dbraw/zinc/07/83/36/1049078336.db2.gz LDEPXRPLZWKFTG-KBRIMQKVSA-N 2 0 328.431 4.149 20 10 EICDRP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)c1 ZINC000813331418 1049753449 /nfs/dbraw/zinc/75/34/49/1049753449.db2.gz ONUFDYVGTLVIEY-SOLBZPMBSA-N 2 0 346.515 4.095 20 10 EICDRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1ccccc1O ZINC000183396683 1051108444 /nfs/dbraw/zinc/10/84/44/1051108444.db2.gz VLENPYVVIXOUSD-GOSISDBHSA-N 2 0 338.495 4.475 20 10 EICDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N3CCCCC3)c(C)c2)C[C@H]1C ZINC001191418177 1051452763 /nfs/dbraw/zinc/45/27/63/1051452763.db2.gz SDYYPGLDVCZTJY-CTNGQTDRSA-N 2 0 343.559 4.290 20 10 EICDRP C[C@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)C[NH+]1CCCCC1 ZINC000325126356 1052984572 /nfs/dbraw/zinc/98/45/72/1052984572.db2.gz DAYPZMLTPZFYMW-IAGOWNOFSA-N 2 0 326.484 4.318 20 10 EICDRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(Cl)ccc1O ZINC000794827577 1053439611 /nfs/dbraw/zinc/43/96/11/1053439611.db2.gz KXMJLTBMFQSIDQ-RDJZCZTQSA-N 2 0 344.886 4.218 20 10 EICDRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N(C)C3CCCCC3)cc2)CC[N@@H+]1C ZINC000765446021 1053549812 /nfs/dbraw/zinc/54/98/12/1053549812.db2.gz PEYOMIRFWBLMGB-MJGOQNOKSA-N 2 0 329.532 4.028 20 10 EICDRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000123919295 1054330593 /nfs/dbraw/zinc/33/05/93/1054330593.db2.gz QVHGCQQUVLEEBW-QGZVFWFLSA-N 2 0 325.500 4.055 20 10 EICDRP Cc1c2ccccc2n(C)c1C[NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001199319413 1054391218 /nfs/dbraw/zinc/39/12/18/1054391218.db2.gz BAVASSRUQDEZSC-HDICACEKSA-N 2 0 341.543 4.334 20 10 EICDRP Cc1cc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000742169106 1058530469 /nfs/dbraw/zinc/53/04/69/1058530469.db2.gz NTAAUMFCQLNCOQ-GOSISDBHSA-N 2 0 344.543 4.306 20 10 EICDRP CCc1cc(C[N@H+]2CC[C@@H](C[NH+](CC)CC)C2)c(O)c(C(C)(C)C)c1 ZINC000743387008 1058971532 /nfs/dbraw/zinc/97/15/32/1058971532.db2.gz CGFLQFASZGHNEC-SFHVURJKSA-N 2 0 346.559 4.416 20 10 EICDRP C[NH+]1CCC(C[NH2+]Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)CC1 ZINC000729682809 1032145652 /nfs/dbraw/zinc/14/56/52/1032145652.db2.gz OXUVZUOQJDONLK-UHFFFAOYSA-N 2 0 346.559 4.419 20 10 EICDRP CN(c1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1)C1CCCCC1 ZINC000166382743 1023099501 /nfs/dbraw/zinc/09/95/01/1023099501.db2.gz CYFTWDCVXARCJW-DENIHFKCSA-N 2 0 341.543 4.172 20 10 EICDRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1O ZINC000183506880 1023374304 /nfs/dbraw/zinc/37/43/04/1023374304.db2.gz GDFBMCBPDSSEFP-OHSMVPPVSA-N 2 0 336.479 4.238 20 10 EICDRP CC[NH+](CC)Cc1cc(OC)ccc1N1C(C)(C)CC([NH3+])CC1(C)C ZINC001167626687 1027488696 /nfs/dbraw/zinc/48/86/96/1027488696.db2.gz RDMDBLLVURLJGV-UHFFFAOYSA-N 2 0 347.547 4.022 20 10 EICDRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccccc1O ZINC000248390963 1033846008 /nfs/dbraw/zinc/84/60/08/1033846008.db2.gz UNQUMBBENRJMAS-QZTJIDSGSA-N 2 0 338.495 4.475 20 10 EICDRP CCN(CC)c1ccc(C[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000727643571 1043256069 /nfs/dbraw/zinc/25/60/69/1043256069.db2.gz CAUSHEXFNUMJFG-IBGZPJMESA-N 2 0 331.548 4.277 20 10 EICDRP CCC[NH+]1CCC([N@H+](C)Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000768921159 1045860523 /nfs/dbraw/zinc/86/05/23/1045860523.db2.gz XDUXMPCWZKLPLV-UHFFFAOYSA-N 2 0 338.495 4.365 20 10 EICDRP CC[N@@H+](Cc1cc(C)ccc1O)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000769530886 1046008472 /nfs/dbraw/zinc/00/84/72/1046008472.db2.gz ODUFQEFLKQOXBW-HXUWFJFHSA-N 2 0 338.495 4.045 20 10 EICDRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)c1 ZINC000788596660 1047244227 /nfs/dbraw/zinc/24/42/27/1047244227.db2.gz ZQFHWDAITCXGGH-KRWDZBQOSA-N 2 0 326.484 4.312 20 10 EICDRP C[NH+]1CCC2(CCC[N@@H+]2Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000789559038 1047442430 /nfs/dbraw/zinc/44/24/30/1047442430.db2.gz IWHRYEGNRBLKKD-UHFFFAOYSA-N 2 0 336.479 4.119 20 10 EICDRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc(N2CCCCCC2)cc1 ZINC000844927426 1048551242 /nfs/dbraw/zinc/55/12/42/1048551242.db2.gz NIXRVGGYLUKQCS-GOSISDBHSA-N 2 0 329.532 4.107 20 10 EICDRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(N2CCCCC2)cc1 ZINC000817968491 1049072072 /nfs/dbraw/zinc/07/20/72/1049072072.db2.gz