smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000532200568 1032085551 /nfs/dbraw/zinc/08/55/51/1032085551.db2.gz WJXSAWZZSQXBMM-YCRPNKLZSA-N 2 0 326.459 4.301 20 0 EIADRP CCC[NH+]1CCC(C[NH2+]Cc2cc(C)c(OC(F)F)c(C)c2)CC1 ZINC000729682370 1032130274 /nfs/dbraw/zinc/13/02/74/1032130274.db2.gz UKSBILYSNPMLMZ-UHFFFAOYSA-N 2 0 340.458 4.116 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(Cl)c(N)c(Cl)c2)C1 ZINC000760161696 1032484770 /nfs/dbraw/zinc/48/47/70/1032484770.db2.gz ZDVFOMBJNWWUQH-STQMWFEESA-N 2 0 344.330 4.347 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1cc(Cl)c(N)c(Cl)c1 ZINC000760166307 1032512120 /nfs/dbraw/zinc/51/21/20/1032512120.db2.gz DKPOGMRHOMNDOC-DRZSPHRISA-N 2 0 330.303 4.099 20 0 EIADRP CC[N@H+](C)C[C@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1 ZINC000450475822 1032521518 /nfs/dbraw/zinc/52/15/18/1032521518.db2.gz ZYOYMCQNFCPKTR-GDBMZVCRSA-N 2 0 328.422 4.126 20 0 EIADRP Cc1nc(C)c([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)s1 ZINC000178424699 1032537449 /nfs/dbraw/zinc/53/74/49/1032537449.db2.gz KKTWNBOEGKVOLG-CQSZACIVSA-N 2 0 329.513 4.207 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@H+](C)CC1CC[NH2+]CC1 ZINC000178981794 1032546095 /nfs/dbraw/zinc/54/60/95/1032546095.db2.gz DCFKTOJDCHSTLB-HNNXBMFYSA-N 2 0 329.513 4.111 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc(Cl)nc1 ZINC000760174785 1032570685 /nfs/dbraw/zinc/57/06/85/1032570685.db2.gz ZCJCNBODKRODBJ-WMZOPIPTSA-N 2 0 343.902 4.298 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccccc1F ZINC000180151960 1032595430 /nfs/dbraw/zinc/59/54/30/1032595430.db2.gz YUZMMWKNNIBHHE-FQEVSTJZSA-N 2 0 330.447 4.007 20 0 EIADRP CCC1(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CCOCC1 ZINC000512396971 1032665540 /nfs/dbraw/zinc/66/55/40/1032665540.db2.gz XVRRFJOWCCLKSY-FPOVZHCZSA-N 2 0 344.543 4.084 20 0 EIADRP CCC[C@@H](NCC[C@@H](C)[N@H+](C)Cc1ccccc1)c1ccccn1 ZINC000500619759 1032725453 /nfs/dbraw/zinc/72/54/53/1032725453.db2.gz UQRIWIGODPXZCC-UYAOXDASSA-N 2 0 325.500 4.423 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)C(c1ccccc1)c1ccccc1 ZINC000643546633 1018899009 /nfs/dbraw/zinc/89/90/09/1018899009.db2.gz SEKKXNMQTCKDJQ-GHTZIAJQSA-N 2 0 334.507 4.471 20 0 EIADRP CC(C)Oc1ccc([C@@H](C)[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1Cl ZINC000643548346 1018925520 /nfs/dbraw/zinc/92/55/20/1018925520.db2.gz OCPYRTWUTJQFRO-GDBMZVCRSA-N 2 0 336.907 4.453 20 0 EIADRP CC[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000643548401 1018926227 /nfs/dbraw/zinc/92/62/27/1018926227.db2.gz OUUMYHPVBGWAPB-HOCLYGCPSA-N 2 0 342.405 4.301 20 0 EIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643548981 1018935286 /nfs/dbraw/zinc/93/52/86/1018935286.db2.gz YMLFKCHVMASXPX-WMLDXEAASA-N 2 0 340.433 4.291 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc(Cl)cn1 ZINC000274961670 1019879435 /nfs/dbraw/zinc/87/94/35/1019879435.db2.gz WXEBUAXHEYEVNC-FAEJEUNOSA-N 2 0 335.923 4.429 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1ccc(Cl)cn1 ZINC000274983125 1019888802 /nfs/dbraw/zinc/88/88/02/1019888802.db2.gz ZPIPOXQFTUELOS-OAHLLOKOSA-N 2 0 331.891 4.428 20 0 EIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000432814816 1032860048 /nfs/dbraw/zinc/86/00/48/1032860048.db2.gz BIRCCNUGZUCPAJ-FQEVSTJZSA-N 2 0 338.495 4.278 20 0 EIADRP O[C@H]1CCC[C@H]1[NH+]1CCC([NH2+]C2CCC(C3CCCCC3)CC2)CC1 ZINC000683470518 1020849135 /nfs/dbraw/zinc/84/91/35/1020849135.db2.gz QNZQRJBTXDCTRT-FGGKUVOCSA-N 2 0 348.575 4.093 20 0 EIADRP CC(C)[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(C(F)(F)F)cc1 ZINC000655805829 1020972149 /nfs/dbraw/zinc/97/21/49/1020972149.db2.gz TWOOKHVHJCLETP-XKQJLSEDSA-N 2 0 328.422 4.332 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]C[C@H]3C[C@@H]([NH+](C)C)C3)cs2)cs1 ZINC000655806270 1020976094 /nfs/dbraw/zinc/97/60/94/1020976094.db2.gz TXHYYOPUMJNQAO-KYOSRNDESA-N 2 0 335.542 4.171 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805667 1020976492 /nfs/dbraw/zinc/97/64/92/1020976492.db2.gz KAZVOHXDXOILLG-OLMNPRSZSA-N 2 0 343.540 4.033 20 0 EIADRP COCCCC1(C[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)CCC1 ZINC001204496331 1020976535 /nfs/dbraw/zinc/97/65/35/1020976535.db2.gz FWDKMAUAYGNQNF-FQEVSTJZSA-N 2 0 336.564 4.027 20 0 EIADRP Cc1ccsc1CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000538116109 1021003868 /nfs/dbraw/zinc/00/38/68/1021003868.db2.gz DZHWNKNFWBEJFP-HKUYNNGSSA-N 2 0 328.525 4.099 20 0 EIADRP CC[NH+](CC)CCC[N@H+](Cc1ccc2c(c1)CCO2)C1CCCC1 ZINC001167318395 1021071139 /nfs/dbraw/zinc/07/11/39/1021071139.db2.gz KKUXICWUPGXOAC-UHFFFAOYSA-N 2 0 330.516 4.098 20 0 EIADRP CC(C)[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccc2[nH]c(=O)oc2c1 ZINC000340475140 1021097641 /nfs/dbraw/zinc/09/76/41/1021097641.db2.gz KMSFHBHSKUPHCC-LJQANCHMSA-N 2 0 345.487 4.086 20 0 EIADRP CC(C)C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)c1ccccc1 ZINC000537955148 1021130286 /nfs/dbraw/zinc/13/02/86/1021130286.db2.gz JFXVAURZBMYVNH-FDFHNCONSA-N 2 0 344.543 4.131 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3ccc(O)cc32)c1 ZINC000340519542 1021186409 /nfs/dbraw/zinc/18/64/09/1021186409.db2.gz MLMXSXZAJOOEDF-JOCHJYFZSA-N 2 0 338.495 4.400 20 0 EIADRP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1ccc2cnccc2c1 ZINC000683774958 1021482151 /nfs/dbraw/zinc/48/21/51/1021482151.db2.gz ZHQLFTBEUJMFGU-UHFFFAOYSA-N 2 0 325.500 4.369 20 0 EIADRP Cc1cc([C@H](C)[NH2+]C[C@@H]2CCCn3ccnc32)ccc1Br ZINC000376178574 1021672258 /nfs/dbraw/zinc/67/22/58/1021672258.db2.gz RUSDLXNCWZFTNH-ZFWWWQNUSA-N 2 0 348.288 4.182 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccc3cnccc3c2)C1 ZINC000683827224 1021723360 /nfs/dbraw/zinc/72/33/60/1021723360.db2.gz ADAVNNOGCLNGDG-AZUAARDMSA-N 2 0 337.511 4.321 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2ccc(-c3ccc(F)cc3)o2)CC1 ZINC000511483697 1021878905 /nfs/dbraw/zinc/87/89/05/1021878905.db2.gz VBEYGQKIGPAQNS-UHFFFAOYSA-N 2 0 330.447 4.249 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1csc(-c2ccccc2)n1 ZINC000414147439 1021966605 /nfs/dbraw/zinc/96/66/05/1021966605.db2.gz MGIWSMGSQIOFBC-HNNXBMFYSA-N 2 0 329.513 4.335 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+]Cc3cc4ccccc4[nH]3)CC2)c1 ZINC000683927311 1021987740 /nfs/dbraw/zinc/98/77/40/1021987740.db2.gz SUVZSXSZLYAMRO-UHFFFAOYSA-N 2 0 339.508 4.231 20 0 EIADRP COc1ccc2oc([C@H](C)[NH2+]CC[C@H]3CCC[N@H+](C)C3)c(C)c2c1 ZINC000414169291 1022017522 /nfs/dbraw/zinc/01/75/22/1022017522.db2.gz BAVQPIYAIUVMGJ-JKSUJKDBSA-N 2 0 330.472 4.132 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cc(F)ccc1F ZINC000171128486 1022085530 /nfs/dbraw/zinc/08/55/30/1022085530.db2.gz BQDXAEHJLKNVMI-OAHLLOKOSA-N 2 0 348.437 4.146 20 0 EIADRP CSc1ccc([C@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000069674883 1022171517 /nfs/dbraw/zinc/17/15/17/1022171517.db2.gz LHUADQINCUTFIL-INIZCTEOSA-N 2 0 344.524 4.200 20 0 EIADRP C[C@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)CC(F)(F)F ZINC000414278997 1022389767 /nfs/dbraw/zinc/38/97/67/1022389767.db2.gz IPGHZFJQVORJMU-LEUOFYLZSA-N 2 0 340.433 4.360 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CC[C@@H]2CCCCO2)ccc1OC ZINC000180259710 1022457376 /nfs/dbraw/zinc/45/73/76/1022457376.db2.gz WHGGJTYQMFRZNY-PXNSSMCTSA-N 2 0 348.531 4.147 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCOC3(CCCC3)C2)CC1 ZINC000127346245 1022666110 /nfs/dbraw/zinc/66/61/10/1022666110.db2.gz CNGIIIIRNUJOFB-RLLQIKCJSA-N 2 0 334.548 4.111 20 0 EIADRP C1CCC([NH+]2CCC([NH2+]C3CCC4(CCOCC4)CC3)CC2)CC1 ZINC000414373270 1022794287 /nfs/dbraw/zinc/79/42/87/1022794287.db2.gz ZEVIKZLHDZLMAG-UHFFFAOYSA-N 2 0 334.548 4.113 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@@H]2CN(C)Cc3ccccc32)cc1 ZINC000378407579 1022805581 /nfs/dbraw/zinc/80/55/81/1022805581.db2.gz YAGSJCRJZJWUMT-KSFYIVLOSA-N 2 0 346.478 4.018 20 0 EIADRP COc1cc(C)ccc1C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548153699 1022828689 /nfs/dbraw/zinc/82/86/89/1022828689.db2.gz DGZUSAJFZAPPRF-WIYYLYMNSA-N 2 0 338.495 4.004 20 0 EIADRP C[C@H]1CCC[N@@H+]1C1CC[NH+](CC2CCC(C(F)(F)F)CC2)CC1 ZINC000376498999 1022846933 /nfs/dbraw/zinc/84/69/33/1022846933.db2.gz CIRUGPXFRVZHJM-FHERZECASA-N 2 0 332.454 4.304 20 0 EIADRP Cc1cn2c(n1)[C@@H](C[NH2+]Cc1ccc(Oc3ccccc3)o1)CCC2 ZINC000378603758 1022888396 /nfs/dbraw/zinc/88/83/96/1022888396.db2.gz AEHVUIXCVLZRAG-MRXNPFEDSA-N 2 0 337.423 4.244 20 0 EIADRP CC[NH+]1CCC([NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000236920373 1033096402 /nfs/dbraw/zinc/09/64/02/1033096402.db2.gz QOSSNPHHHBYMOT-UHFFFAOYSA-N 2 0 346.421 4.331 20 0 EIADRP CN(CCC[NH+]1CCCC1)Cc1ccc(Cl)cc1C(F)(F)F ZINC001143506115 1023069412 /nfs/dbraw/zinc/06/94/12/1023069412.db2.gz YKLOSASSGVLQMT-UHFFFAOYSA-N 2 0 334.813 4.277 20 0 EIADRP Cn1ccnc1C[C@H]([NH2+]CCc1ccc(Cl)cc1)c1ccccc1 ZINC000656503600 1023074760 /nfs/dbraw/zinc/07/47/60/1023074760.db2.gz OACZXRTYSBJQKN-IBGZPJMESA-N 2 0 339.870 4.190 20 0 EIADRP c1ccc(C[N@H+]2CC[C@@H](C[NH2+][C@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000376672599 1023255390 /nfs/dbraw/zinc/25/53/90/1023255390.db2.gz OJELGPNBPZUIOD-UGKGYDQZSA-N 2 0 335.495 4.035 20 0 EIADRP C[C@@H](CCc1ccco1)[NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000310066034 1023335391 /nfs/dbraw/zinc/33/53/91/1023335391.db2.gz BLFIVZQJFQKBSH-RXVVDRJESA-N 2 0 326.484 4.103 20 0 EIADRP CSC1(C[NH2+]C2CC(c3ccc(Cl)cc3)C2)CC[NH+](C)CC1 ZINC000584809451 1023338827 /nfs/dbraw/zinc/33/88/27/1023338827.db2.gz ICHZXJOQFIDFKM-UHFFFAOYSA-N 2 0 338.948 4.003 20 0 EIADRP COC[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1ccccc1 ZINC000581539730 1023344783 /nfs/dbraw/zinc/34/47/83/1023344783.db2.gz RHOHZNZORYHITB-JOCHJYFZSA-N 2 0 338.495 4.150 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc2c(c1)OCO2 ZINC000537942939 1033128903 /nfs/dbraw/zinc/12/89/03/1033128903.db2.gz VOKALKHYSXBCBE-IVMQYODDSA-N 2 0 344.499 4.109 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc(OCc2ccccc2F)cc1 ZINC000415013309 1023388969 /nfs/dbraw/zinc/38/89/69/1023388969.db2.gz KLTWZHIXHRNSHK-INIZCTEOSA-N 2 0 330.447 4.012 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]Cc2cccc3c2CCCN3)CC[N@@H+]1Cc1ccccc1 ZINC000415046491 1023409012 /nfs/dbraw/zinc/40/90/12/1023409012.db2.gz ZTYLDQFIAXMZEM-RXVVDRJESA-N 2 0 349.522 4.187 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc(Br)s1)c1ccccc1 ZINC000415050603 1023409991 /nfs/dbraw/zinc/40/99/91/1023409991.db2.gz IUUHDOMTSQUJCN-CQSZACIVSA-N 2 0 339.302 4.080 20 0 EIADRP COc1cccc([C@H](N[C@H]2CCC[NH2+]CC2)c2ccccc2Cl)c1 ZINC000415081238 1023429523 /nfs/dbraw/zinc/42/95/23/1023429523.db2.gz KMPMLBIQVCXSGS-JXFKEZNVSA-N 2 0 344.886 4.170 20 0 EIADRP COc1cccc([C@@H]([NH2+]C2CCC([NH3+])CC2)c2ccccc2Cl)c1 ZINC000415086633 1023437447 /nfs/dbraw/zinc/43/74/47/1023437447.db2.gz SHHWFXKSFWLGJK-ALLBUHFWSA-N 2 0 344.886 4.298 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ccc(-n2ccnc2)cc1 ZINC000120152296 1023502459 /nfs/dbraw/zinc/50/24/59/1023502459.db2.gz SUQDTGIAZZTQOI-ZWKOTPCHSA-N 