KFIDYDAULMGMJH-KRWDZBQOSA-N 2 0 335.495 4.131 20 10 EICDRP CC1(C[NH2+][C@@H](CCc2ccccc2)c2ccccc2O)CC[NH2+]CC1 ZINC000817965214 1049072739 /nfs/dbraw/zinc/07/27/39/1049072739.db2.gz RJLOVPQMYSUQBG-FQEVSTJZSA-N 2 0 338.495 4.045 20 10 EICDRP Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000817982176 1049076618 /nfs/dbraw/zinc/07/66/18/1049076618.db2.gz ZAPNKWYWRHCGQK-PZJWPPBQSA-N 2 0 338.495 4.188 20 10 EICDRP CC[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(N(C)C)cc1 ZINC000817980783 1049077225 /nfs/dbraw/zinc/07/72/25/1049077225.db2.gz DJUDTTUAXUZAPL-SFTDATJTSA-N 2 0 325.500 4.274 20 10 EICDRP C[C@@H]1C[C@@H]([NH2+][C@@H](CCC[NH3+])c2ccccc2)c2c1c(F)ccc2O ZINC000817983249 1049077582 /nfs/dbraw/zinc/07/75/82/1049077582.db2.gz LDEPXRPLZWKFTG-XOKHGSTOSA-N 2 0 328.431 4.149 20 10 EICDRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(N2CCCCCC2)cc1 ZINC000817984583 1049079561 /nfs/dbraw/zinc/07/95/61/1049079561.db2.gz USTJJZNAGPBKIX-GOSISDBHSA-N 2 0 327.516 4.027 20 10 EICDRP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc(N3CCCC3)cc2)CC1(C)C ZINC001171619806 1049766362 /nfs/dbraw/zinc/76/63/62/1049766362.db2.gz QYYGTDINTNOJMW-UHFFFAOYSA-N 2 0 329.532 4.028 20 10 EICDRP Oc1cccc2c1[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CC2 ZINC000297933865 1052106904 /nfs/dbraw/zinc/10/69/04/1052106904.db2.gz XUIMLBSYNRNHPM-OTYNDTSQSA-N 2 0 348.490 4.165 20 10 EICDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000185062319 1052388537 /nfs/dbraw/zinc/38/85/37/1052388537.db2.gz FBKBZLKKCHWYBA-HNNXBMFYSA-N 2 0 330.447 4.224 20 10 EICDRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(N2CCCCCC2)cc1 ZINC000764667091 1053261385 /nfs/dbraw/zinc/26/13/85/1053261385.db2.gz OWWKPIAKFXXLEO-LJQANCHMSA-N 2 0 329.532 4.204 20 10 EICDRP CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1 ZINC000120855751 1053629876 /nfs/dbraw/zinc/62/98/76/1053629876.db2.gz PCIQWSARXZDSIU-MRXNPFEDSA-N 2 0 343.490 4.194 20 10 EICDRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC001199329189 1054392497 /nfs/dbraw/zinc/39/24/97/1054392497.db2.gz PIDLSDGQBVUVHR-BGYRXZFFSA-N 2 0 343.559 4.135 20 10 EICDRP CC[C@@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)c1ccc(N(C)C)cc1 ZINC000765777777 1055273425 /nfs/dbraw/zinc/27/34/25/1055273425.db2.gz YXRLHZRHEJSOSQ-JOCHJYFZSA-N 2 0 339.527 4.445 20 10 EICDRP CCCN(CCC)c1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC000742380997 1058580890 /nfs/dbraw/zinc/58/08/90/1058580890.db2.gz UUARGSFIUXDCMV-XDNSSPFJSA-N 2 0 343.559 4.418 20 10 EICDRP C[C@H](CC[NH2+][C@@H](C)c1cc(F)ccc1O)[N@H+](C)Cc1ccccc1 ZINC000379643758 1059710369 /nfs/dbraw/zinc/71/03/69/1059710369.db2.gz GBOBYXFWNHERPV-CVEARBPZSA-N 2 0 330.447 4.093 20 10 EICDRP Cc1cc(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000746382964 1060263857 /nfs/dbraw/zinc/26/38/57/1060263857.db2.gz QELJXBZNGHAELT-SFHVURJKSA-N 2 0 344.543 4.162 20 10 EICDRP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C(C)C)c1ccccc1O ZINC000155130777 1020276432 /nfs/dbraw/zinc/27/64/32/1020276432.db2.gz NOPCHZDRSNAURX-HXUWFJFHSA-N 2 0 326.484 4.473 20 10 EICDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCN(C)[C@@H]2c2cccs2)c1 ZINC000363870728 1022875647 /nfs/dbraw/zinc/87/56/47/1022875647.db2.gz YHOKJFBPHPSZNU-KHYOSLBOSA-N 2 0 330.497 4.106 20 10 EICDRP Cc1ccc([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c(O)c1 ZINC000186165075 1023102067 /nfs/dbraw/zinc/10/20/67/1023102067.db2.gz BXAKIFSGBYPJEA-LMDPOFIKSA-N 2 0 330.516 4.394 20 10 EICDRP Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000310901388 1023465855 /nfs/dbraw/zinc/46/58/55/1023465855.db2.gz MVAMSXCFCWQUQB-ICSRJNTNSA-N 2 0 338.495 4.263 20 10 EICDRP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(N2CCCCC2)cc1 ZINC000178257145 1023875711 /nfs/dbraw/zinc/87/57/11/1023875711.db2.gz XYPMGKIULBJQKA-GOSISDBHSA-N 2 0 341.543 4.202 20 10 EICDRP C[C@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1ccc2ccccc2c1O ZINC000760899505 1037650987 /nfs/dbraw/zinc/65/09/87/1037650987.db2.gz ZCQDZFCLKODIQG-INIZCTEOSA-N 2 0 326.484 4.318 20 10 EICDRP Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(O)c1 ZINC000788796733 1047304780 /nfs/dbraw/zinc/30/47/80/1047304780.db2.gz IBGDKFRDFORILG-ICSRJNTNSA-N 2 0 338.495 4.182 20 10 