2 0 328.504 4.033 20 0 EIADRP Clc1ccc(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)c2ncccc12 ZINC000656786259 1023526918 /nfs/dbraw/zinc/52/69/18/1023526918.db2.gz QZGBFCIHRSXHGD-MRXNPFEDSA-N 2 0 343.902 4.100 20 0 EIADRP c1nc(C2CCCC2)sc1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000656786175 1023527870 /nfs/dbraw/zinc/52/78/70/1023527870.db2.gz LVJHPYKRYAVITB-QGZVFWFLSA-N 2 0 333.545 4.012 20 0 EIADRP CC(C)c1ccc(-c2ncc(CN3CCC[C@H](C[NH3+])C3)s2)cc1 ZINC000430633896 1023538703 /nfs/dbraw/zinc/53/87/03/1023538703.db2.gz CJLKDBBSGNGMEJ-OAHLLOKOSA-N 2 0 329.513 4.104 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H](C)c1ccc(C2CC2)cc1 ZINC000418111963 1023542044 /nfs/dbraw/zinc/54/20/44/1023542044.db2.gz GIAPIEMFFODIMO-HNNXBMFYSA-N 2 0 332.451 4.304 20 0 EIADRP CCc1ccc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)cn1 ZINC000581693911 1023616489 /nfs/dbraw/zinc/61/64/89/1023616489.db2.gz VAGZZFNXVJSKFU-SFHVURJKSA-N 2 0 329.532 4.121 20 0 EIADRP CC(C)C1=[NH+]CCc2ccc(NCCC[N@@H+]3CCCC[C@H]3C)cc21 ZINC001167754790 1023641799 /nfs/dbraw/zinc/64/17/99/1023641799.db2.gz VLEZLPFNGYFEBZ-QGZVFWFLSA-N 2 0 327.516 4.364 20 0 EIADRP Cc1ccn(C2CC[NH+]([C@@H](C)c3ccc(-n4ccnc4C)cc3)CC2)n1 ZINC000377632327 1023643158 /nfs/dbraw/zinc/64/31/58/1023643158.db2.gz UPOBDHMEFCGDAR-KRWDZBQOSA-N 2 0 349.482 4.084 20 0 EIADRP CCC[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]CC2)c1ccc(F)cc1F ZINC000584535161 1023662024 /nfs/dbraw/zinc/66/20/24/1023662024.db2.gz UUERKRFQEDRACW-FQEVSTJZSA-N 2 0 330.422 4.242 20 0 EIADRP C[C@H](N[C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1ccc(F)cn1 ZINC000390564569 1023682397 /nfs/dbraw/zinc/68/23/97/1023682397.db2.gz ALDANMRGYVSNQA-OXJNMPFZSA-N 2 0 341.474 4.172 20 0 EIADRP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000581847178 1023763277 /nfs/dbraw/zinc/76/32/77/1023763277.db2.gz XUMGTXUDNDRSLE-MBSJSRAVSA-N 2 0 326.406 4.040 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@H]3CCC[C@@H](c4cccnc4)C3)C2)cc1 ZINC000500382548 1023769767 /nfs/dbraw/zinc/76/97/67/1023769767.db2.gz HQVZFYDPXTVPIL-XPNTWCBSSA-N 2 0 349.522 4.220 20 0 EIADRP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000390744205 1023819685 /nfs/dbraw/zinc/81/96/85/1023819685.db2.gz OMYRZDVLVWTWEV-RDJZCZTQSA-N 2 0 328.422 4.219 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000511741926 1023854600 /nfs/dbraw/zinc/85/46/00/1023854600.db2.gz XSRDEEXCKRQMCP-RQRMZWKBSA-N 2 0 344.543 4.194 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccccc1 ZINC000090971285 1023931067 /nfs/dbraw/zinc/93/10/67/1023931067.db2.gz CINXYULSMBIBAZ-LJQANCHMSA-N 2 0 349.522 4.069 20 0 EIADRP CC1CC[NH+](Cc2ccc(C[NH2+]Cc3cc4cnccc4o3)cc2)CC1 ZINC000651671413 1024147115 /nfs/dbraw/zinc/14/71/15/1024147115.db2.gz QNZGVHNLAQGKHP-UHFFFAOYSA-N 2 0 349.478 4.350 20 0 EIADRP FCCC[C@@H]1CCC[C@H]1[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000510672774 1024210416 /nfs/dbraw/zinc/21/04/16/1024210416.db2.gz WPFWQDFMGVHMEQ-LEWJYISDSA-N 2 0 332.507 4.407 20 0 EIADRP FCCC[C@H]1CCC[C@H]1[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000510699587 1024251127 /nfs/dbraw/zinc/25/11/27/1024251127.db2.gz CDTQHSACKKRAJB-IEBWSBKVSA-N 2 0 338.536 4.468 20 0 EIADRP C[NH2+]CC1CC[NH+](Cc2csc(-c3ccc(C(C)C)cc3)n2)CC1 ZINC000430956498 1024285553 /nfs/dbraw/zinc/28/55/53/1024285553.db2.gz PAZHARYAKINYMV-UHFFFAOYSA-N 2 0 343.540 4.365 20 0 EIADRP CC(C)c1ccc(-c2ncc(C[NH+]3CCC([C@@H](C)[NH3+])CC3)s2)cc1 ZINC000430953611 1024293428 /nfs/dbraw/zinc/29/34/28/1024293428.db2.gz UFLNWKYTAHPWOH-OAHLLOKOSA-N 2 0 343.540 4.493 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](c2cccnc2)C2CCCCC2)C1 ZINC000652149879 1024331289 /nfs/dbraw/zinc/33/12/89/1024331289.db2.gz DOYMMLURCRGZMQ-WIYYLYMNSA-N 2 0 329.532 4.413 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3cc(F)ccc32)c1 ZINC000341705153 1024356899 /nfs/dbraw/zinc/35/68/99/1024356899.db2.gz IRRVLOHIEYSTLB-OAQYLSRUSA-N 2 0 326.459 4.445 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CCN(C)[C@H](C)C1 ZINC000510737090 1024379298 /nfs/dbraw/zinc/37/92/98/1024379298.db2.gz RVTIFRMEUHRMFC-CPUCHLNUSA-N 2 0 328.422 4.099 20 0 EIADRP Cc1cc([C@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)sc1Br ZINC000511937700 1024818630 /nfs/dbraw/zinc/81/86/30/1024818630.db2.gz JBBUNDONNFFZCP-LBPRGKRZSA-N 2 0 345.350 4.202 20 0 EIADRP CS[C@@H]1CCC[C@H]([NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000548483980 1024831592 /nfs/dbraw/zinc/83/15/92/1024831592.db2.gz RGRSLFXTVNAJIW-OJAHFUOMSA-N 2 0 332.557 4.161 20 0 EIADRP C[C@@H]([NH2+]CCSCc1cccc2ccccc21)C1CC[NH+](C)CC1 ZINC000610803927 1024986741 /nfs/dbraw/zinc/98/67/41/1024986741.db2.gz JGOMTGBDWVWWFU-QGZVFWFLSA-N 2 0 342.552 4.393 20 0 EIADRP CC(C)(C)[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc(F)cc1 ZINC000662281009 1025026102 /nfs/dbraw/zinc/02/61/02/1025026102.db2.gz HFXGIYOSWXMQFC-FQEVSTJZSA-N 2 0 326.459 4.348 20 0 EIADRP C[C@@H](c1ccc(OC(F)F)cc1)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662295872 1025049292 /nfs/dbraw/zinc/04/92/92/1025049292.db2.gz IIEDUBYJKJMPJO-YOEHRIQHSA-N 2 0 338.442 4.061 20 0 EIADRP c1ccc(C[N@H+]2CCC[C@H](C[NH2+][C@@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000684611406 1025057582 /nfs/dbraw/zinc/05/75/82/1025057582.db2.gz GLMNPPYBBXFDNC-NFBKMPQASA-N 2 0 349.522 4.425 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2coc(-c3cccc(Cl)c3)n2)[C@@H]1CCC[NH3+] ZINC000662314617 1025066509 /nfs/dbraw/zinc/06/65/09/1025066509.db2.gz OWKCTBZCASOZES-RDTXWAMCSA-N 2 0 347.890 4.334 20 0 EIADRP COCC[C@@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)c1ccc(Cl)c(Cl)c1 ZINC000342056374 1025079652 /nfs/dbraw/zinc/07/96/52/1025079652.db2.gz HOIVARJXZMWINM-RHSMWYFYSA-N 2 0 345.314 4.145 20 0 EIADRP CC[N@H+](Cc1scnc1C1CC1)Cc1ccc(C[NH+](C)C)cc1 ZINC000348970802 1025152844 /nfs/dbraw/zinc/15/28/44/1025152844.db2.gz XCIISBOJTOFPBR-UHFFFAOYSA-N 2 0 329.513 4.104 20 0 EIADRP c1csc(CN2CCC[C@H](C[NH2+]Cc3cccc4[nH]ccc43)C2)c1 ZINC000236592253 1025248275 /nfs/dbraw/zinc/24/82/75/1025248275.db2.gz CZYKEGIOFLKMJU-MRXNPFEDSA-N 2 0 339.508 4.231 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2occc2c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000511985604 1025396518 /nfs/dbraw/zinc/39/65/18/1025396518.db2.gz AQDRCOCJWSSLRC-UTKZUKDTSA-N 2 0 334.463 4.433 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2ncc(Cl)s2)C[N@@H+]1Cc1ccccc1 ZINC000472037149 1025461440 /nfs/dbraw/zinc/46/14/40/1025461440.db2.gz HQRSXQKRRPEMEJ-GDBMZVCRSA-N 2 0 349.931 4.187 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cc(O)cc(F)c2)cc1 ZINC000472040313 1025475109 /nfs/dbraw/zinc/47/51/09/1025475109.db2.gz BUNXJUUZQJURKL-MRXNPFEDSA-N 2 0 342.458 4.196 20 0 EIADRP CCSc1cccc(C[NH2+]Cc2ccc(C[NH+](C)C)c(F)c2)c1 ZINC000472051754 1025526884 /nfs/dbraw/zinc/52/68/84/1025526884.db2.gz AJHSNXXIQNCXFG-UHFFFAOYSA-N 2 0 332.488 4.289 20 0 EIADRP Cc1ccc2[nH]c(C[NH2+]Cc3ccc(C[NH+](C)C)c(F)c3)cc2c1C ZINC000472052654 1025544384 /nfs/dbraw/zinc/54/43/84/1025544384.db2.gz FHZWSZMZRQPDBA-UHFFFAOYSA-N 2 0 339.458 4.275 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)n1c2ccc(C)cc2c2c1CC[NH2+]C2 ZINC001167826162 1025619232 /nfs/dbraw/zinc/61/92/32/1025619232.db2.gz NOPXOPKDEXIAHR-QGZVFWFLSA-N 2 0 327.516 4.278 20 0 EIADRP CC[C@H]1C[C@@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)CO1 ZINC000657304320 1025838381 /nfs/dbraw/zinc/83/83/81/1025838381.db2.gz YKRJZRDOGBWOPC-RTWAWAEBSA-N 2 0 338.495 4.072 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCN([C@@H](C)c2ccc(F)cc2)CC1 ZINC001167835855 1025838986 /nfs/dbraw/zinc/83/89/86/1025838986.db2.gz URHYHUJXAIJPTP-OALUTQOASA-N 2 0 349.538 4.015 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000511046585 1025840429 /nfs/dbraw/zinc/84/04/29/1025840429.db2.gz KXVCVIZZTZZZJF-OAHLLOKOSA-N 2 0 342.449 4.348 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(Oc2cccc(C)c2)CC1 ZINC001167839386 1025851987 /nfs/dbraw/zinc/85/19/87/1025851987.db2.gz XPDDRCKVZYELIT-LJQANCHMSA-N 2 0 332.532 4.349 20 0 EIADRP CC(C)C1CCC(C[NH2+][C@@H]2CCN(Cc3ccccn3)C[C@H]2C)CC1 ZINC000512056042 1025853279 /nfs/dbraw/zinc/85/32/79/1025853279.db2.gz FFDYIXVGJMFVKQ-FYYGKBSSSA-N 2 0 343.559 4.344 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC2(CCc3ccccc3O2)CC1 ZINC001167840075 1025856941 /nfs/dbraw/zinc/85/69/41/1025856941.db2.gz DOBYXNFOCDQEGL-IBGZPJMESA-N 2 0 344.543 4.357 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+]Cc1cccc(OCc2ccccc2Cl)c1 ZINC000415020238 1025857589 /nfs/dbraw/zinc/85/75/89/1025857589.db2.gz JKKWUUGWQMBIDA-HNNXBMFYSA-N 2 0 332.875 4.136 20 0 EIADRP COc1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C2CC2)cc1 ZINC001167967034 1025862801 /nfs/dbraw/zinc/86/28/01/1025862801.db2.gz AGYCZDFQRQWZMC-RKKYOWQMSA-N 2 0 340.511 4.141 20 0 EIADRP CCC[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccsc1 ZINC000187680409 1025880311 /nfs/dbraw/zinc/88/03/11/1025880311.db2.gz PCAUQSXKZXCHRA-GOSISDBHSA-N 2 0 332.513 4.320 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1cncc(F)c1 ZINC000164023836 1025883534 /nfs/dbraw/zinc/88/35/34/1025883534.db2.gz HWWDBPKGHVTVLE-INIZCTEOSA-N 2 0 327.447 4.057 20 0 EIADRP COc1cccc([C@H]2C[C@@H](C)C[N@@H+]2CCCCn2ccnc2C)c1 ZINC000344034479 1025889108 /nfs/dbraw/zinc/88/91/08/1025889108.db2.gz FASLQLGNNBFDKQ-OXQOHEQNSA-N 2 0 327.472 4.063 20 0 EIADRP C[C@@H]([NH2+]CCCN1CCCO[C@@H](C)C1)c1cc(Cl)cc(Cl)c1 ZINC000432418147 1025897710 /nfs/dbraw/zinc/89/77/10/1025897710.db2.gz QJONPYUMIPQMEU-UONOGXRCSA-N 2 0 345.314 4.145 20 0 EIADRP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1cccc(OC)c1 ZINC001167969447 1025994955 /nfs/dbraw/zinc/99/49/55/1025994955.db2.gz CGUXOUCJOVBNMZ-SMLSOGCJSA-N 2 0 328.500 4.141 20 0 EIADRP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCCC1)c1cccc(OC(F)F)c1 ZINC000390933921 1026093554 /nfs/dbraw/zinc/09/35/54/1026093554.db2.gz IHMSCUZAYPUUBQ-LSDHHAIUSA-N 2 0 326.431 4.061 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)c1cccc(OC(F)F)c1)C[NH+]1CCCCC1 ZINC000390933911 1026094253 /nfs/dbraw/zinc/09/42/53/1026094253.db2.gz IHMSCUZAYPUUBQ-GJZGRUSLSA-N 2 0 326.431 4.061 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)c1cccc(OC(F)F)c1)C[NH+]1CCCCC1 ZINC000390933906 1026095476 /nfs/dbraw/zinc/09/54/76/1026095476.db2.gz IHMSCUZAYPUUBQ-CABCVRRESA-N 2 0 326.431 4.061 20 0 EIADRP CC1CC[NH+](CCC[C@@H]([NH2+]C[C@H]2CCCO2)c2ccc(F)cc2)CC1 ZINC000344182324 1026103704 /nfs/dbraw/zinc/10/37/04/1026103704.db2.gz HBEQBOARFGLJLE-NHCUHLMSSA-N 2 0 348.506 4.148 20 0 EIADRP CCC1(C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)CCOCC1 ZINC000582091755 1026129415 /nfs/dbraw/zinc/12/94/15/1026129415.db2.gz ISXLCEUWOQUPCI-NRFANRHFSA-N 2 0 344.543 4.085 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccnn2-c2ccccc2)c1 ZINC000279160505 1026162588 /nfs/dbraw/zinc/16/25/88/1026162588.db2.gz PUASOFKXXMOQJC-UHFFFAOYSA-N 2 0 348.494 4.002 20 0 EIADRP COc1cccc(CCC[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@H]3C)C2)c1 ZINC000303950945 1026297282 /nfs/dbraw/zinc/29/72/82/1026297282.db2.gz VRMRGZNYEFNSAA-CTNGQTDRSA-N 2 0 344.543 4.214 20 0 EIADRP c1ccc2c(c1)OCCC[C@@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000162925788 1026331990 /nfs/dbraw/zinc/33/19/90/1026331990.db2.gz BVNRWPMYEHWUAQ-NRFANRHFSA-N 2 0 336.479 4.286 20 0 EIADRP CCOc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167978555 1026344843 /nfs/dbraw/zinc/34/48/43/1026344843.db2.gz OZCBFWYQCNKDKA-MIJOPJBOSA-N 2 0 328.500 4.141 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1sccc1Br ZINC000582221046 1026346102 /nfs/dbraw/zinc/34/61/02/1026346102.db2.gz DZPYEMZTXFMDSY-NSHDSACASA-N 2 0 343.334 4.036 20 0 EIADRP Cc1ccc2cc(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)[nH]c2c1 ZINC000657385348 1026413608 /nfs/dbraw/zinc/41/36/08/1026413608.db2.gz UPQZNZMVBJROEH-UHFFFAOYSA-N 2 0 325.500 4.363 20 0 EIADRP c1cncc([C@H]2CCC[C@@H]([NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)C2)c1 ZINC000337322972 1026463607 /nfs/dbraw/zinc/46/36/07/1026463607.db2.gz AFGWWIJLJVHJEV-JTHBVZDNSA-N 2 0 349.522 4.493 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(-c3ccccc3)n[nH]2)CC1 ZINC000506888802 1026490360 /nfs/dbraw/zinc/49/03/60/1026490360.db2.gz BAJXKODGKHDOOZ-UHFFFAOYSA-N 2 0 340.515 4.021 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cnc(CC(C)C)s2)CC1 ZINC000506891362 1026507239 /nfs/dbraw/zinc/50/72/39/1026507239.db2.gz ODHDTEVAYBVLLT-UHFFFAOYSA-N 2 0 337.577 4.286 20 0 EIADRP CO[C@H](CC(C)C)C[N@H+](C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC001167571829 1026585488 /nfs/dbraw/zinc/58/54/88/1026585488.db2.gz BAVWZTYANQEMTE-SESVDKBCSA-N 2 0 332.532 4.032 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@H](CC)c2ccc(OC)c(OC)c2)CC1 ZINC000122960425 1026672552 /nfs/dbraw/zinc/67/25/52/1026672552.db2.gz SDDVSRNITCJULM-GOSISDBHSA-N 2 0 334.504 4.009 20 0 EIADRP CCOc1ccccc1[C@H](C)N[C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512330907 1026711034 /nfs/dbraw/zinc/71/10/34/1026711034.db2.gz VVLQVQPPLDAPRY-SQNIBIBYSA-N 2 0 330.516 4.389 20 0 EIADRP CC[C@@H]1C[C@]1([NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C)c1cccc(C)c1 ZINC000500493355 1026792834 /nfs/dbraw/zinc/79/28/34/1026792834.db2.gz YAASJKYNYHQDQY-DENIHFKCSA-N 2 0 346.478 4.299 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000507449550 1026797235 /nfs/dbraw/zinc/79/72/35/1026797235.db2.gz NRDGYWXBDMBJPL-OAHLLOKOSA-N 2 0 327.299 4.302 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@H]2[NH2+]CC2(C)CC[NH+](C)CC2)cc1 ZINC000507452879 1026798951 /nfs/dbraw/zinc/79/89/51/1026798951.db2.gz YNGSAWSXKFWHSF-LEWJYISDSA-N 2 0 344.543 4.431 20 0 EIADRP C[C@@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000507479186 1026808627 /nfs/dbraw/zinc/80/86/27/1026808627.db2.gz NXDJLYDMSXMQCV-HNNXBMFYSA-N 2 0 342.449 4.348 20 0 EIADRP CCc1cnccc1[C@H](C)[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000507498289 1026812614 /nfs/dbraw/zinc/81/26/14/1026812614.db2.gz UXBRHBDLRBXQHR-CZEIZJIKSA-N 2 0 349.522 4.205 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)[C@H]1CCCOC1 ZINC000507511132 1026822892 /nfs/dbraw/zinc/82/28/92/1026822892.db2.gz NXBRGJSJWCKNGF-RXVVDRJESA-N 2 0 344.543 4.356 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@H]3CCCc4cccnc43)cc2)C1 ZINC000684954075 1026889135 /nfs/dbraw/zinc/88/91/35/1026889135.db2.gz PJDFCSLTKCFGES-GCJKJVERSA-N 2 0 349.522 4.481 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCCc4cccnc43)CC2)CC1 ZINC000684960807 1026899421 /nfs/dbraw/zinc/89/94/21/1026899421.db2.gz TZUVSLFFRUUNSP-SOAGJPPSSA-N 2 0 327.516 4.092 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000519818935 1027012123 /nfs/dbraw/zinc/01/21/23/1027012123.db2.gz FSPUSGGCZZAEDC-PDXHDDNESA-N 2 0 349.453 4.180 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cc1OC ZINC000474476299 1027106759 /nfs/dbraw/zinc/10/67/59/1027106759.db2.gz WXGBPMYDZGKMPK-RCCFBDPRSA-N 2 0 348.531 4.050 20 0 EIADRP CCc1c(C)[nH+]c2ccccc2c1NC1CC[NH+](CCCOC)CC1 ZINC000302025587 1027191065 /nfs/dbraw/zinc/19/10/65/1027191065.db2.gz HUEWDHLVBZQWKD-UHFFFAOYSA-N 2 0 341.499 4.018 20 0 EIADRP Cc1ccncc1C[NH2+]Cc1ccccc1C[N@@H+](C)C1CCCCC1 ZINC000474597014 1027261545 /nfs/dbraw/zinc/26/15/45/1027261545.db2.gz IPGNDHAUZXSQIW-UHFFFAOYSA-N 2 0 337.511 4.444 20 0 EIADRP Cc1cc(C)c(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c(C)c1 ZINC000657611658 1027286202 /nfs/dbraw/zinc/28/62/02/1027286202.db2.gz BJMNAXPAULPDHU-UHFFFAOYSA-N 2 0 337.511 4.009 20 0 EIADRP Cc1cc(Cl)ccc1C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657613826 1027304385 /nfs/dbraw/zinc/30/43/85/1027304385.db2.gz RXQQIMCNIWTDOP-UHFFFAOYSA-N 2 0 343.902 4.045 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000474628558 1027337776 /nfs/dbraw/zinc/33/77/76/1027337776.db2.gz LBXKIXAXRKKFOX-CBBWQLFWSA-N 2 0 326.937 4.215 20 0 EIADRP COc1ccc(CNC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c(F)c1 ZINC000520238420 1027342071 /nfs/dbraw/zinc/34/20/71/1027342071.db2.gz IONOEQAHQIQFGQ-KXBFYZLASA-N 2 0 348.487 4.069 20 0 EIADRP CCc1cccc(F)c1C[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000474727339 1027445287 /nfs/dbraw/zinc/44/52/87/1027445287.db2.gz JRDDSQSQKKDISP-UHFFFAOYSA-N 2 0 344.474 4.008 20 0 EIADRP CCO[P@@](C)(=O)CC[C@H](C)[NH2+]C1CCC(C)([NH+]2CCCC2)CC1 ZINC000896387991 1027448759 /nfs/dbraw/zinc/44/87/59/1027448759.db2.gz PFPJYOXPWZBTQZ-IJZBHVGQSA-N 2 0 344.480 4.096 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CCCCc2cccc(C(F)(F)F)c2)CC[N@@H+]1C ZINC000474818036 1027540176 /nfs/dbraw/zinc/54/01/76/1027540176.db2.gz RJOIYUWTFAWKDB-WMLDXEAASA-N 2 0 328.422 4.100 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)c1ccc(OC(F)F)cc1)C[NH+]1CCCCC1 ZINC000320904073 1027543050 /nfs/dbraw/zinc/54/30/50/1027543050.db2.gz CLRMOYYJAYHBIG-GJZGRUSLSA-N 2 0 326.431 4.061 20 0 EIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000152449772 1027558135 /nfs/dbraw/zinc/55/81/35/1027558135.db2.gz LGWNCVYBXKCSMZ-ICSRJNTNSA-N 2 0 340.536 4.414 20 0 EIADRP c1ccc(CC[C@H]2CCC[C@H]2[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000475548674 1027583166 /nfs/dbraw/zinc/58/31/66/1027583166.db2.gz NHTDLEWMVKHETP-OVESXRPUSA-N 2 0 326.528 4.394 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CCCOc3ccc(F)cc32)ccc1F ZINC000120857280 1027600124 /nfs/dbraw/zinc/60/01/24/1027600124.db2.gz AYGHLQMCZTUQKZ-IBGZPJMESA-N 2 0 346.421 4.030 20 0 EIADRP Cc1ccc2ccnc(NC3CC[NH+](Cc4ccccn4)CC3)c2c1 ZINC000582901830 1027639340 /nfs/dbraw/zinc/63/93/40/1027639340.db2.gz ZZNUENHKAYPTCR-UHFFFAOYSA-N 2 0 332.451 4.015 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475576788 1027693505 /nfs/dbraw/zinc/69/35/05/1027693505.db2.gz XQMFDLTWTWGIET-RWBZWWBESA-N 2 0 340.433 4.243 20 0 EIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1OC ZINC000474877572 1027725671 /nfs/dbraw/zinc/72/56/71/1027725671.db2.gz KKDCIOPJBOOVKF-GJZGRUSLSA-N 2 0 348.531 4.095 20 0 EIADRP Fc1cccc([C@@H]2CC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)c1 ZINC001167995010 1027734997 /nfs/dbraw/zinc/73/49/97/1027734997.db2.gz TYMFMBCQCZUTSG-OKCRPCIYSA-N 2 0 328.475 4.020 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CC[C@@H](C)[NH+]2CCCCC2)cc1OC ZINC000474941548 1027810197 /nfs/dbraw/zinc/81/01/97/1027810197.db2.gz JLHHRLRTIZVMQR-KZNAEPCWSA-N 2 0 348.531 4.050 20 0 EIADRP C[C@H](CC[NH+]1CCC(CCC[NH+](C)C)CC1)OCc1ccccc1 ZINC000474970545 1027838761 /nfs/dbraw/zinc/83/87/61/1027838761.db2.gz RYCMODCNRRWRBX-LJQANCHMSA-N 2 0 332.532 4.036 20 0 EIADRP FC(F)(F)c1cccc([C@H]2C[C@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)C2)c1 ZINC000280803820 1027895878 /nfs/dbraw/zinc/89/58/78/1027895878.db2.gz LBRWSLUVFNRDMD-DKIMLUQUSA-N 2 0 338.417 4.168 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000346140175 1028274102 /nfs/dbraw/zinc/27/41/02/1028274102.db2.gz XAGHEACYTWBYEM-FQEVSTJZSA-N 2 0 336.414 4.052 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](Cc1ccccc1)CC(C)C ZINC000346145573 1028283877 /nfs/dbraw/zinc/28/38/77/1028283877.db2.gz SZJGRXGQRCVFOM-UHFFFAOYSA-N 2 0 334.467 4.234 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@H]1Cc1ccc(C)cc1 ZINC000346159695 1028295229 /nfs/dbraw/zinc/29/52/29/1028295229.db2.gz CXDCMTNESVSHPL-JOCHJYFZSA-N 2 0 346.478 4.091 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@H]1c1ccccc1C ZINC000346174511 1028305798 /nfs/dbraw/zinc/30/57/98/1028305798.db2.gz MKHOEAHRPZOMIO-OAQYLSRUSA-N 2 0 332.451 4.221 20 0 EIADRP FC(F)(F)c1ccc([C@H]2C[C@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)cc1 ZINC000280963620 1028312030 /nfs/dbraw/zinc/31/20/30/1028312030.db2.gz ZGTUYTMNSFGFMK-LEUOFYLZSA-N 2 0 338.417 4.168 20 0 EIADRP CC[NH+](CC)CCOC1CC[NH+]([C@H](C)c2ccc3c(c2)CCC3)CC1 ZINC000445380554 1028502075 /nfs/dbraw/zinc/50/20/75/1028502075.db2.gz LIJQNHVRJWOKGH-GOSISDBHSA-N 2 0 344.543 4.059 20 0 EIADRP CC(C)C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccncc1 ZINC000647289151 1028645803 /nfs/dbraw/zinc/64/58/03/1028645803.db2.gz DJUCVDMAMJELMT-FQEVSTJZSA-N 2 0 329.463 4.159 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2cnc(C(F)(F)F)s2)C1 ZINC000443991944 1028713523 /nfs/dbraw/zinc/71/35/23/1028713523.db2.gz XJEAHAHGWWJEEX-STQMWFEESA-N 2 0 349.466 4.010 20 0 EIADRP C[C@@H](c1cccnc1)[NH+](C)CCCCC[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000093234347 1028726827 /nfs/dbraw/zinc/72/68/27/1028726827.db2.gz MICZDEPOUZNDIT-OALUTQOASA-N 2 0 340.515 4.333 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000650713039 1028862659 /nfs/dbraw/zinc/86/26/59/1028862659.db2.gz CEAHRGYAPRYJKS-JKSUJKDBSA-N 2 0 326.406 4.060 20 0 EIADRP C[C@H]([NH3+])C1CC[NH+](Cc2c(OC(F)F)ccc3ccccc32)CC1 ZINC000347141418 1028887788 /nfs/dbraw/zinc/88/77/88/1028887788.db2.gz WIURXJJOKOAZJH-ZDUSSCGKSA-N 2 0 334.410 4.000 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1cncc(F)c1 ZINC000157020123 1028899347 /nfs/dbraw/zinc/89/93/47/1028899347.db2.gz CFJDLHKCFCWJRW-QGZVFWFLSA-N 2 0 341.474 4.303 20 0 EIADRP CC(C)C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000647302038 1028992126 /nfs/dbraw/zinc/99/21/26/1028992126.db2.gz PKUBGQGLNVZYJC-RBBKRZOGSA-N 2 0 337.511 4.281 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000650745668 1029074113 /nfs/dbraw/zinc/07/41/13/1029074113.db2.gz LHMAIBVZMGSHBP-GOSISDBHSA-N 2 0 332.850 4.287 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cccc(C(F)(F)F)c1 ZINC000650751869 1029144889 /nfs/dbraw/zinc/14/48/89/1029144889.db2.gz CZZGDUJZXANGRZ-LLVKDONJSA-N 2 0 326.337 4.154 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000650758116 1029218174 /nfs/dbraw/zinc/21/81/74/1029218174.db2.gz JOJUZLHPKJEUQB-CYBMUJFWSA-N 2 0 338.373 4.155 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1C[NH2+]C)c1ccc(OC(F)F)cc1 ZINC000650759096 1029221986 /nfs/dbraw/zinc/22/19/86/1029221986.db2.gz CWPZGAYZXXCJNT-GOSISDBHSA-N 2 0 334.410 4.248 20 0 EIADRP C[NH+](C)CC1CC[NH+](Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC000583818867 1029226404 /nfs/dbraw/zinc/22/64/04/1029226404.db2.gz XXKUKFWLOUNLHL-UHFFFAOYSA-N 2 0 349.931 4.237 