EICDRP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(C(F)(F)F)cc1O ZINC000824988876 1048016096 /nfs/dbraw/zinc/01/60/96/1048016096.db2.gz SUUGXHKIHJHXIF-NQKGRLOXSA-N 2 0 342.405 4.077 20 10 EICDRP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)c1 ZINC000845973102 1048773222 /nfs/dbraw/zinc/77/32/22/1048773222.db2.gz XJTMCZFEYXTUCF-GUXCAODWSA-N 2 0 346.515 4.095 20 10 EICDRP COc1cccc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c1O ZINC000846139912 1048830989 /nfs/dbraw/zinc/83/09/89/1048830989.db2.gz WPGQPVUFPZVTOR-MRXNPFEDSA-N 2 0 342.483 4.092 20 10 EICDRP Oc1c(C[NH+]2CCC(CCCn3ccnc3)CC2)ccc2ccccc21 ZINC000816611394 1048843291 /nfs/dbraw/zinc/84/32/91/1048843291.db2.gz OTJPFDOJJDJQQB-UHFFFAOYSA-N 2 0 349.478 4.434 20 10 EICDRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N2CCCCCC2)cc1 ZINC000817987211 1049079077 /nfs/dbraw/zinc/07/90/77/1049079077.db2.gz YHBIBALJIAECOQ-UYAOXDASSA-N 2 0 341.543 4.392 20 10 EICDRP CCN(CC)c1ccc(C[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC001177289280 1050177458 /nfs/dbraw/zinc/17/74/58/1050177458.db2.gz CMYQDXVCWJOBIE-PMACEKPBSA-N 2 0 345.575 4.381 20 10 EICDRP CCCN(c1ccc(C[NH3+])cc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000775140659 1050603213 /nfs/dbraw/zinc/60/32/13/1050603213.db2.gz PAQRVNROZSRAJU-UHFFFAOYSA-N 2 0 337.511 4.026 20 10 EICDRP CCCC[N@H+](C)CC1CC[NH+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC001180124654 1050892493 /nfs/dbraw/zinc/89/24/93/1050892493.db2.gz KBYYQPIMFUIKBK-BQYQJAHWSA-N 2 0 343.559 4.210 20 10 EICDRP CC[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccccc1O ZINC000775524059 1051698927 /nfs/dbraw/zinc/69/89/27/1051698927.db2.gz PFNMYCIXBFPYMA-QLOJAFMTSA-N 2 0 330.516 4.476 20 10 EICDRP CC[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(N(C)C)cc1 ZINC000120913739 1053640569 /nfs/dbraw/zinc/64/05/69/1053640569.db2.gz PEVUASLAMZCUIU-OAQYLSRUSA-N 2 0 343.490 4.194 20 10 EICDRP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC001199329191 1054393333 /nfs/dbraw/zinc/39/33/33/1054393333.db2.gz PIDLSDGQBVUVHR-WOJBJXKFSA-N 2 0 343.559 4.135 20 10 EICDRP Cc1cccc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)c1O ZINC000776251838 1055057624 /nfs/dbraw/zinc/05/76/24/1055057624.db2.gz DLHXMIFIXDHADO-UYAOXDASSA-N 2 0 338.495 4.091 20 10 EICDRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000743388155 1058970943 /nfs/dbraw/zinc/97/09/43/1058970943.db2.gz NSXMOQRYDACZBX-KRWDZBQOSA-N 2 0 332.532 4.162 20 10 EICDRP C[C@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1ccc(N(C)C)cc1 ZINC000766511621 1060485146 /nfs/dbraw/zinc/48/51/46/1060485146.db2.gz FQAZIASBFNSAOJ-OCDPCBSRSA-N 2 0 329.532 4.200 20 10 EICDRP CC[C@H]([NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1)c1ccccc1O ZINC000155384349 1020561851 /nfs/dbraw/zinc/56/18/51/1020561851.db2.gz MGGHOJKQDMHZJJ-FQEVSTJZSA-N 2 0 326.484 4.473 20 10 EICDRP Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000310901394 1022572798 /nfs/dbraw/zinc/57/27/98/1022572798.db2.gz MVAMSXCFCWQUQB-UYAOXDASSA-N 2 0 338.495 4.263 20 10 EICDRP CN(c1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1)C1CCCCC1 ZINC000166382874 1023099566 /nfs/dbraw/zinc/09/95/66/1023099566.db2.gz CYFTWDCVXARCJW-SIKLNZKXSA-N 2 0 341.543 4.172 20 10 EICDRP CC[C@H]([NH2+]Cc1ccc(-n2ccnc2)c(F)c1)c1ccc(C)cc1O ZINC000280142172 1035177026 /nfs/dbraw/zinc/17/70/26/1035177026.db2.gz PRKSYMKLEHCCBM-SFHVURJKSA-N 2 0 339.414 4.266 20 10 EICDRP C[C@@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1ccc2ccccc2c1O ZINC000760899507 1037650493 /nfs/dbraw/zinc/65/04/93/1037650493.db2.gz ZCQDZFCLKODIQG-MRXNPFEDSA-N 2 0 326.484 4.318 20 10 EICDRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)C1 ZINC000731041503 1043681407 /nfs/dbraw/zinc/68/14/07/1043681407.db2.gz CPMCZTAMEKJWEF-MRXNPFEDSA-N 2 0 346.559 4.419 20 10 EICDRP Cc1cc(O)c(C[NH+]2CCC(C[NH+]3CCCC3)CC2)cc1C(C)C ZINC000738071330 1045032158 /nfs/dbraw/zinc/03/21/58/1045032158.db2.gz KZFCGXOBUPTYIG-UHFFFAOYSA-N 2 0 330.516 4.132 20 10 EICDRP Cc1cc(O)c(C[NH+]2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)cc1C ZINC000738107828 1045042254 /nfs/dbraw/zinc/04/22/54/1045042254.db2.gz OQKFPQSDIKYFEG-RBUKOAKNSA-N 2 0 330.516 4.095 20 10 EICDRP CC(C)[NH+]1CCC([N@H+](C)Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000768231602 1045758816 /nfs/dbraw/zinc/75/88/16/1045758816.db2.gz UZJASKAPXLWVAA-UHFFFAOYSA-N 2 0 338.495 4.364 20 10 EICDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000769509365 1046004808 /nfs/dbraw/zinc/00/48/08/1046004808.db2.gz XAKQOZBGXXJEOL-GOSISDBHSA-N 2 0 338.495 4.223 20 10 EICDRP CC[N@H+](CCC1CC[NH+](Cc2cc(C)ccc2O)CC1)CC1CC1 ZINC000770597926 1046233651 /nfs/dbraw/zinc/23/36/51/1046233651.db2.gz SEEAFLKTPMSVMT-UHFFFAOYSA-N 2 0 330.516 4.035 20 10 EICDRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccc2ccccc2c1O ZINC000815647383 1048569978 /nfs/dbraw/zinc/56/99/78/1048569978.db2.gz IXEVMEXMRSPPMB-QGZVFWFLSA-N 2 0 326.484 4.462 20 10 EICDRP CC[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1O ZINC000810215202 1048684226 /nfs/dbraw/zinc/68/42/26/1048684226.db2.gz AKYCSVRBFZVSNX-INIZCTEOSA-N 2 0 344.421 4.184 20 10 EICDRP COc1cccc([C@@H](C)[NH2+]C2CC[NH+](CC3CCCCC3)CC2)c1O ZINC000846143332 1048831934 /nfs/dbraw/zinc/83/19/34/1048831934.db2.gz ZKDUHVBEOJLJSE-MRXNPFEDSA-N 2 0 346.515 4.096 20 10 EICDRP CC[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1O ZINC000817414368 1048964696 /nfs/dbraw/zinc/96/46/96/1048964696.db2.gz XIRBMINPFLZUAB-ZBCRRDGASA-N 2 0 344.421 4.325 20 10 EICDRP CC[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(C(F)(F)F)cc1O ZINC000817984944 1049076876 /nfs/dbraw/zinc/07/68/76/1049076876.db2.gz CREFYLTWQPJZQD-ZFWWWQNUSA-N 2 0 342.405 4.126 20 10 EICDRP Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)c1O ZINC000817984416 1049080482 /nfs/dbraw/zinc/08/04/82/1049080482.db2.gz XUYHSHCXQQEQJJ-RDTXWAMCSA-N 2 0 332.875 4.485 20 10 EICDRP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000817985017 1049080924 /nfs/dbraw/zinc/08/09/24/1049080924.db2.gz FNJJSHTVNGUJOF-MJGOQNOKSA-N 2 0 327.516 4.002 20 10 EICDRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(N2CCCCC2)cc1 ZINC000774495498 1051617424 /nfs/dbraw/zinc/61/74/24/1051617424.db2.gz IWBVUZOOQGNQLT-SFHVURJKSA-N 2 0 341.543 4.202 20 10 EICDRP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1cc2c(cc1O)CCCC2 ZINC000185941594 1052828994 /nfs/dbraw/zinc/82/89/94/1052828994.db2.gz HZQXGSZXMRPVRP-HNNXBMFYSA-N 2 0 330.516 4.185 20 10 EICDRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(C)cc1O ZINC000794819308 1053433412 /nfs/dbraw/zinc/43/34/12/1053433412.db2.gz UQHLJOPMNHZVLW-HLIPFELVSA-N 2 0 330.516 4.394 20 10 EICDRP CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1 ZINC000123613634 1054212311 /nfs/dbraw/zinc/21/23/11/1054212311.db2.gz RBGYGUPKSSLMRP-QGZVFWFLSA-N 2 0 325.500 4.055 20 10 EICDRP CC[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(N(C)C)cc1 ZINC000123658004 1054218973 /nfs/dbraw/zinc/21/89/73/1054218973.db2.gz HLKMITVVFAVXBG-OAQYLSRUSA-N 2 0 325.500 4.055 20 10 EICDRP CN(C)c1ccc(/C=C\C[NH2+]CCC[N@H+](C)C2CCCCC2)cc1 ZINC001198907867 1054308972 /nfs/dbraw/zinc/30/89/72/1054308972.db2.gz IONZHBOZDMQHIR-CLFYSBASSA-N 2 0 329.532 4.010 20 10 EICDRP C[C@H](c1ccccc1)[N@H+](CC[C@H]1CCC[NH+]1C)Cc1ccccc1O ZINC000776002541 1054436559 /nfs/dbraw/zinc/43/65/59/1054436559.db2.gz FDLVKUNDHUMBEE-WIYYLYMNSA-N 2 0 338.495 4.440 20 10 EICDRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(N2CCCCCC2)cc1 ZINC000126293105 1055004449 /nfs/dbraw/zinc/00/44/49/1055004449.db2.gz DOXKWLNFWZLHTQ-SFHVURJKSA-N 2 0 329.532 4.059 20 10 EICDRP CCCN(CCC)c1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC001202220735 1055093570 /nfs/dbraw/zinc/09/35/70/1055093570.db2.gz VDQYQRAOQAJVMP-UHFFFAOYSA-N 2 0 343.559 4.277 20 10 EICDRP CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)CC)c2)cc1 ZINC000765776409 1055116334 /nfs/dbraw/zinc/11/63/34/1055116334.db2.gz PSVPTUAHVJKOLH-GOSISDBHSA-N 2 0 339.527 4.445 20 10 EICDRP C[C@@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1cc(F)ccc1O ZINC000379643763 1059711194 /nfs/dbraw/zinc/71/11/94/1059711194.db2.gz GBOBYXFWNHERPV-JKSUJKDBSA-N 2 0 330.447 4.093 20 10 EICDRP C[C@@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1ccc(N(C)C)cc1 ZINC000766511618 1060481868 /nfs/dbraw/zinc/48/18/68/1060481868.db2.gz FQAZIASBFNSAOJ-FQVISZRSSA-N 2 0 329.532 4.200 20 10 EICDRP COc1ccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cc1C ZINC000065976543 1031640244 /nfs/dbraw/zinc/64/02/44/1031640244.db2.gz OJTUMFWKRHGVCT-UHFFFAOYSA-N 2 0 326.484 4.134 20 10 EICDRP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(N(C)C)cc1 ZINC000157523184 1037638081 /nfs/dbraw/zinc/63/80/81/1037638081.db2.gz XDRYLHGORHUOES-QGZVFWFLSA-N 2 0 329.532 4.200 20 10 EICDRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)C1 ZINC000731041502 1043682887 /nfs/dbraw/zinc/68/28/87/1043682887.db2.gz CPMCZTAMEKJWEF-INIZCTEOSA-N 2 0 346.559 4.419 20 10 EICDRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000769504240 1046000370 /nfs/dbraw/zinc/00/03/70/1046000370.db2.gz RJECFXBQRHTXNJ-SFHVURJKSA-N 2 0 338.495 4.223 20 10 EICDRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000154853902 1047702132 /nfs/dbraw/zinc/70/21/32/1047702132.db2.gz JWPGNFDMJXYPSV-GOSISDBHSA-N 2 0 339.527 4.444 20 10 EICDRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)c1cccc(C2CC2)c1 ZINC000824462644 1047877044 /nfs/dbraw/zinc/87/70/44/1047877044.db2.gz JQKXIKXCDSOKFT-SFHVURJKSA-N 2 0 349.522 4.167 20 10 EICDRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cc(Cl)c(C)cc2O)c1 ZINC000825246517 1048058717 /nfs/dbraw/zinc/05/87/17/1048058717.db2.gz BUUZDIQZFUZWOQ-UHFFFAOYSA-N 2 0 332.875 4.096 20 10 EICDRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(N2CCCCC2)cc1 ZINC000844924661 1048549732 /nfs/dbraw/zinc/54/97/32/1048549732.db2.gz PIIDYOUVJKJQJM-INIZCTEOSA-N 2 0 341.474 4.126 20 10 EICDRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cccc(OC)c2O)cc1 ZINC000846136631 1048829350 /nfs/dbraw/zinc/82/93/50/1048829350.db2.gz MKSDNVBYIIZWMS-INIZCTEOSA-N 2 0 342.483 4.093 20 10 EICDRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816557794 1048834196 /nfs/dbraw/zinc/83/41/96/1048834196.db2.gz BKWQSPHPWVUWPX-QGZVFWFLSA-N 2 0 326.484 4.003 20 10 EICDRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CCc2ccc(N)cc2)CC1 ZINC000817957291 1049065753 /nfs/dbraw/zinc/06/57/53/1049065753.db2.gz KQLSWOHNOFMGOK-UHFFFAOYSA-N 2 0 331.548 4.080 20 10 EICDRP C[C@@H]1C[C@H]([NH2+][C@H](CCC[NH3+])c2ccccc2)c2c1c(F)ccc2O ZINC000817983250 1049077443 /nfs/dbraw/zinc/07/74/43/1049077443.db2.gz LDEPXRPLZWKFTG-XYPHTWIQSA-N 2 0 328.431 4.149 20 10 EICDRP C[N@H+](Cc1ccccc1O)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171988778 1049832229 /nfs/dbraw/zinc/83/22/29/1049832229.db2.gz UXWLQTVQOSTAPD-HXUWFJFHSA-N 2 0 338.495 4.267 20 10 EICDRP CCN(CC)c1ccc(C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001177289278 1050177971 /nfs/dbraw/zinc/17/79/71/1050177971.db2.gz CMYQDXVCWJOBIE-BGYRXZFFSA-N 2 0 345.575 4.381 20 10 EICDRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1ccccc1O ZINC000183418590 1051116524 /nfs/dbraw/zinc/11/65/24/1051116524.db2.gz GEBHYSDCBKLJKL-MSOLQXFVSA-N 2 0 338.495 4.475 20 10 EICDRP CC[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc(Cl)ccc1O ZINC000775488402 1051578914 /nfs/dbraw/zinc/57/89/14/1051578914.db2.gz SQWNWOPDYYEKLN-GOSISDBHSA-N 2 0 332.875 4.348 20 10 EICDRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(Cl)ccc1O ZINC000794827576 1053440081 /nfs/dbraw/zinc/44/00/81/1053440081.db2.gz KXMJLTBMFQSIDQ-NVXWUHKLSA-N 2 0 344.886 4.218 20 10 EICDRP COc1ccc(O)c([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC000186164996 1054057500 /nfs/dbraw/zinc/05/75/00/1054057500.db2.gz YZZAHIDKSTWEOD-AOCRQIFASA-N 2 0 346.515 4.095 20 10 EICDRP COc1cc(C[NH2+]C2CC[NH+](C(C)(C)C)CC2)c(O)c(C(C)(C)C)c1 ZINC000850036142 1055326359 /nfs/dbraw/zinc/32/63/59/1055326359.db2.gz LHDHEJQTHWEPGL-UHFFFAOYSA-N 2 0 348.531 4.051 20 10 EICDRP CC[C@@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1ccccc1O ZINC000379624592 1059617358 /nfs/dbraw/zinc/61/73/58/1059617358.db2.gz DLQDSYZXABMXJC-FXAWDEMLSA-N 2 0 326.484 4.344 20 10 EICDRP CC[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C(C)C)c1ccccc1O ZINC000155130667 1020277061 /nfs/dbraw/zinc/27/70/61/1020277061.db2.gz NOPCHZDRSNAURX-FQEVSTJZSA-N 2 0 326.484 4.473 20 10 EICDRP CC[C@@H]([NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1)c1ccccc1O ZINC000155384452 1020561493 /nfs/dbraw/zinc/56/14/93/1020561493.db2.gz MGGHOJKQDMHZJJ-HXUWFJFHSA-N 2 0 326.484 4.473 20 10 EICDRP CC[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(C)cc1O ZINC000279990464 1035115144 /nfs/dbraw/zinc/11/51/44/1035115144.db2.gz FHNMLVTYKGBMDV-LJQANCHMSA-N 2 0 330.447 4.142 20 10 EICDRP Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001168372449 1037038952 /nfs/dbraw/zinc/03/89/52/1037038952.db2.gz