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]C2CC(c3ccc(F)cc3F)C2)CC1 ZINC000896951959 1029236717 /nfs/dbraw/zinc/23/67/17/1029236717.db2.gz SJFUWFQVWFYZPB-UHFFFAOYSA-N 2 0 334.454 4.207 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(-n2ccnc2)cc1 ZINC000157882468 1029260993 /nfs/dbraw/zinc/26/09/93/1029260993.db2.gz RFTIWVPMOVTUCU-OALUTQOASA-N 2 0 340.515 4.178 20 0 EIADRP C[NH+]1CCC2(CCC[N@@H+]2Cc2ccc(Oc3ccccc3)o2)CC1 ZINC000475115988 1029273970 /nfs/dbraw/zinc/27/39/70/1029273970.db2.gz DKDABGLVZAEPCO-UHFFFAOYSA-N 2 0 326.440 4.132 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CCC1CC[NH2+]CC1 ZINC000650764229 1029280035 /nfs/dbraw/zinc/28/00/35/1029280035.db2.gz TZSGLZVIQSTKBT-OAHLLOKOSA-N 2 0 343.540 4.467 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)CCS2 ZINC000343471349 1029320815 /nfs/dbraw/zinc/32/08/15/1029320815.db2.gz TUFFXURMILMSDW-FUHWJXTLSA-N 2 0 336.545 4.188 20 0 EIADRP C/C(=C/c1ccccc1OC(F)F)CN(C)CCC[NH+]1CCCC1 ZINC000583903651 1029349048 /nfs/dbraw/zinc/34/90/48/1029349048.db2.gz DZCRQPYMOXEXGJ-PEZBUJJGSA-N 2 0 338.442 4.109 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)CCS2 ZINC000343493593 1029355760 /nfs/dbraw/zinc/35/57/60/1029355760.db2.gz DCBDPCXJCHHLIS-LPHOPBHVSA-N 2 0 348.556 4.476 20 0 EIADRP Cc1nc(F)ccc1C[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000278508273 1029387401 /nfs/dbraw/zinc/38/74/01/1029387401.db2.gz OMYAECNNSROIQT-UHFFFAOYSA-N 2 0 341.474 4.195 20 0 EIADRP COC1CCC(C)(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)CC1 ZINC000475202328 1029432678 /nfs/dbraw/zinc/43/26/78/1029432678.db2.gz MBDIVHRJQGANHW-PPXMBRMGSA-N 2 0 336.564 4.214 20 0 EIADRP C[C@@H]1[C@H]([NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000475278834 1029485171 /nfs/dbraw/zinc/48/51/71/1029485171.db2.gz XFRGCHVCJFGVPL-NEKRIBJYSA-N 2 0 334.507 4.290 20 0 EIADRP CC(C)[C@H](COCc1ccccc1)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000446742896 1029552728 /nfs/dbraw/zinc/55/27/28/1029552728.db2.gz HOGDRZVXZINKJO-QFIPXVFZSA-N 2 0 340.511 4.079 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH2+]C2CC(N3CCC(C(F)(F)F)CC3)C2)[C@H]1C ZINC000475352774 1029566032 /nfs/dbraw/zinc/56/60/32/1029566032.db2.gz JAPIRBXHSGZGFP-WICCELJUSA-N 2 0 332.454 4.206 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H](c2ccccc2)c2ccc3ccccc3n2)C1 ZINC000584047449 1029566793 /nfs/dbraw/zinc/56/67/93/1029566793.db2.gz AGWTUCCHIUINKR-LLBVYWAGSA-N 2 0 345.490 4.431 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cccc(F)c1 ZINC000446820825 1029588423 /nfs/dbraw/zinc/58/84/23/1029588423.db2.gz HXDFEBDSORWXBN-NRFANRHFSA-N 2 0 344.474 4.397 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(C(F)F)nc1 ZINC000657827563 1029606716 /nfs/dbraw/zinc/60/67/16/1029606716.db2.gz NLNUSNDNFBMXPG-OAHLLOKOSA-N 2 0 345.437 4.466 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CCC[C@H](C(F)F)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168064287 1029626599 /nfs/dbraw/zinc/62/65/99/1029626599.db2.gz PSUSMUZAAHPBMS-NBMJBFSESA-N 2 0 336.470 4.405 20 0 EIADRP c1ccc(CC[C@H]2CCC[C@H]2[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446886669 1029631911 /nfs/dbraw/zinc/63/19/11/1029631911.db2.gz IMYCMTKOADSGHE-IFMALSPDSA-N 2 0 326.528 4.252 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000447025848 1029666956 /nfs/dbraw/zinc/66/69/56/1029666956.db2.gz FDHGICDVWZXNTI-ZDUSSCGKSA-N 2 0 326.406 4.230 20 0 EIADRP Clc1cc2c(c(Cl)c1)CC[C@@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447036291 1029669200 /nfs/dbraw/zinc/66/92/00/1029669200.db2.gz DNMNRHFEFDHYHP-SFHVURJKSA-N 2 0 339.310 4.445 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](C[C@@H](OC(C)C)c2ccccc2)CC1 ZINC000428468339 1029684755 /nfs/dbraw/zinc/68/47/55/1029684755.db2.gz NONTXGMZZLCUFR-OAQYLSRUSA-N 2 0 332.532 4.207 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc(C(F)F)nc1 ZINC000657838532 1029722194 /nfs/dbraw/zinc/72/21/94/1029722194.db2.gz VJZVXJLEDXZHMQ-OAHLLOKOSA-N 2 0 325.447 4.182 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657838282 1029724263 /nfs/dbraw/zinc/72/42/63/1029724263.db2.gz PYOBGHVSNFTFBW-GJZGRUSLSA-N 2 0 325.447 4.182 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cc2ccncc2s1 ZINC000657837989 1029732641 /nfs/dbraw/zinc/73/26/41/1029732641.db2.gz LTXXPTONJRQIOW-HOTGVXAUSA-N 2 0 331.529 4.459 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000708525632 1029812893 /nfs/dbraw/zinc/81/28/93/1029812893.db2.gz WTWGNUQRWUBCHO-MAUKXSAKSA-N 2 0 346.877 4.337 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000708525634 1029813343 /nfs/dbraw/zinc/81/33/43/1029813343.db2.gz WTWGNUQRWUBCHO-QAPCUYQASA-N 2 0 346.877 4.337 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000091287733 1029882454 /nfs/dbraw/zinc/88/24/54/1029882454.db2.gz QKFXDEDQGIWJGV-CXAGYDPISA-N 2 0 326.406 4.088 20 0 EIADRP c1cc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc(-c2ccncc2)c1 ZINC000092066689 1029899967 /nfs/dbraw/zinc/89/99/67/1029899967.db2.gz YOXZFEVMKODDEY-GGAORHGYSA-N 2 0 347.506 4.197 20 0 EIADRP C[C@H](C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1cccc(Cl)c1 ZINC000525874926 1030091504 /nfs/dbraw/zinc/09/15/04/1030091504.db2.gz RSMXODSGCRGHPK-OXFYSEKESA-N 2 0 332.919 4.392 20 0 EIADRP Fc1ccc([C@@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2ccccc2)cc1 ZINC000447549293 1030153486 /nfs/dbraw/zinc/15/34/86/1030153486.db2.gz DTIURRYKCOJUPU-QFIPXVFZSA-N 2 0 338.470 4.379 20 0 EIADRP Clc1cc2c(c(Cl)c1)[C@@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CC2 ZINC000447574508 1030160373 /nfs/dbraw/zinc/16/03/73/1030160373.db2.gz VSTOZOZNKTYVGS-KRWDZBQOSA-N 2 0 339.310 4.445 20 0 EIADRP Fc1ccc(C[C@@H]([NH2+]C2CCN(C3CC3)CC2)c2ccccc2)cc1 ZINC000447560906 1030168378 /nfs/dbraw/zinc/16/83/78/1030168378.db2.gz GDIRCYTUHRQVBV-JOCHJYFZSA-N 2 0 338.470 4.326 20 0 EIADRP CC(C)COc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000447566823 1030179026 /nfs/dbraw/zinc/17/90/26/1030179026.db2.gz WSPIVZOAUOKWQM-KRWDZBQOSA-N 2 0 330.516 4.246 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@H](c2cccnc2)C2CC2)C3)cc1 ZINC000447588806 1030188798 /nfs/dbraw/zinc/18/87/98/1030188798.db2.gz VNTDPFGVYHXBDI-GPJHCHHRSA-N 2 0 347.506 4.318 20 0 EIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CCCO2 ZINC000447575497 1030202899 /nfs/dbraw/zinc/20/28/99/1030202899.db2.gz YGJMDMXLCTZNFV-NRFANRHFSA-N 2 0 342.527 4.488 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@@H]2CCCCS2)C3)cc1 ZINC000447601365 1030224424 /nfs/dbraw/zinc/22/44/24/1030224424.db2.gz PKMPQMPGHGZDEZ-YRPNKDGESA-N 2 0 330.541 4.057 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530217580 1030225628 /nfs/dbraw/zinc/22/56/28/1030225628.db2.gz UFJLZDBAGCGITE-BEFAXECRSA-N 2 0 325.500 4.098 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCc2c(F)cccc2Cl)C[C@H]1C ZINC000447723516 1030310759 /nfs/dbraw/zinc/31/07/59/1030310759.db2.gz PQHSWZYRNMKCGF-CABCVRRESA-N 2 0 326.887 4.216 20 0 EIADRP C[C@H](CC[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccccc1 ZINC000447735315 1030312829 /nfs/dbraw/zinc/31/28/29/1030312829.db2.gz CVXCFBZANCNWSL-AQNXPRMDSA-N 2 0 344.543 4.001 20 0 EIADRP Cc1ccc(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)c(C)n1 ZINC000186931832 1030314968 /nfs/dbraw/zinc/31/49/68/1030314968.db2.gz UTTZITYCGZJEQH-UHFFFAOYSA-N 2 0 337.511 4.042 20 0 EIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1nccc2ccccc21 ZINC000685456748 1030334512 /nfs/dbraw/zinc/33/45/12/1030334512.db2.gz WTVBMEVGYJEZBD-UHFFFAOYSA-N 2 0 333.479 4.319 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C[C@@H]2CCC3(CCCC3)O2)C1 ZINC000530358418 1030336891 /nfs/dbraw/zinc/33/68/91/1030336891.db2.gz ZQKPMSQORVLIAF-AABGKKOBSA-N 2 0 334.548 4.065 20 0 EIADRP COc1cc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)ccc1C ZINC000447817239 1030338262 /nfs/dbraw/zinc/33/82/62/1030338262.db2.gz PBGRIXRNYMHHHH-UHFFFAOYSA-N 2 0 338.495 4.005 20 0 EIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3cc(F)cc(C(F)(F)F)c3)C2)CC1 ZINC000685463175 1030340635 /nfs/dbraw/zinc/34/06/35/1030340635.db2.gz XDZAADOWVRDWDS-OAHLLOKOSA-N 2 0 344.396 4.008 20 0 EIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccc(Oc4ccccc4)o3)C2)CC1 ZINC000685462861 1030341067 /nfs/dbraw/zinc/34/10/67/1030341067.db2.gz VFXUMRJATBYWMD-SFHVURJKSA-N 2 0 340.467 4.236 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1cccc2cccnc21 ZINC000708571139 1030390822 /nfs/dbraw/zinc/39/08/22/1030390822.db2.gz QRYGAPPCCUQJCV-XMSQKQJNSA-N 2 0 345.490 4.093 20 0 EIADRP C[C@H]([NH2+]CCc1ccc(F)c(F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000527041846 1030422463 /nfs/dbraw/zinc/42/24/63/1030422463.db2.gz BSTWTEHIJUHSFI-LPHOPBHVSA-N 2 0 344.449 4.008 20 0 EIADRP C[C@@H](CCSc1ccccc1)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000431607622 1030474548 /nfs/dbraw/zinc/47/45/48/1030474548.db2.gz IIYDPFJVKASULJ-PKOBYXMFSA-N 2 0 332.557 4.221 20 0 EIADRP C[C@H](CC1CCOCC1)[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000685665254 1030663547 /nfs/dbraw/zinc/66/35/47/1030663547.db2.gz ZWTBYODIVNWVFH-KNQAVFIVSA-N 2 0 344.543 4.084 20 0 EIADRP Cc1cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cc(C)c1O ZINC000398182637 1030735354 /nfs/dbraw/zinc/73/53/54/1030735354.db2.gz KKMMTTGOQHOVJI-NQIIRXRSSA-N 2 0 338.495 4.009 20 0 EIADRP C[C@H]([NH2+]CCc1cncn1C)c1ccc(O[C@@H](C)c2ccccc2)cc1 ZINC000657982951 1030738211 /nfs/dbraw/zinc/73/82/11/1030738211.db2.gz PCPDHLYGPYKHJB-ROUUACIJSA-N 2 0 349.478 4.453 20 0 EIADRP C[C@@H]([NH2+]CCc1cncn1C)c1ccc(O[C@@H](C)c2ccccc2)cc1 ZINC000657982947 1030741677 /nfs/dbraw/zinc/74/16/77/1030741677.db2.gz PCPDHLYGPYKHJB-MSOLQXFVSA-N 2 0 349.478 4.453 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2cnc(C3CCCC3)s2)CC1 ZINC000093688416 1030743776 /nfs/dbraw/zinc/74/37/76/1030743776.db2.gz RXYIZIZTKSMUBK-UHFFFAOYSA-N 2 0 335.561 4.355 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)ccn1 ZINC000527635715 1030789619 /nfs/dbraw/zinc/78/96/19/1030789619.db2.gz FLBIMLYKHMNTFS-UHFFFAOYSA-N 2 0 345.490 4.408 20 0 EIADRP c1csc(CN2CCC[C@H](C[NH2+]Cc3ccc4cc[nH]c4c3)C2)c1 ZINC000527650545 1030800613 /nfs/dbraw/zinc/80/06/13/1030800613.db2.gz QBZYKCCRALMURZ-QGZVFWFLSA-N 2 0 339.508 4.231 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2noc3ccccc32)CC1 ZINC000658067243 1030813654 /nfs/dbraw/zinc/81/36/54/1030813654.db2.gz TWKXKVPSLCGKKJ-OXQOHEQNSA-N 2 0 341.499 4.003 20 0 EIADRP c1nc([C@H]2CCC[N@@H+](Cc3ccnc4ccccc34)C2)n2c1CCCC2 ZINC000548859327 1030835983 /nfs/dbraw/zinc/83/59/83/1030835983.db2.gz ZJIIAKOYXPMNLV-SFHVURJKSA-N 2 0 346.478 4.147 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2occc2c1)c1cccc(OCC[NH+](C)C)c1 ZINC000658120392 1030840842 /nfs/dbraw/zinc/84/08/42/1030840842.db2.gz RKESBWRYWLSYHO-MRXNPFEDSA-N 2 0 338.451 4.224 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)[C@@H]1C[C@H]1c1ccccc1 ZINC000658166169 1030864001 /nfs/dbraw/zinc/86/40/01/1030864001.db2.gz MVXIPYXZJDPJPX-LEOXJPRUSA-N 2 0 349.522 4.075 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)C1CCCCCC1 