XSZSGPBWXALENR-NRFANRHFSA-N 2 0 342.527 4.096 20 10 EICDRP Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(O)c1 ZINC000311073422 1041252472 /nfs/dbraw/zinc/25/24/72/1041252472.db2.gz KNNOACVXAZUYKK-HBFSDRIKSA-N 2 0 338.495 4.262 20 10 EICDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(-c3ccccc3)ccc2O)C[C@@H]1C ZINC000769469625 1045986612 /nfs/dbraw/zinc/98/66/12/1045986612.db2.gz BRJMWTDZIACZDY-UWJYYQICSA-N 2 0 338.495 4.364 20 10 EICDRP Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)c1O ZINC000808673717 1048046666 /nfs/dbraw/zinc/04/66/66/1048046666.db2.gz ICGGLNHSWICBAW-CQSZACIVSA-N 2 0 332.875 4.266 20 10 EICDRP CCCN(CCC)c1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000809705206 1048486541 /nfs/dbraw/zinc/48/65/41/1048486541.db2.gz PLPCMYMQGYMSFC-CBQGHPETSA-N 2 0 343.559 4.370 20 10 EICDRP CC[NH+](CC)CC1CC[NH+](Cc2ccc3ccccc3c2O)CC1 ZINC000816486081 1048812173 /nfs/dbraw/zinc/81/21/73/1048812173.db2.gz NHIPAUMXLRYHCH-UHFFFAOYSA-N 2 0 326.484 4.099 20 10 EICDRP COc1cccc([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1O ZINC000846157030 1048824744 /nfs/dbraw/zinc/82/47/44/1048824744.db2.gz IJYFLMOEAYIFHD-WWDZGPRUSA-N 2 0 346.515 4.095 20 10 EICDRP Oc1c(C[NH2+]CCCCC[NH+]2CCCCC2)ccc2ccccc21 ZINC000816547452 1048827985 /nfs/dbraw/zinc/82/79/85/1048827985.db2.gz WXKAYRGJJLRBSG-UHFFFAOYSA-N 2 0 326.484 4.291 20 10 EICDRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817585759 1049015169 /nfs/dbraw/zinc/01/51/69/1049015169.db2.gz HUXUYPYFVAWOMY-IPJUCJBFSA-N 2 0 347.522 4.339 20 10 EICDRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000817585763 1049017378 /nfs/dbraw/zinc/01/73/78/1049017378.db2.gz HUXUYPYFVAWOMY-IVMQYODDSA-N 2 0 347.522 4.339 20 10 EICDRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccc(N2CCCCC2)cc1 ZINC000817947492 1049065003 /nfs/dbraw/zinc/06/50/03/1049065003.db2.gz OMAZIKHKXPARLF-GOSISDBHSA-N 2 0 337.511 4.029 20 10 EICDRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2ccc(Br)cc2O)cc1 ZINC000817962550 1049068853 /nfs/dbraw/zinc/06/88/53/1049068853.db2.gz KAZMONNIHMHJKZ-VXGBXAGGSA-N 2 0 349.272 4.025 20 10 EICDRP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(N2CCCCC2)cc1 ZINC000817985015 1049079643 /nfs/dbraw/zinc/07/96/43/1049079643.db2.gz FNJJSHTVNGUJOF-HKUYNNGSSA-N 2 0 327.516 4.002 20 10 EICDRP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)c1 ZINC000813331416 1049753314 /nfs/dbraw/zinc/75/33/14/1049753314.db2.gz ONUFDYVGTLVIEY-BQFCYCMXSA-N 2 0 346.515 4.095 20 10 EICDRP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1ccccc1O ZINC001171983388 1049839385 /nfs/dbraw/zinc/83/93/85/1049839385.db2.gz NPJNSUDQKJFVNZ-HKUYNNGSSA-N 2 0 338.495 4.486 20 10 EICDRP CCc1cccc(C[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)c1O ZINC001180030983 1050861017 /nfs/dbraw/zinc/86/10/17/1050861017.db2.gz RTOCFUXICHEURV-ROUUACIJSA-N 2 0 330.516 4.041 20 10 EICDRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000185062339 1052389071 /nfs/dbraw/zinc/38/90/71/1052389071.db2.gz FBKBZLKKCHWYBA-OAHLLOKOSA-N 2 0 330.447 4.224 20 10 EICDRP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(C)cc1O ZINC000794819313 1053434419 /nfs/dbraw/zinc/43/44/19/1053434419.db2.gz UQHLJOPMNHZVLW-UWVAXJGDSA-N 2 0 330.516 4.394 20 10 EICDRP CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1 ZINC000120855939 1053629933 /nfs/dbraw/zinc/62/99/33/1053629933.db2.gz PCIQWSARXZDSIU-INIZCTEOSA-N 2 0 343.490 4.194 20 10 EICDRP CC[N@H+](C)C[C@H]1CC[NH+](Cc2cc3oc4ccccc4c3cc2O)C1 ZINC000743399494 1058980635 /nfs/dbraw/zinc/98/06/35/1058980635.db2.gz MVQKFDJOEXUNSX-OAHLLOKOSA-N 2 0 338.451 4.065 20 10 EICDRP CCCN(CCC)c1ccc(C[NH2+]C2CC[NH+](C(C)C)CC2)cc1 ZINC000743644717 1059067321 /nfs/dbraw/zinc/06/73/21/1059067321.db2.gz QGKIHGSVHMJEHA-UHFFFAOYSA-N 2 0 331.548 4.275 20 10 EICDRP CC[C@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1ccccc1O ZINC000379624594 1059616262 /nfs/dbraw/zinc/61/62/62/1059616262.db2.gz DLQDSYZXABMXJC-PXNSSMCTSA-N 2 0 326.484 4.344 20 10 EICDRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1cc(F)ccc1O ZINC000311222994 1023007878 /nfs/dbraw/zinc/00/78/78/1023007878.db2.gz VSSLZPKTRBHDSV-WMZOPIPTSA-N 2 0 342.458 4.094 20 10 EICDRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccc1O ZINC000183506896 1023373100 /nfs/dbraw/zinc/37/31/00/1023373100.db2.gz GDFBMCBPDSSEFP-VOBGVNJCSA-N 2 0 336.479 4.238 20 10 EICDRP CC(C)(C)[NH+]1CCC([NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000236645631 1023396350 /nfs/dbraw/zinc/39/63/50/1023396350.db2.gz CXOQADQDSKPSHV-UHFFFAOYSA-N 2 0 329.532 4.029 20 10 EICDRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(N2CCCCCC2)cc1 ZINC000152450837 1042827822 /nfs/dbraw/zinc/82/78/22/1042827822.db2.gz SHKOLCABGPLIMF-OALUTQOASA-N 2 0 341.543 4.202 20 10 EICDRP C[NH+](C)C[C@@H]1CC[N@H+](Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)C1 ZINC000738228242 1045044177 /nfs/dbraw/zinc/04/41/77/1045044177.db2.gz USJIRVWIGVBVEK-INIZCTEOSA-N 2 0 346.559 4.371 20 10 EICDRP CCCN(CCC)c1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000915682841 1045448086 /nfs/dbraw/zinc/44/80/86/1045448086.db2.gz SAVUBUVMSYZVMF-PZJWPPBQSA-N 2 0 329.532 4.029 20 10 EICDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(-c3ccccc3)ccc2O)[C@H](C)C1 ZINC000769482765 1045971321 /nfs/dbraw/zinc/97/13/21/1045971321.db2.gz DYWYWNIQRSLXSU-UTKZUKDTSA-N 2 0 338.495 4.221 20 10 EICDRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000769504238 1046001065 /nfs/dbraw/zinc/00/10/65/1046001065.db2.gz RJECFXBQRHTXNJ-GOSISDBHSA-N 2 0 338.495 4.223 20 10 EICDRP Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(O)c1 ZINC000788796735 1047303812 /nfs/dbraw/zinc/30/38/12/1047303812.db2.gz IBGDKFRDFORILG-QUCCMNQESA-N 2 0 338.495 4.182 20 10 EICDRP COc1cccc([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1O ZINC000846157029 1048824796 /nfs/dbraw/zinc/82/47/96/1048824796.db2.gz IJYFLMOEAYIFHD-AOCRQIFASA-N 2 0 346.515 4.095 20 10 EICDRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cccc(OC)c2O)cc1 ZINC000846136633 1048829590 /nfs/dbraw/zinc/82/95/90/1048829590.db2.gz MKSDNVBYIIZWMS-MRXNPFEDSA-N 2 0 342.483 4.093 20 10 EICDRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000817975745 1049076037 /nfs/dbraw/zinc/07/60/37/1049076037.db2.gz ATWCWMBUVCBNTO-PXNSSMCTSA-N 2 0 326.484 4.173 20 10 EICDRP Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)c1O ZINC000817984411 1049080666 /nfs/dbraw/zinc/08/06/66/1049080666.db2.gz XUYHSHCXQQEQJJ-KDOFPFPSSA-N 2 0 332.875 4.485 20 10 EICDRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)c1ccc(N(C)C)cc1 ZINC000773074662 1049564511 /nfs/dbraw/zinc/56/45/11/1049564511.db2.gz GYQNUYMWLKFRTM-RXVVDRJESA-N 2 0 331.548 4.161 20 10 EICDRP COc1ccc(O)c([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)c1 ZINC000813331419 1049752975 /nfs/dbraw/zinc/75/29/75/1049752975.db2.gz ONUFDYVGTLVIEY-XYJFISCASA-N 2 0 346.515 4.095 20 10 EICDRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(N3CCCCC3)c(C)c2)C[C@@H]1C ZINC001191418180 1051452826 /nfs/dbraw/zinc/45/28/26/1051452826.db2.gz SDYYPGLDVCZTJY-FPOVZHCZSA-N 2 0 343.559 4.290 20 10 EICDRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2c(O)cc(C)cc2Cl)cc1 ZINC001177133555 1052233984 /nfs/dbraw/zinc/23/39/84/1052233984.db2.gz YZCVCNPOMHQETB-UHFFFAOYSA-N 2 0 346.902 4.486 20 10 EICDRP Cc1ccc(O)c([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c1 ZINC000185241342 1052550752 /nfs/dbraw/zinc/55/07/52/1052550752.db2.gz HCVONTWCOWWZLN-MRXNPFEDSA-N 2 0 344.524 4.325 20 10 EICDRP C[C@H]([NH2+]CC(C)(C)C[NH+](C)C)c1ccc(N2CCCCC2)c(F)c1 ZINC000764431872 1053099953 /nfs/dbraw/zinc/09/99/53/1053099953.db2.gz HGNZTBVMRNFONI-INIZCTEOSA-N 2 0 335.511 4.054 20 10 EICDRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(N3CCCCC3)c(F)c2)C1 ZINC000765293086 1053499341 /nfs/dbraw/zinc/49/93/41/1053499341.db2.gz ZUWILBHEYKQYFM-ZWKOTPCHSA-N 2 0 347.522 4.199 20 10 EICDRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(N(C)C3CCCCC3)cc2)CC[N@@H+]1C ZINC000765446020 1053550879 /nfs/dbraw/zinc/55/08/79/1053550879.db2.gz PEYOMIRFWBLMGB-IEBWSBKVSA-N 2 0 329.532 4.028 20 10 EICDRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000858490321 1054499171 /nfs/dbraw/zinc/49/91/71/1054499171.db2.gz GFFVUCAMFHEDHI-RTBURBONSA-N 2 0 329.532 4.059 20 10 EICDRP CC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000765773252 1054885919 /nfs/dbraw/zinc/88/59/19/1054885919.db2.gz ZIDCBXIBILJZJJ-GOSISDBHSA-N 2 0 329.532 4.059 20 10 EICDRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000765779862 1055280472 /nfs/dbraw/zinc/28/04/72/1055280472.db2.gz