ZINC000658167558 1030864570 /nfs/dbraw/zinc/86/45/70/1030864570.db2.gz SSIDGNCMEVDILN-SFHVURJKSA-N 2 0 329.532 4.242 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](CCCSCc2ccccc2)CC1 ZINC001168199754 1031105061 /nfs/dbraw/zinc/10/50/61/1031105061.db2.gz BMOIIWDAVWBPJG-UHFFFAOYSA-N 2 0 334.573 4.364 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2c(C)cc(C)c(C(C)=O)c2C)C[C@@H]1C ZINC000532589647 1031321078 /nfs/dbraw/zinc/32/10/78/1031321078.db2.gz ROVIOMMRJWFCJD-LPHOPBHVSA-N 2 0 330.516 4.119 20 0 EIADRP CCC[NH+]1CCC(N(C)Cc2cnc(-c3ccccc3F)s2)CC1 ZINC000449015744 1031342001 /nfs/dbraw/zinc/34/20/01/1031342001.db2.gz MDNAGSTVXDUFFM-UHFFFAOYSA-N 2 0 347.503 4.255 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2CCOC3(CCC3)C2)cc1 ZINC000449080389 1031435356 /nfs/dbraw/zinc/43/53/56/1031435356.db2.gz VTTAYHOTQNXRDC-GHTZIAJQSA-N 2 0 342.527 4.252 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000532626163 1031442094 /nfs/dbraw/zinc/44/20/94/1031442094.db2.gz MCVBXDINYMBSLK-DLBZAZTESA-N 2 0 343.540 4.350 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccnn2C2CCCC2)c1 ZINC000449098617 1031442716 /nfs/dbraw/zinc/44/27/16/1031442716.db2.gz KHCZAWASMILXBI-UHFFFAOYSA-N 2 0 340.515 4.128 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CCc2c[nH]c3ccccc23)CCN1Cc1ccccc1 ZINC000531677765 1031470402 /nfs/dbraw/zinc/47/04/02/1031470402.db2.gz ZTALYEMLJCXDEL-GHTZIAJQSA-N 2 0 347.506 4.353 20 0 EIADRP COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1ccc(-n2ccnc2)c(F)c1 ZINC000531696523 1031477279 /nfs/dbraw/zinc/47/72/79/1031477279.db2.gz KQAMAWHASNUBKZ-OAHLLOKOSA-N 2 0 339.414 4.179 20 0 EIADRP CS[C@@H]1CCC[C@@H]([NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)C1 ZINC000449143943 1031478172 /nfs/dbraw/zinc/47/81/72/1031478172.db2.gz RNBYESBIVXZLAG-IOMROCGXSA-N 2 0 346.584 4.346 20 0 EIADRP C[C@H](NC1(C[NH2+][C@H]2CCOC3(CCC3)C2)CCCC1)c1ccccc1 ZINC000449154731 1031484552 /nfs/dbraw/zinc/48/45/52/1031484552.db2.gz JJLDQHRMQUNESO-ICSRJNTNSA-N 2 0 342.527 4.341 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)cc1C ZINC000531705042 1031489496 /nfs/dbraw/zinc/48/94/96/1031489496.db2.gz WNMDKGRFIDXMOF-LJQANCHMSA-N 2 0 340.511 4.485 20 0 EIADRP CCSCC[C@@H](C)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449166128 1031505920 /nfs/dbraw/zinc/50/59/20/1031505920.db2.gz BYARVEZAMCZYJB-MSOLQXFVSA-N 2 0 334.573 4.203 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCOC3(CCC3)C2)CC1 ZINC000449194097 1031513278 /nfs/dbraw/zinc/51/32/78/1031513278.db2.gz XJMYQOVRIGWSQD-GOSISDBHSA-N 2 0 336.564 4.357 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCCC(F)(F)C2)CC1 ZINC000449183957 1031521653 /nfs/dbraw/zinc/52/16/53/1031521653.db2.gz GPAAQCYIZGOOTA-VQIMIIECSA-N 2 0 336.470 4.250 20 0 EIADRP COc1ccc2c(c1)C[C@@H]([N@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001168251736 1031524057 /nfs/dbraw/zinc/52/40/57/1031524057.db2.gz KYUAERVMTHGZJO-JBACZVJFSA-N 2 0 342.527 4.067 20 0 EIADRP C[C@H](CCCc1cccnc1)[NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000453070102 1031534546 /nfs/dbraw/zinc/53/45/46/1031534546.db2.gz ZVUABRYSDLFWLO-VAMGGRTRSA-N 2 0 331.548 4.141 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)c1ccncn1 ZINC000453071182 1031537616 /nfs/dbraw/zinc/53/76/16/1031537616.db2.gz DBAQWKHFUVCVSB-KRWDZBQOSA-N 2 0 346.478 4.056 20 0 EIADRP C[C@H]1CC[C@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)c2sccc21 ZINC000453061650 1031552216 /nfs/dbraw/zinc/55/22/16/1031552216.db2.gz LEHIGAGFPFVRLD-KXBFYZLASA-N 2 0 344.524 4.417 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2cc3cccnc3o2)C[N@@H+]1Cc1ccccc1 ZINC000449217117 1031552352 /nfs/dbraw/zinc/55/23/52/1031552352.db2.gz WZNDHCAMSUOETM-IEBWSBKVSA-N 2 0 349.478 4.218 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H]1CCc2cc(F)c(F)c(F)c21 ZINC000449217889 1031553336 /nfs/dbraw/zinc/55/33/36/1031553336.db2.gz COBKHGBOAJWTIG-DOMZBBRYSA-N 2 0 328.422 4.191 20 0 EIADRP C[C@H]([NH2+]C1CCC(OC2CCCC2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000449231324 1031560093 /nfs/dbraw/zinc/56/00/93/1031560093.db2.gz DGUQYEXVNBSWJX-BXRCABCMSA-N 2 0 348.575 4.499 20 0 EIADRP C[C@H]1CC[C@@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)c2sccc21 ZINC000453094780 1031590752 /nfs/dbraw/zinc/59/07/52/1031590752.db2.gz SZDKZRZDUTVPIA-MAUKXSAKSA-N 2 0 344.524 4.417 20 0 EIADRP COCC[C@H]([NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1)C(C)(C)C ZINC000449312757 1031630351 /nfs/dbraw/zinc/63/03/51/1031630351.db2.gz NFQQKNWSQVMAJP-NQIIRXRSSA-N 2 0 346.559 4.123 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H](C)CCCc2cccnc2)CC1 ZINC000453134438 1031639452 /nfs/dbraw/zinc/63/94/52/1031639452.db2.gz RXXDQTCIKTWWIQ-LJQANCHMSA-N 2 0 331.548 4.141 20 0 EIADRP COCC(C)(C)CCC[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449334407 1031652814 /nfs/dbraw/zinc/65/28/14/1031652814.db2.gz XHDWFTOYWMVGOH-IBGZPJMESA-N 2 0 346.559 4.124 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C[C@H]2CCC[C@@H](CO)C2)CC1 ZINC000449335409 1031653450 /nfs/dbraw/zinc/65/34/50/1031653450.db2.gz ZROAPACRKHWBQZ-ZWKOTPCHSA-N 2 0 338.580 4.054 20 0 EIADRP Cc1nccn1CCCC[N@@H+](CC(C)C)[C@H]1CCCc2cccnc21 ZINC000126885678 1031665351 /nfs/dbraw/zinc/66/53/51/1031665351.db2.gz UGXUTARUDQSHHL-FQEVSTJZSA-N 2 0 340.515 4.402 20 0 EIADRP CC(C)OCCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000453194484 1031700792 /nfs/dbraw/zinc/70/07/92/1031700792.db2.gz NNTVXDIWILJMOG-YPAWHYETSA-N 2 0 344.543 4.224 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@H]21)C(F)(F)F ZINC000453207617 1031718987 /nfs/dbraw/zinc/71/89/87/1031718987.db2.gz WMJQURBRAGWVNG-SPUZQDLCSA-N 2 0 340.433 4.218 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C2CC2)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000188722198 1031730272 /nfs/dbraw/zinc/73/02/72/1031730272.db2.gz VHAGDBLOZHVBCA-KRWDZBQOSA-N 2 0 338.495 4.355 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000453256130 1031779247 /nfs/dbraw/zinc/77/92/47/1031779247.db2.gz QQBARDLRMJOYEQ-IFMALSPDSA-N 2 0 337.511 4.425 20 0 EIADRP Cc1cc([C@@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)ccc1F ZINC000453266670 1031790465 /nfs/dbraw/zinc/79/04/65/1031790465.db2.gz ZOWKFEUSYFHSEP-IAGOWNOFSA-N 2 0 344.474 4.486 20 0 EIADRP Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)ccc1F ZINC000453266669 1031790574 /nfs/dbraw/zinc/79/05/74/1031790574.db2.gz ZOWKFEUSYFHSEP-DLBZAZTESA-N 2 0 344.474 4.486 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CC2(CF)CCOCC2)CC1 ZINC000449489410 1031798961 /nfs/dbraw/zinc/79/89/61/1031798961.db2.gz RLLOIGZCHUUNTQ-UHFFFAOYSA-N 2 0 342.543 4.022 20 0 EIADRP CCN(CC)[C@H](C[NH2+]C1CCC2(CCOCC2)CC1)c1ccccc1 ZINC000531932702 1031840427 /nfs/dbraw/zinc/84/04/27/1031840427.db2.gz DXLXWQHBPWNESZ-OAQYLSRUSA-N 2 0 344.543 4.399 20 0 EIADRP COc1cc(-c2ccccc2)ccc1CNC1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449560765 1031847761 /nfs/dbraw/zinc/84/77/61/1031847761.db2.gz PJZOJMJFZCUPKJ-SEJPIABJSA-N 2 0 336.479 4.077 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1F ZINC000453359693 1031889123 /nfs/dbraw/zinc/88/91/23/1031889123.db2.gz QFNHWAAPNACHMS-RLFDKKOZSA-N 2 0 346.490 4.075 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1cc(Br)cs1 ZINC000453387217 1031896247 /nfs/dbraw/zinc/89/62/47/1031896247.db2.gz BALBBVUZLGNSDB-LLVKDONJSA-N 2 0 331.323 4.036 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000531972415 1031908944 /nfs/dbraw/zinc/90/89/44/1031908944.db2.gz RIVLNIKSUXKXEW-UWJYYQICSA-N 2 0 344.449 4.180 20 0 EIADRP COc1cc(C)c([C@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cc1OC ZINC000531973688 1031912855 /nfs/dbraw/zinc/91/28/55/1031912855.db2.gz UYHGIVQOJZXZSX-SFHVURJKSA-N 2 0 348.531 4.319 20 0 EIADRP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]C1CCC2(CCOCC2)CC1 ZINC000531979786 1031926573 /nfs/dbraw/zinc/92/65/73/1031926573.db2.gz VSVWPYQAUCIGFK-UYAOXDASSA-N 2 0 336.564 4.216 20 0 EIADRP C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453405340 1031940584 /nfs/dbraw/zinc/94/05/84/1031940584.db2.gz QJHQZFUBZBBNID-AWEZNQCLSA-N 2 0 328.422 4.100 20 0 EIADRP Cc1cc([C@@H]([NH2+]CCCC[N@@H+](C)C2CC2)c2cccnc2)ccc1F ZINC000453405920 1031941039 /nfs/dbraw/zinc/94/10/39/1031941039.db2.gz QVPWEBAUPKUTRR-OAQYLSRUSA-N 2 0 341.474 4.083 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCCC[N@H+](C)C2CC2)c2ccccc12 ZINC000453405873 1031941864 /nfs/dbraw/zinc/94/18/64/1031941864.db2.gz QQFKQWVOVBKQRH-INIZCTEOSA-N 2 0 326.484 4.373 20 0 EIADRP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453406476 1031942110 /nfs/dbraw/zinc/94/21/10/1031942110.db2.gz RBDFDHLBHDIIKK-AWEZNQCLSA-N 2 0 328.422 4.100 20 0 EIADRP CC(C)(C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)cc1 ZINC000459370418 1031974120 /nfs/dbraw/zinc/97/41/20/1031974120.db2.gz IKZUBAVOYSAELY-UHFFFAOYSA-N 2 0 343.902 4.271 20 0 EIADRP CCO[C@@H]1CCCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000449761229 1031980405 /nfs/dbraw/zinc/98/04/05/1031980405.db2.gz VVKSITMDZXNWTP-RFQIGKHKSA-N 2 0 342.527 4.119 20 0 EIADRP Clc1cccc([C@H]2CC[C@@H]([NH2+]C3CC[NH+](CC4CC4)CC3)C2)c1 ZINC000449771972 1031995118 /nfs/dbraw/zinc/99/51/18/1031995118.db2.gz KNFROFSIEZUJKI-FXAWDEMLSA-N 2 0 332.919 4.440 20 0 EIADRP Clc1cccc([C@@H]2CC[C@@H]([NH2+]C3CC[NH+](CC4CC4)CC3)C2)c1 ZINC000449772159 1031995506 /nfs/dbraw/zinc/99/55/06/1031995506.db2.gz KNFROFSIEZUJKI-YLJYHZDGSA-N 2 0 332.919 4.440 20 0 EIADRP FC1(F)CCC([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000512632314 1033555741 /nfs/dbraw/zinc/55/57/41/1033555741.db2.gz YZSBOIQZBGAPKD-YZGWKJHDSA-N 2 0 348.481 4.455 20 0 EIADRP Cc1cnc([C@H](C)[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)o1 ZINC000433048675 1033725014 /nfs/dbraw/zinc/72/50/14/1033725014.db2.gz YCHJZLPQAAVRTO-SFHVURJKSA-N 2 0 339.483 4.032 20 0 EIADRP COc1cc(-c2ccccc2)ccc1C[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000512772673 1033904632 /nfs/dbraw/zinc/90/46/32/1033904632.db2.gz CWTVGMGTGQYLTH-FQEVSTJZSA-N 2 0 347.462 4.465 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000261722886 1034079282 /nfs/dbraw/zinc/07/92/82/1034079282.db2.gz LYXUBZKTVBOUGR-CXAGYDPISA-N 2 0 326.406 4.230 20 0 EIADRP Brc1ccc(C[NH2+]CCCCC[NH+]2CCCCC2)cc1 ZINC000500914137 1034098372 /nfs/dbraw/zinc/09/83/72/1034098372.db2.gz DVVMOEVABNUWKW-UHFFFAOYSA-N 2 0 339.321 4.195 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000333303410 1034627377 /nfs/dbraw/zinc/62/73/77/1034627377.db2.gz QLCMFRXPUSOVPY-IOASZLSFSA-N 2 0 345.487 4.186 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000333347527 1034816301 /nfs/dbraw/zinc/81/63/01/1034816301.db2.gz ZPKMZMYIDKMKLB-BZUAXINKSA-N 2 0 327.497 4.047 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000509927395 1035012097 /nfs/dbraw/zinc/01/20/97/1035012097.db2.gz PEMNIHHGUWXXOG-AZGFIHASSA-N 2 0 344.543 4.338 20 0 EIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@H]([NH2+]C4CCSCC4)[C@H]3C2)cc1 ZINC000513683637 1035101004 /nfs/dbraw/zinc/10/10/04/1035101004.db2.gz