ZNQPMKFJYTWVSA-QGZVFWFLSA-N 2 0 347.522 4.199 20 10 EICDRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2cc(CC)cc(C(C)(C)C)c2O)C1 ZINC000743390627 1058973344 /nfs/dbraw/zinc/97/33/44/1058973344.db2.gz RXWSDAHHCFVNMX-SFHVURJKSA-N 2 0 346.559 4.416 20 10 EICDRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2cc(CC)cc(C(C)(C)C)c2O)C1 ZINC000743390626 1058975169 /nfs/dbraw/zinc/97/51/69/1058975169.db2.gz RXWSDAHHCFVNMX-GOSISDBHSA-N 2 0 346.559 4.416 20 10 EICDRP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc2ccccc2c1O ZINC000193929138 1032187850 /nfs/dbraw/zinc/18/78/50/1032187850.db2.gz VCLANZVWTVSCRP-OAHLLOKOSA-N 2 0 326.484 4.459 20 10 EICDRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1O ZINC000310799480 1032522792 /nfs/dbraw/zinc/52/27/92/1032522792.db2.gz GKCCAZLLRIWOCX-DSKINZAPSA-N 2 0 338.495 4.344 20 10 EICDRP CC[C@@H]([NH2+]Cc1ccc(-n2ccnc2)cc1)c1ccc(N(C)C)cc1 ZINC000177806481 1022457031 /nfs/dbraw/zinc/45/70/31/1022457031.db2.gz RYXKRWZANRDCLW-OAQYLSRUSA-N 2 0 334.467 4.179 20 10 EICDRP Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000310807623 1023442157 /nfs/dbraw/zinc/44/21/57/1023442157.db2.gz HZTJGHJQKNHAIZ-HBFSDRIKSA-N 2 0 338.495 4.262 20 10 EICDRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(N2CCCCCC2)cc1 ZINC000158186384 1035659967 /nfs/dbraw/zinc/65/99/67/1035659967.db2.gz IJMADYJRUCMWKC-MOPGFXCFSA-N 2 0 329.532 4.059 20 10 EICDRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(N2CCCCC2)c(F)c1 ZINC000295919091 1042538401 /nfs/dbraw/zinc/53/84/01/1042538401.db2.gz JTHSLFSLEGMABO-UXDRXVOSSA-N 2 0 345.506 4.092 20 10 EICDRP Cc1cc(C)c([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c(O)c1 ZINC000788509125 1047210621 /nfs/dbraw/zinc/21/06/21/1047210621.db2.gz ZHDUUMCJEKFOCC-SFHVURJKSA-N 2 0 338.495 4.456 20 10 EICDRP Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c(O)c1 ZINC000788796731 1047303379 /nfs/dbraw/zinc/30/33/79/1047303379.db2.gz IBGDKFRDFORILG-AZUAARDMSA-N 2 0 338.495 4.182 20 10 EICDRP CSC1(C[NH2+][C@H](C)c2ccc3ccccc3c2O)CC[NH+](C)CC1 ZINC000810252958 1048730007 /nfs/dbraw/zinc/73/00/07/1048730007.db2.gz XKYSTRQFHZYWMI-OAHLLOKOSA-N 2 0 344.524 4.023 20 10 EICDRP C[NH+](C)Cc1cc(C[NH2+]Cc2ccc3ccccc3c2O)ccc1F ZINC000816552030 1048832092 /nfs/dbraw/zinc/83/20/92/1048832092.db2.gz YVPNKASDQUXFSS-UHFFFAOYSA-N 2 0 338.426 4.036 20 10 EICDRP Oc1c(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)ccc2ccccc21 ZINC000816555542 1048834442 /nfs/dbraw/zinc/83/44/42/1048834442.db2.gz IYERUYBOTBSIMC-UHFFFAOYSA-N 2 0 338.495 4.432 20 10 EICDRP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc(N2CCCCCC2)cc1 ZINC000817965014 1049073367 /nfs/dbraw/zinc/07/33/67/1049073367.db2.gz MTNYEEAHGBFJLI-RXVVDRJESA-N 2 0 329.532 4.107 20 10 EICDRP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)c1ccc(N(C)C)cc1 ZINC000773074658 1049565670 /nfs/dbraw/zinc/56/56/70/1049565670.db2.gz GYQNUYMWLKFRTM-NQIIRXRSSA-N 2 0 331.548 4.161 20 10 EICDRP C[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2O)CCN1Cc1ccccc1 ZINC000237573274 1049627462 /nfs/dbraw/zinc/62/74/62/1049627462.db2.gz CMWYPMFIINLKTD-BEFAXECRSA-N 2 0 344.886 4.188 20 10 EICDRP Oc1ccccc1C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172060505 1049842334 /nfs/dbraw/zinc/84/23/34/1049842334.db2.gz ATEKAMYXYASFHP-WKCHPHFGSA-N 2 0 336.479 4.068 20 10 EICDRP Oc1cccc2c1[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CC2 ZINC000297933877 1052106299 /nfs/dbraw/zinc/10/62/99/1052106299.db2.gz XUIMLBSYNRNHPM-VTHDOGFWSA-N 2 0 348.490 4.165 20 10 EICDRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc2ccccc2c1O ZINC000184936943 1052320342 /nfs/dbraw/zinc/32/03/42/1052320342.db2.gz JTPHRLAXKZVAHH-INIZCTEOSA-N 2 0 334.463 4.458 20 10 EICDRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc(F)cc1[O-] ZINC000185241390 1052550856 /nfs/dbraw/zinc/55/08/56/1052550856.db2.gz NZHLVVFLVOWBKH-AWEZNQCLSA-N 2 0 348.487 4.156 20 10 EICDRP CCN(CC)c1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC001199403290 1054407035 /nfs/dbraw/zinc/40/70/35/1054407035.db2.gz QBOUKIHVGXBIAR-UHFFFAOYSA-N 2 0 343.559 4.420 20 10 EICDRP Cc1cc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c(O)c(C(C)(C)C)c1 ZINC000742169107 1058528260 /nfs/dbraw/zinc/52/82/60/1058528260.db2.gz NTAAUMFCQLNCOQ-SFHVURJKSA-N 2 0 344.543 4.306 20 10 EICDRP