LUBPYKMVIWMFOB-JBACZVJFSA-N 2 0 344.568 4.162 20 0 EIADRP Cc1ccc([C@@H](Cn2ccnc2)[NH2+][C@H](C)c2cccc(CO)c2)c(C)c1 ZINC000345246492 1035170750 /nfs/dbraw/zinc/17/07/50/1035170750.db2.gz HGFIOBNZYAMDBU-XMSQKQJNSA-N 2 0 349.478 4.084 20 0 EIADRP Cc1ccccc1CCC[N@@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501081998 1035374530 /nfs/dbraw/zinc/37/45/30/1035374530.db2.gz QHWCLNCHZZNOQJ-UHFFFAOYSA-N 2 0 337.511 4.171 20 0 EIADRP CCc1cc(OC)ccc1C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000501475317 1035452644 /nfs/dbraw/zinc/45/26/44/1035452644.db2.gz JINAZXBBFULWMP-UHFFFAOYSA-N 2 0 338.495 4.143 20 0 EIADRP c1csc([C@H]2c3ccsc3CC[N@H+]2CC[C@@H]2CCC[NH2+]C2)c1 ZINC000420320512 1035511931 /nfs/dbraw/zinc/51/19/31/1035511931.db2.gz QKXLOIGOHNMZMQ-KBXCAEBGSA-N 2 0 332.538 4.147 20 0 EIADRP c1csc(C[N@@H+](CCCC2CCCC2)[C@H]2CC23CC[NH2+]CC3)n1 ZINC000420319149 1035515761 /nfs/dbraw/zinc/51/57/61/1035515761.db2.gz XESXRUHOFXCLRU-KRWDZBQOSA-N 2 0 333.545 4.058 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[N@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000420326852 1035531245 /nfs/dbraw/zinc/53/12/45/1035531245.db2.gz XSWMONHUSDQKKZ-DLBZAZTESA-N 2 0 343.540 4.419 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000420328279 1035533717 /nfs/dbraw/zinc/53/37/17/1035533717.db2.gz ZVTDIVMAVVLURT-HZPDHXFCSA-N 2 0 329.513 4.111 20 0 EIADRP CSCC1(CC[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000595067426 1035548605 /nfs/dbraw/zinc/54/86/05/1035548605.db2.gz ILNPRTXKAGURLZ-PKOBYXMFSA-N 2 0 332.557 4.020 20 0 EIADRP CC(C)c1ccc([C@H](C)[NH+]2CCC([C@H]3C[C@H]([NH3+])CCO3)CC2)cc1 ZINC000420388980 1035563664 /nfs/dbraw/zinc/56/36/64/1035563664.db2.gz LUDVXPYYDYPUPK-ZLGUVYLKSA-N 2 0 330.516 4.089 20 0 EIADRP FC(F)(F)c1cccc([C@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)C2CC2)c1 ZINC000420402608 1035577147 /nfs/dbraw/zinc/57/71/47/1035577147.db2.gz KBQZNWLYRALYCT-SUMWQHHRSA-N 2 0 326.406 4.136 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc3sccc3c2)[C@H](C)C1 ZINC000575222286 1035729127 /nfs/dbraw/zinc/72/91/27/1035729127.db2.gz ZMWVFJIJQRIMIX-APWZRJJASA-N 2 0 346.540 4.128 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000491057590 1035798210 /nfs/dbraw/zinc/79/82/10/1035798210.db2.gz FUEARGSCFBBBAI-HXUWFJFHSA-N 2 0 328.887 4.361 20 0 EIADRP CSC1(C[NH2+]C(c2ccccc2)c2ccccc2)CC[NH+](C)CC1 ZINC000571213137 1036018073 /nfs/dbraw/zinc/01/80/73/1036018073.db2.gz YVHJICSHBFUQDS-UHFFFAOYSA-N 2 0 340.536 4.193 20 0 EIADRP Cc1cccc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)n1 ZINC000571380352 1036037844 /nfs/dbraw/zinc/03/78/44/1036037844.db2.gz IPAXKICDKUKXEN-YMPZKCBVSA-N 2 0 349.522 4.170 20 0 EIADRP Cc1c(F)cccc1-c1ccc(C[NH2+]CCC2CC[NH+](C)CC2)o1 ZINC000237158187 1036053624 /nfs/dbraw/zinc/05/36/24/1036053624.db2.gz KOEMLIWJVBXMAM-UHFFFAOYSA-N 2 0 330.447 4.216 20 0 EIADRP COc1ccccc1/C=C\C[NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000588177760 1036285465 /nfs/dbraw/zinc/28/54/65/1036285465.db2.gz FPBIHGYKSGUNJN-WXUGTPJSSA-N 2 0 330.516 4.056 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C[C@H]2CC23CCSCC3)CC1 ZINC000421374819 1036323453 /nfs/dbraw/zinc/32/34/53/1036323453.db2.gz HLHMZNUQORXVSD-ZHALLVOQSA-N 2 0 336.589 4.152 20 0 EIADRP C/C(=C/c1ccccc1OC(F)F)C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421375484 1036325732 /nfs/dbraw/zinc/32/57/32/1036325732.db2.gz PFSRKWYWGKKVQI-OWBHPGMISA-N 2 0 338.442 4.154 20 0 EIADRP Cc1ccc2[nH+]ccc(N(C)C[C@@H]3CC[N@H+](C)[C@H]3c3cccnc3)c2c1 ZINC000486002062 1036416994 /nfs/dbraw/zinc/41/69/94/1036416994.db2.gz IHIFOUCSFHFYLU-AVRDEDQJSA-N 2 0 346.478 4.067 20 0 EIADRP c1nc(C2CCCCC2)sc1C[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000572243018 1036471054 /nfs/dbraw/zinc/47/10/54/1036471054.db2.gz HHUBFJPLNPPRPW-DLBZAZTESA-N 2 0 333.545 4.012 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)CC3 ZINC000486479291 1036727489 /nfs/dbraw/zinc/72/74/89/1036727489.db2.gz UMLUSGZEGGXIKO-IBGZPJMESA-N 2 0 347.506 4.185 20 0 EIADRP COc1ccc([C@@H]([NH2+]C2CCC([NH+](C)C)CC2)c2ccccc2)cc1 ZINC000513758687 1036734805 /nfs/dbraw/zinc/73/48/05/1036734805.db2.gz BIXFOFPALASBBW-AOMIVXANSA-N 2 0 338.495 4.247 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)cc1 ZINC000613259557 1036810394 /nfs/dbraw/zinc/81/03/94/1036810394.db2.gz IDWWLSJWMUCYDL-HSALFYBXSA-N 2 0 330.516 4.076 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]C2CCC([NH+](C)C)CC2)sc1Br ZINC000421890104 1036834775 /nfs/dbraw/zinc/83/47/75/1036834775.db2.gz XSCVMQYCXCKOKN-PNESKVBLSA-N 2 0 345.350 4.342 20 0 EIADRP CC[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cccc(Br)c1 ZINC000421886122 1036832854 /nfs/dbraw/zinc/83/28/54/1036832854.db2.gz UZTAPEOOTIUVAV-OFLPRAFFSA-N 2 0 339.321 4.363 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(Br)c(F)c1 ZINC000421888626 1036835241 /nfs/dbraw/zinc/83/52/41/1036835241.db2.gz WUJKAOLDQDUBCP-XGNXJENSSA-N 2 0 343.284 4.112 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421891905 1036837110 /nfs/dbraw/zinc/83/71/10/1036837110.db2.gz YYNYKUCJWUJQSW-PMTKGXAQSA-N 2 0 325.500 4.316 20 0 EIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421869841 1036839210 /nfs/dbraw/zinc/83/92/10/1036839210.db2.gz DREYOAVTPNBLTI-NVPAJSRCSA-N 2 0 344.528 4.037 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3[nH]nc4ccccc43)cc2)C1 ZINC000589641197 1036857936 /nfs/dbraw/zinc/85/79/36/1036857936.db2.gz XAORUCVHJSJQRE-QGZVFWFLSA-N 2 0 348.494 4.085 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CCC[C@@H](c2ccccc2)C1 ZINC000486859843 1036873826 /nfs/dbraw/zinc/87/38/26/1036873826.db2.gz QBXPWKDDYOIRTI-CTNGQTDRSA-N 2 0 346.478 4.392 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2ccccc2OC(F)(F)F)CC1 ZINC000589836124 1036880875 /nfs/dbraw/zinc/88/08/75/1036880875.db2.gz GVVXPQSIRSLLPR-UHFFFAOYSA-N 2 0 344.421 4.187 20 0 EIADRP CC(C)C[NH2+]C[C@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000503043719 1036883412 /nfs/dbraw/zinc/88/34/12/1036883412.db2.gz HDLPTYWMRGXHNR-WBVHZDCISA-N 2 0 328.422 4.334 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH+]1CCC(c2ccsc2)CC1 ZINC000486919964 1036890711 /nfs/dbraw/zinc/89/07/11/1036890711.db2.gz KESLBCOKSZBIJL-UHFFFAOYSA-N 2 0 338.480 4.017 20 0 EIADRP Clc1sccc1CN1C[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000710907979 1036892280 /nfs/dbraw/zinc/89/22/80/1036892280.db2.gz QQWMFBLTBZFNAQ-AEFFLSMTSA-N 2 0 346.927 4.355 20 0 EIADRP CC(C)n1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cn1 ZINC000272298750 1037153267 /nfs/dbraw/zinc/15/32/67/1037153267.db2.gz GNLATBODLQRPQL-BJLQDIEVSA-N 2 0 340.515 4.025 20 0 EIADRP Cc1oc(-c2ccccc2)nc1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000590786527 1037165479 /nfs/dbraw/zinc/16/54/79/1037165479.db2.gz DCVWXUMMPMKORE-UHFFFAOYSA-N 2 0 341.499 4.202 20 0 EIADRP Cc1csc([C@H](C)C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000273470309 1037473652 /nfs/dbraw/zinc/47/36/52/1037473652.db2.gz RXDDCUHYKATPNV-GPMSIDNRSA-N 2 0 343.540 4.055 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](CCOc2cccc3ccccc32)CC1 ZINC000488356940 1037541882 /nfs/dbraw/zinc/54/18/82/1037541882.db2.gz DMZFNHYXRXQSOC-UHFFFAOYSA-N 2 0 340.511 4.272 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](CCOc2ccc3ccccc3c2)CC1 ZINC000488361575 1037547282 /nfs/dbraw/zinc/54/72/82/1037547282.db2.gz PLFLAVJODKREDW-UHFFFAOYSA-N 2 0 340.511 4.272 20 0 EIADRP C[C@@H]1C[C@@H]1C[NH2+]C[C@@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000488415369 1037583826 /nfs/dbraw/zinc/58/38/26/1037583826.db2.gz AMULRZHPYCSPRT-VUNQQRPYSA-N 2 0 340.433 4.334 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CS1 ZINC000488436643 1037593020 /nfs/dbraw/zinc/59/30/20/1037593020.db2.gz YAGQONXUJIIPBB-YVZSJOIWSA-N 2 0 344.568 4.302 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CS1 ZINC000488547752 1037658374 /nfs/dbraw/zinc/65/83/74/1037658374.db2.gz SWQCUERTPJFSGT-LMCOJAPRSA-N 2 0 332.557 4.017 20 0 EIADRP CCCOCc1ccccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000422697045 1037800566 /nfs/dbraw/zinc/80/05/66/1037800566.db2.gz TYSBQOTWRQOUJX-PWRODBHTSA-N 2 0 330.516 4.014 20 0 EIADRP c1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422710970 1037804796 /nfs/dbraw/zinc/80/47/96/1037804796.db2.gz MBUKKSSYJFDNPG-VXPBHUBDSA-N 2 0 348.490 4.168 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c(C)c1 ZINC000422713326 1037811036 /nfs/dbraw/zinc/81/10/36/1037811036.db2.gz PNLPDRHYECLCMQ-XJABCFGWSA-N 2 0 336.479 4.210 20 0 EIADRP CCCC[C@@H]([NH2+][C@H](C)c1ccc(C[NH3+])nc1C)c1ccc(OC)cc1 ZINC000422718075 1037813041 /nfs/dbraw/zinc/81/30/41/1037813041.db2.gz WLQZOFYBIUDOGF-IIBYNOLFSA-N 2 0 341.499 4.439 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000422727199 1037817845 /nfs/dbraw/zinc/81/78/45/1037817845.db2.gz BOUTVQFYNKJAIE-SFHVURJKSA-N 3 0 331.548 4.058 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000422769111 1037828631 /nfs/dbraw/zinc/82/86/31/1037828631.db2.gz STIMPJWXUJYTFZ-ORAYPTAESA-N 2 0 329.875 4.304 20 0 EIADRP c1cc(-c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)cc2)ccn1 ZINC000422774375 1037831407 /nfs/dbraw/zinc/83/14/07/1037831407.db2.gz WTDWXIWTGZPSAA-YPAWHYETSA-N 2 0 335.495 4.149 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](c1ccc(F)cc1)C(C)(C)C ZINC000422788108 1037834212 /nfs/dbraw/zinc/83/42/12/1037834212.db2.gz VESUDZWLVGQYRW-KUHUBIRLSA-N 2 0 329.463 4.426 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccccc1COc1ccccc1Cl ZINC000422790795 1037840555 /nfs/dbraw/zinc/84/05/55/1037840555.db2.gz XZMZLRHKTLQKST-HNNXBMFYSA-N 2 0 332.875 4.136 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000422832528 1037842979 /nfs/dbraw/zinc/84/29/79/1037842979.db2.gz XWIRNIXAKIHSIH-XYPHTWIQSA-N 2 0 328.422 4.449 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000422832527 1037843943 /nfs/dbraw/zinc/84/39/43/1037843943.db2.gz XWIRNIXAKIHSIH-XOKHGSTOSA-N 2 0 328.422 4.449 20 0 EIADRP C[C@H](CC[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1 ZINC000422857705 1037846584 /nfs/dbraw/zinc/84/65/84/1037846584.db2.gz YTTZJFQTFDFTHI-PIPMEXSNSA-N 2 0 336.479 4.026 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422884742 1037853698 /nfs/dbraw/zinc/85/36/98/1037853698.db2.gz FOYIQBCSQMNLAV-MNOVXSKESA-N 2 0 335.904 4.030 20 0 EIADRP CO[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422911805 1037866660 /nfs/dbraw/zinc/86/66/60/1037866660.db2.gz LOPNYHHTODRSAB-TUCQFJRYSA-N 2 0 330.859 4.150 20 0 EIADRP Cc1cc(C)cc([C@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422891481 1037867629 /nfs/dbraw/zinc/86/76/29/1037867629.db2.gz VKPCHDXDGVPKFG-UCNVEGJOSA-N 2 0 336.479 4.210 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1ccccc1C(F)(F)F ZINC000422927718 1037871034 /nfs/dbraw/zinc/87/10/34/1037871034.db2.gz ZWVDKYXTLJJKSZ-DGCLKSJQSA-N 2 0 337.389 4.279 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H](c1ccc(Br)cc1)C1CCC1 ZINC000422935787 1037876625 /nfs/dbraw/zinc/87/66/25/1037876625.db2.gz DRBVASUXYUDQRJ-WBMJQRKESA-N 2 0 325.294 4.007 20 0 EIADRP Cc1sc(C[NH2+][C@@H](C)CCCC[NH3+])nc1-c1ccc(Cl)cc1 ZINC000422945668 1037885611 /nfs/dbraw/zinc/88/56/11/1037885611.db2.gz NPSVOSAZGMRQJJ-LBPRGKRZSA-N 2 0 337.920 4.379 20 0 EIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+][C@H](C)CCCC[NH3+])s2)cc1 ZINC000422984512 1037894677 /nfs/dbraw/zinc/89/46/77/1037894677.db2.gz YDCROLUKSJPNEH-ZIAGYGMSSA-N 2 0 347.528 4.295 20 0 EIADRP CC[C@@H](CSc1ccccc1)[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000423007456 1037899757 /nfs/dbraw/zinc/89/97/57/1037899757.db2.gz XSKZFQIKNBYPPR-HOCLYGCPSA-N 2 0 329.513 4.070 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c2ccccc21 ZINC000423004710 1037900037 /nfs/dbraw/zinc/90/00/37/1037900037.db2.gz PUOPICHTKZLICW-UXYIHQQYSA-N 2 0 348.490 4.471 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c2ccccc21 ZINC000423004709 1037900209 /nfs/dbraw/zinc/90/02/09/1037900209.db2.gz PUOPICHTKZLICW-SBQCITLYSA-N 2 0 348.490 4.471 20 0 EIADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]CCc1csc(-c2ccc(Cl)cc2)n1 ZINC000423017592 1037903570 /nfs/dbraw/zinc/90/35/70/1037903570.db2.gz WSUGXIOHQFMPCH-SJORKVTESA-N 2 0 349.931 4.256 20 0 EIADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]CCc1csc(-c2ccc(Cl)cc2)n1 ZINC000423012771 1037904269 /nfs/dbraw/zinc/90/42/69/1037904269.db2.gz LJDMIZUHWJYEFN-PBHICJAKSA-N 2 0 349.931 4.113 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H]1CCCOc2cc(Cl)ccc21 ZINC000423019842 1037906954 /nfs/dbraw/zinc/90/69/54/1037906954.db2.gz XKHGJYMLOKTAIR-ACJLOTCBSA-N 2 0 345.874 4.067 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H]1CCCOc2cc(Cl)ccc21 ZINC000423019843 1037908212 /nfs/dbraw/zinc/90/82/12/1037908212.db2.gz XKHGJYMLOKTAIR-FZKQIMNGSA-N 2 0 345.874 4.067 20 0 EIADRP FC(F)(F)[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)c1ccccc1 ZINC000423067191 1037929379 /nfs/dbraw/zinc/92/93/79/1037929379.db2.gz YVEWCODUYFUTFN-BSDSXHPESA-N 2 0 340.433 4.233 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+]CC1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000423072923 1037932298 /nfs/dbraw/zinc/93/22/98/1037932298.db2.gz QPMKRZYKCQCZDE-LLVKDONJSA-N 2 0 334.813 4.107 20 0 EIADRP COCCC[C@H](C[NH2+][C@@H]1CCCCC[C@H]1[NH3+])c1ccc(Cl)cc1 ZINC000423100147 1037956576 /nfs/dbraw/zinc/95/65/76/1037956576.db2.gz GJSCORDWAFUPEZ-BHIYHBOVSA-N 2 0 338.923 4.100 20 0 EIADRP Fc1ccc(C2CC([NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)C2)cc1Cl ZINC000423099244 1037958533 /nfs/dbraw/zinc/95/85/33/1037958533.db2.gz LUFAADCATFSCJY-KEDMZRARSA-N 2 0 336.882 4.235 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000423097860 1037959834 /nfs/dbraw/zinc/95/98/34/1037959834.db2.gz BOOQVNWPYWWHFK-COXVUDFISA-N 2 0 328.422 4.449 20 0 EIADRP Fc1ccc2[nH]cc(CCC[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)c2c1 ZINC000423116361 1037964119 /nfs/dbraw/zinc/96/41/19/1037964119.db2.gz POQGUTCSGFOAIY-MISYRCLQSA-N 2 0 343.490 4.140 20 0 EIADRP FC(F)(F)[C@H](CC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1)c1ccccc1 ZINC000423127234 1037973720 /nfs/dbraw/zinc/97/37/20/1037973720.db2.gz BRDAWSJFZUXFKW-BSDSXHPESA-N 2 0 340.433 4.233 20 0 EIADRP COCC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000423108907 1037989572 /nfs/dbraw/zinc/98/95/72/1037989572.db2.gz RSJILAGEIAZZGV-BLLLJJGKSA-N 2 0 333.303 4.178 20 0 EIADRP FC(F)(F)c1cccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C2CCC2)c1 ZINC000423112852 1037994071 /nfs/dbraw/zinc/99/40/71/1037994071.db2.gz YDXDKDNRAJAXPK-WFFDWFOESA-N 2 0 338.417 4.419 20 0 EIADRP FC(F)(F)c1cccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C2CCC2)c1 ZINC000423112851 1037996005 /nfs/dbraw/zinc/99/60/05/1037996005.db2.gz YDXDKDNRAJAXPK-UJJTZGENSA-N 2 0 338.417 4.419 20 0 EIADRP [NH3+][C@H]1C[C@H]([NH+]2CCC(Cc3cccc(F)c3F)CC2)c2ccccc21 ZINC000423153204 1038005862 /nfs/dbraw/zinc/00/58/62/1038005862.db2.gz GXSWJBUFXHHVMU-PMACEKPBSA-N 2 0 342.433 4.364 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000423209381 1038037697 /nfs/dbraw/zinc/03/76/97/1038037697.db2.gz FDBNHNNOPOVTAX-YCPHGPKFSA-N 2 0 328.422 4.004 20 0 EIADRP CCCOc1ccc([C@@H](C)[NH2+]C2CCC([NH3+])CC2)c(OCCC)c1 ZINC000423208118 1038038043 /nfs/dbraw/zinc/03/80/43/1038038043.db2.gz DAWXOSXGRAZZOP-KLAILNCOSA-N 2 0 334.504 4.185 20 0 EIADRP C[NH2+]CCC[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423200039 1038050087 /nfs/dbraw/zinc/05/00/87/1038050087.db2.gz LMPBIFXHFLRUJG-CQSZACIVSA-N 2 0 335.904 4.040 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccc2ccccc2c1OC(F)F ZINC000423222150 1038067279 /nfs/dbraw/zinc/06/72/79/1038067279.db2.gz ZWSHUUMUWYKKDN-GRTSSRMGSA-N 2 0 334.410 4.362 20 0 EIADRP Fc1ccc([C@@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2cnc3ccccc3c2)cc1 ZINC000423245460 1038077715 /nfs/dbraw/zinc/07/77/15/1038077715.db2.gz IYGYTGWBKMKOGE-OPAMFIHVSA-N 2 0 349.453 4.053 20 0 EIADRP COc1ccc([C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2ccccc2Cl)cc1 ZINC000423250943 1038079603 /nfs/dbraw/zinc/07/96/03/1038079603.db2.gz RFVGDDFBRUHGGO-YWZLYKJASA-N 2 0 344.886 4.027 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC[C@H]2CC[NH2+]C2)CCC3)cc1 ZINC000423253828 1038084517 /nfs/dbraw/zinc/08/45/17/1038084517.db2.gz WLMCILFWXQIBMY-WBVHZDCISA-N 2 0 341.524 4.085 20 0 EIADRP CSC[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1 ZINC000423256462 1038084626 /nfs/dbraw/zinc/08/46/26/1038084626.db2.gz FFNYWDAPQLLFTI-BBRMVZONSA-N 2 0 346.462 4.089 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)cc1 ZINC000423259636 1038088619 /nfs/dbraw/zinc/08/86/19/1038088619.db2.gz OQBMLFQVXIELIM-QZTJIDSGSA-N 2 0 338.495 4.403 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423282388 1038089758 /nfs/dbraw/zinc/08/97/58/1038089758.db2.gz WMDHTQXCOISYEY-ZBFHGGJFSA-N 2 0 328.422 4.006 20 0 EIADRP COc1cc(OC)c([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1Cl ZINC000423288955 1038090554 /nfs/dbraw/zinc/09/05/54/1038090554.db2.gz ACVUHPDJRKGZCL-QWHCGFSZSA-N 2 0 348.874 4.228 20 0 EIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]CCC1CC[NH+](C)CC1)CCCO2 ZINC000489513853 1038093579 /nfs/dbraw/zinc/09/35/79/1038093579.db2.gz HGBRUMAYRQFQLK-HXUWFJFHSA-N 2 0 330.516 4.345 20 0 EIADRP [NH3+]CCCC[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423317214 1038111577 /nfs/dbraw/zinc/11/15/77/1038111577.db2.gz AMFDQUFXOJFAEW-CQSZACIVSA-N 2 0 335.904 4.169 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccccc1Br ZINC000423293889 1038118313 /nfs/dbraw/zinc/11/83/13/1038118313.db2.gz SKHXCXRRIQLCGV-QWHCGFSZSA-N 2 0 333.273 4.320 20 0 EIADRP COc1cc([C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)ccc1SC ZINC000423295900 1038119036 /nfs/dbraw/zinc/11/90/36/1038119036.db2.gz XSQAJXOUXNRECJ-KBPBESRZSA-N 2 0 330.497 4.288 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCc3ccc(Br)cc32)cc1 ZINC000423294180 1038120321 /nfs/dbraw/zinc/12/03/21/1038120321.db2.gz TXPDVMMRUVWUKO-SGTLLEGYSA-N 2 0 345.284 4.246 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)CCCS2 ZINC000423295683 1038122893 /nfs/dbraw/zinc/12/28/93/1038122893.db2.gz XEICSOYVSQAHKA-IFXJQAMLSA-N 2 0 342.508 4.432 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccccc2Br)cc1 ZINC000423293888 1038123165 /nfs/dbraw/zinc/12/31/65/1038123165.db2.gz SKHXCXRRIQLCGV-OLZOCXBDSA-N 2 0 333.273 4.320 20 0 EIADRP C[C@@H](C[NH3+])C[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423304356 1038128376 /nfs/dbraw/zinc/12/83/76/1038128376.db2.gz YKPFDRSDZJPIPR-SMDDNHRTSA-N 2 0 335.904 4.025 20 0 EIADRP Fc1cccc([C@@H]([NH2+]CC2=CC[NH2+]CC2)c2cccc(Cl)c2)c1 ZINC000423328918 1038142962 /nfs/dbraw/zinc/14/29/62/1038142962.db2.gz AZLHBDCSSVQAST-IBGZPJMESA-N 2 0 330.834 4.078 20 0 EIADRP [NH3+][C@@H](C[NH2+]C1CCC(c2cccc(C(F)(F)F)c2)CC1)C1CC1 ZINC000423335283 1038151783 /nfs/dbraw/zinc/15/17/83/1038151783.db2.gz XBLWGIMKXQOAIO-SEFLRBGSSA-N 2 0 326.406 4.059 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(F)c(Br)c1 ZINC000423363616 1038175974 /nfs/dbraw/zinc/17/59/74/1038175974.db2.gz USAWIJCIVIHUFP-LLVKDONJSA-N 2 0 349.247 4.042 20 0 EIADRP CC[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(Br)cc1Cl ZINC000423362776 1038177373 /nfs/dbraw/zinc/17/73/73/1038177373.db2.gz YEMHKGPMUGSUES-HNNXBMFYSA-N 2 0 343.696 4.063 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[NH2+][C@@H](C)C2)CCC3)cc1 ZINC000423379264 1038190323 /nfs/dbraw/zinc/19/03/23/1038190323.db2.gz MWODHEHMDOJCOR-USXIJHARSA-N 2 0 341.524 4.226 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423386676 1038197287 /nfs/dbraw/zinc/19/72/87/1038197287.db2.gz MIQFMTLCKLSWMP-OAQYLSRUSA-N 2 0 336.479 4.417 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(Br)ccc1F ZINC000423399799 1038205191 /nfs/dbraw/zinc/20/51/91/1038205191.db2.gz VDVHKPOGYRFJBW-LLVKDONJSA-N 2 0 349.247 4.042 20 0 EIADRP COc1ccc2oc([C@@H](C)[NH2+]Cc3ccc4c(c3)C[NH2+]C4)c(C)c2c1 ZINC000423375002 1038206806 /nfs/dbraw/zinc/20/68/06/1038206806.db2.gz INYNVHNHEJLWQB-CQSZACIVSA-N 2 0 336.435 4.204 20 0 EIADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H](Cc1ccccc1Cl)c1ccsc1 ZINC000423407935 1038219698 /nfs/dbraw/zinc/21/96/98/1038219698.db2.gz WPXZFXUVTLLIEK-BVGQSLNGSA-N 2 0 334.916 4.273 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)[C@@H](C)c1nc2ccccc2s1 ZINC000423417238 1038221250 /nfs/dbraw/zinc/22/12/50/1038221250.db2.gz FFEQNABUUIITAP-KLHDSHLOSA-N 2 0 331.529 4.143 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1cc2cc(Br)ccc2o1 ZINC000423442018 1038225391 /nfs/dbraw/zinc/22/53/91/1038225391.db2.gz UQYXWHNRLVBYPL-VXGBXAGGSA-N 2 0 339.277 4.363 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000423437795 1038236183 /nfs/dbraw/zinc/23/61/83/1038236183.db2.gz QRZLOXWQDVLBFW-DNVCBOLYSA-N 2 0 331.891 4.126 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@H](c1ccc(Br)cc1Cl)C1CC1 ZINC000423455317 1038239066 /nfs/dbraw/zinc/23/90/66/1038239066.db2.gz MKKKAGIQWZEMPD-BONVTDFDSA-N 2 0 345.712 4.271 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)C1 ZINC000423460916 1038240083 /nfs/dbraw/zinc/24/00/83/1038240083.db2.gz BTOOQXJYPRKEAF-MJEQTWJJSA-N 2 0 342.405 4.143 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000423459227 1038240323 /nfs/dbraw/zinc/24/03/23/1038240323.db2.gz LAVJOJSKAIMMGH-JDFRZJQESA-N 2 0 347.503 4.426 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)C1 ZINC000423460920 1038240371 /nfs/dbraw/zinc/24/03/71/1038240371.db2.gz BTOOQXJYPRKEAF-XGWLTEMNSA-N 2 0 342.405 4.143 20 0 EIADRP Cc1c([C@H](C)[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)cnn1-c1cccc(Cl)c1 ZINC000423462232 1038242132 /nfs/dbraw/zinc/24/21/32/1038242132.db2.gz DGKSLSKLYSFBCQ-YSVLISHTSA-N 2 0 346.906 4.002 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000423465705 1038242362 /nfs/dbraw/zinc/24/23/62/1038242362.db2.gz WTQFSMFAIBIOAD-IUODEOHRSA-N 2 0 333.476 4.044 20 0 EIADRP COc1ccc([C@H]([NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)c2ccc(F)cc2)cc1 ZINC000423465919 1038242646 /nfs/dbraw/zinc/24/26/46/1038242646.db2.gz ICDBOCSRTQANMA-QFIXIFRTSA-N 2 0 342.458 4.031 20 0 EIADRP c1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC[C@H]2CCC[NH2+]2)CCC3)cc1 ZINC000423467183 1038244345 /nfs/dbraw/zinc/24/43/45/1038244345.db2.gz BGMGZQPPNOUEBR-SJORKVTESA-N 2 0 341.524 4.309 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1cc(Cl)ccc1OC(F)F ZINC000423472788 1038246242 /nfs/dbraw/zinc/24/62/42/1038246242.db2.gz NHHJCJCIKPHKPY-DMDPSCGWSA-N 2 0 332.822 4.110 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccsc1 ZINC000423474381 1038247853 /nfs/dbraw/zinc/24/78/53/1038247853.db2.gz OSJGAYVXBHLANC-QXAKKESOSA-N 2 0 332.488 4.321 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1cccc(Br)c1 ZINC000423454253 1038255232 /nfs/dbraw/zinc/25/52/32/1038255232.db2.gz BZCMADQJCLKPBP-MAZHCROVSA-N 2 0 325.294 4.007 20 0 EIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccccc1OC(F)F ZINC000423497346 1038255341 /nfs/dbraw/zinc/25/53/41/1038255341.db2.gz GQSRXIZLNHLLKX-PBHICJAKSA-N 2 0 334.410 4.419 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CC[C@H]([NH2+]CCC[C@H]3CCC[NH2+]3)C2)cc1 ZINC000423487919 1038259373 /nfs/dbraw/zinc/25/93/73/1038259373.db2.gz UUERBYIQAJNGKH-NXHRZFHOSA-N 2 0 340.433 4.463 20 0 EIADRP Brc1ccc([C@@H]([NH2+]CCC[C@H]2CCC[NH2+]2)C2CC2)s1 ZINC000423486858 1038259841 /nfs/dbraw/zinc/25/98/41/1038259841.db2.gz SWDBUKNNFKASCD-DOMZBBRYSA-N 2 0 343.334 4.084 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423495636 1038263545 /nfs/dbraw/zinc/26/35/45/1038263545.db2.gz CFVLINSCAOBYAL-LLGFUMIMSA-N 2 0 326.484 4.257 20 0 EIADRP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000423494486 1038264988 /nfs/dbraw/zinc/26/49/88/1038264988.db2.gz SFTBPWLBOASJFI-SXLOBPIMSA-N 2 0 330.516 4.070 20 0 EIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC[NH2+]C2CC2)CCC3)cc1 ZINC000423524664 1038277898 /nfs/dbraw/zinc/27/78/98/1038277898.db2.gz JRZBXMJGGFKAOK-MRXNPFEDSA-N 2 0 345.487 4.058 20 0 EIADRP Cc1cc(N[C@H]2CCn3ccnc3C2)c2cc(Cl)cc(C)c2[nH+]1 ZINC000489954065 1038282528 /nfs/dbraw/zinc/28/25/28/1038282528.db2.gz PIGMIBCPWVPISM-AWEZNQCLSA-N 2 0 326.831 4.128 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]CCC2=CC[NH2+]CC2)cc1 ZINC000423559802 1038283874 /nfs/dbraw/zinc/28/38/74/1038283874.db2.gz PEMPLOGNIYIEIL-QGZVFWFLSA-N 2 0 336.479 4.323 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423536182 1038286348 /nfs/dbraw/zinc/28/63/48/1038286348.db2.gz GZHDOBUFXBEKOV-INIZCTEOSA-N 2 0 325.500 4.124 20 0 EIADRP Clc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@@H]3C[NH2+]C[C@H]3C1)CCCS2 ZINC000423539067 1038286537 /nfs/dbraw/zinc/28/65/37/1038286537.db2.gz HRDQISNFXJKPPG-GKLJAUDBSA-N 2 0 336.932 4.245 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423538346 1038287144 /nfs/dbraw/zinc/28/71/44/1038287144.db2.gz GDYYBKPREZUORG-NYCLONFESA-N 2 0 340.433 4.004 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423544573 1038289212 /nfs/dbraw/zinc/28/92/12/1038289212.db2.gz OLPDIWZYMLHIRJ-VSZNYVQBSA-N 2 0 339.527 4.202 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000423547987 1038293050 /nfs/dbraw/zinc/29/30/50/1038293050.db2.gz QRKSUKSPDWOVEH-YMYKFTITSA-N 2 0 342.527 4.088 20 0 EIADRP C[C@@H]1C[C@@H](C[N@@H+]2CCC[C@H]2c2ccc(Br)s2)CC[NH2+]1 ZINC000414760289 1038349254 /nfs/dbraw/zinc/34/92/54/1038349254.db2.gz QHDJGKJAWFSZHV-AGIUHOORSA-N 2 0 343.334 4.036 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)C1 ZINC000594784436 1038399757 /nfs/dbraw/zinc/39/97/57/1038399757.db2.gz KPNCJRFUUQICNU-FQEVSTJZSA-N 2 0 347.506 4.121 20 0 EIADRP C[C@@H](C[NH2+][C@H](Cc1ccncc1)c1cccs1)C[NH+]1CCCCC1 ZINC000424274430 1038780480 /nfs/dbraw/zinc/78/04/80/1038780480.db2.gz YWRZGXKYYUYJQQ-PKOBYXMFSA-N 2 0 343.540 4.139 20 0 EIADRP C[NH+](C)CC1(C[NH2+][C@H](Cc2ccncc2)c2cccs2)CCCC1 ZINC000424282534 1038791126 /nfs/dbraw/zinc/79/11/26/1038791126.db2.gz QGTKWHWOJGGDNA-GOSISDBHSA-N 2 0 343.540 4.139 20 0 EIADRP C[C@H](CC[NH2+][C@H](Cc1ccncc1)c1cccs1)[NH+]1CCCCC1 ZINC000424279988 1038792698 /nfs/dbraw/zinc/79/26/98/1038792698.db2.gz LDFMJCRJYHBWOY-IEBWSBKVSA-N 2 0 343.540 4.281 20 0 EIADRP FC1(F)CCCC[C@@H]1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC001168317149 1038824693 /nfs/dbraw/zinc/82/46/93/1038824693.db2.gz JMQLVUCBIUXYDF-GOSISDBHSA-N 2 0 328.491 4.400 20 0 EIADRP CCc1noc(C)c1C[NH+]1CCC(CC[N@@H+](CC)CC(C)C)CC1 ZINC000539099139 1038836905 /nfs/dbraw/zinc/83/69/05/1038836905.db2.gz XPVJDBUCGKBKDU-UHFFFAOYSA-N 2 0 335.536 4.125 20 0 EIADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000504906338 1038845644 /nfs/dbraw/zinc/84/56/44/1038845644.db2.gz WVCDQJSVIWMDGP-LXZJYRNTSA-N 2 0 330.516 4.022 20 0 EIADRP CC(C)[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000539203883 1038878674 /nfs/dbraw/zinc/87/86/74/1038878674.db2.gz VREDWGJDOCFXQV-KRWDZBQOSA-N 2 0 328.422 4.334 20 0 EIADRP CC(C)[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc2[nH]c(=O)oc2c1 ZINC000539214310 1038885338 /nfs/dbraw/zinc/88/53/38/1038885338.db2.gz HOMNIUOWRUXXNS-SFHVURJKSA-N 2 0 345.487 4.083 20 0 EIADRP C[C@@H](CCc1ccc(O)cc1)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000119537462 1038933464 /nfs/dbraw/zinc/93/34/64/1038933464.db2.gz JGQFODPFQVWFRU-KRWDZBQOSA-N 2 0 330.516 4.100 20 0 EIADRP CC[N@H+](Cc1ccc(Br)cc1)C1CCC([NH+](C)C)CC1 ZINC001168328168 1038936447 /nfs/dbraw/zinc/93/64/47/1038936447.db2.gz YFWVUSAOSJMFQH-UHFFFAOYSA-N 2 0 339.321 4.144 20 0 EIADRP C[NH+](C)C1CCC([NH+]2CCC(n3ccc4ccccc43)CC2)CC1 ZINC001168328155 1038937695 /nfs/dbraw/zinc/93/76/95/1038937695.db2.gz XNQLZBVMLLSEGP-UHFFFAOYSA-N 2 0 325.500 4.151 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCSCc1ccc(Cl)cc1Cl ZINC000539296777 1038948420 /nfs/dbraw/zinc/94/84/20/1038948420.db2.gz LCWGAQDDCUDUBA-LRDDRELGSA-N 2 0 347.355 4.156 20 0 EIADRP C[C@@H](c1cccc(Br)c1)[N@H+](C)C1CCC([NH+](C)C)CC1 ZINC001168328747 1038949426 /nfs/dbraw/zinc/94/94/26/1038949426.db2.gz CAXJOUQSNDZUNR-IGEOTXOUSA-N 2 0 339.321 4.315 20 0 EIADRP Cc1ccc2c(c1)c(C1CC[NH2+]CC1)cn2C1CCC([NH+](C)C)CC1 ZINC001168329169 1038962700 /nfs/dbraw/zinc/96/27/00/1038962700.db2.gz OCROPZHQVTVFPX-UHFFFAOYSA-N 2 0 339.527 4.462 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2ccc(Br)cc2)C1 ZINC000481027713 1038967906 /nfs/dbraw/zinc/96/79/06/1038967906.db2.gz WRTCKLVHDILORN-YOEHRIQHSA-N 2 0 339.321 4.222 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCC[C@@H]2c2ccc(OC)c(F)c2)C1 ZINC000481039925 1038989596 /nfs/dbraw/zinc/98/95/96/1038989596.db2.gz QINATYYIUFKGPW-POAQFYNOSA-N 2 0 348.506 4.182 20 0 EIADRP CC[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cc(F)ccc1F ZINC000089215406 1039025106 /nfs/dbraw/zinc/02/51/06/1039025106.db2.gz UHCHCLNILKXGDP-HXUWFJFHSA-N 2 0 345.437 4.317 20 0 EIADRP C[NH+](C)C1CCC([N@H+](C)CCc2ccc(C(F)(F)F)cc2)CC1 ZINC001168333939 1039035673 /nfs/dbraw/zinc/03/56/73/1039035673.db2.gz GOSVNMFFNKRRFZ-UHFFFAOYSA-N 2 0 328.422 4.053 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)c(C)c1OC ZINC000552062772 1039082236 /nfs/dbraw/zinc/08/22/36/1039082236.db2.gz GJYXPSKPJAIPNQ-ROUUACIJSA-N 2 0 348.531 4.031 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CC2(c3cccc(Cl)c3F)CCCC2)CC[N@@H+]1C ZINC000477864124 1039141826 /nfs/dbraw/zinc/14/18/26/1039141826.db2.gz ZUZJOOCGZVMZSM-HUUCEWRRSA-N 2 0 338.898 4.363 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414822944 1039183219 /nfs/dbraw/zinc/18/32/19/1039183219.db2.gz NMQCTTKSLYKUFK-IIAWOOMASA-N 2 0 328.422 4.004 20 0 EIADRP C[C@@H](NCC(C)(C)C[NH+]1CCCC1)c1ccc(Br)s1 ZINC000477931941 1039219806 /nfs/dbraw/zinc/21/98/06/1039219806.db2.gz DKVLTWPILGXHMS-GFCCVEGCSA-N 2 0 345.350 4.283 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CCC[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000414829706 1039221664 /nfs/dbraw/zinc/22/16/64/1039221664.db2.gz NZMDDXRWOHFIGE-MPBYHJMHSA-N 2 0 338.417 4.214 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](CC)c2cccc(C)c2)[C@@H](C)C1 ZINC000552244526 1039310335 /nfs/dbraw/zinc/31/03/35/1039310335.db2.gz DEYJCPYKLAQTFD-JBACZVJFSA-N 2 0 332.532 4.173 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCCOC2CCCC2)CC1 ZINC000552247649 1039314471 /nfs/dbraw/zinc/31/44/71/1039314471.db2.gz WILGMMJIYIUMTI-UHFFFAOYSA-N 2 0 344.543 4.369 20 0 EIADRP Cc1cc(CC[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)cc(C)c1O ZINC000470132794 1039421472 /nfs/dbraw/zinc/42/14/72/1039421472.db2.gz LPAKSRDOOMWUCN-IERDGZPVSA-N 2 0 344.543 4.184 20 0 EIADRP Cc1ccnc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)c1 ZINC000514087938 1039587649 /nfs/dbraw/zinc/58/76/49/1039587649.db2.gz JHRCZCHKILILQC-RTBURBONSA-N 2 0 337.511 4.473 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000514086669 1039590182 /nfs/dbraw/zinc/59/01/82/1039590182.db2.gz CASBSTXSMUXOGX-LRVUVFPRSA-N 2 0 330.394 4.109 20 0 EIADRP CCc1ccc([C@H](CNC2CC[NH+](C(C)C)CC2)[NH+](CC)CC)cc1 ZINC000550848332 1039601290 /nfs/dbraw/zinc/60/12/90/1039601290.db2.gz RFLVUOLVBNJYGH-QFIPXVFZSA-N 2 0 345.575 4.094 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cccc(Cl)c1 ZINC000122348505 1039653824 /nfs/dbraw/zinc/65/38/24/1039653824.db2.gz FOQCJLZFOUZXRQ-OAHLLOKOSA-N 2 0 332.875 4.131 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc2c(s1)CCC2 ZINC000122346297 1039655047 /nfs/dbraw/zinc/65/50/47/1039655047.db2.gz BYQBRTYPFZJKQA-HNNXBMFYSA-N 2 0 344.524 4.028 20 0 EIADRP CC[NH+]1CCC(Nc2cc[nH+]c3cc(OC(F)(F)F)ccc23)CC1 ZINC000899874405 1039750844 /nfs/dbraw/zinc/75/08/44/1039750844.db2.gz BJARPABAXYETLN-UHFFFAOYSA-N 2 0 339.361 4.030 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1cccc(F)c1 ZINC000481732951 1039796882 /nfs/dbraw/zinc/79/68/82/1039796882.db2.gz YFURVDJAAXHAEU-HNNXBMFYSA-N 2 0 332.488 4.450 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1cccc(F)c1 ZINC000481732953 1039797132 /nfs/dbraw/zinc/79/71/32/1039797132.db2.gz YFURVDJAAXHAEU-OAHLLOKOSA-N 2 0 332.488 4.450 20 0 EIADRP CCOC1(C)CC[NH+](CC(C)(C)C[N@H+](C)Cc2ccccc2)CC1 ZINC000430110105 1039848894 /nfs/dbraw/zinc/84/88/94/1039848894.db2.gz XFGMNUQONCEPOM-UHFFFAOYSA-N 2 0 332.532 4.036 20 0 EIADRP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666954199 1039860434 /nfs/dbraw/zinc/86/04/34/1039860434.db2.gz RXQGTVLRLYFYAN-ZBFHGGJFSA-N 2 0 327.299 4.046 20 0 EIADRP c1c2ccccc2sc1C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000537692194 1039910047 /nfs/dbraw/zinc/91/00/47/1039910047.db2.gz GKCMHQRFDBPXSI-APWZRJJASA-N 2 0 326.509 4.350 20 0 EIADRP CC(C)=CCC[C@H](C)CC[NH+]1CCN(CC[NH+]2[C@@H](C)CC[C@@H]2C)CC1 ZINC000482141709 1040050698 /nfs/dbraw/zinc/05/06/98/1040050698.db2.gz KXFSMXPDTQZBGV-FKBYEOEOSA-N 2 0 349.607 4.249 20 0 EIADRP CC(C)=CCC[C@H](C)CC[NH+]1CCN(C2CC[NH+](C(C)C)CC2)CC1 ZINC000482174799 1040058186 /nfs/dbraw/zinc/05/81/86/1040058186.db2.gz ZGTKZWBBUBVRQU-NRFANRHFSA-N 2 0 349.607 4.249 20 0 EIADRP CC[NH2+]CCCN[C@H](c1ccc(F)cc1)c1cnc2ccccc2c1 ZINC000643498970 1040060115 /nfs/dbraw/zinc/06/01/15/1040060115.db2.gz DGARVSXTCOKVLI-OAQYLSRUSA-N 2 0 337.442 4.053 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)[C@@H](C)C1 ZINC000551238872 1040084144 /nfs/dbraw/zinc/08/41/44/1040084144.db2.gz FENIDPXKWAYUGS-XIRDDKMYSA-N 2 0 328.422 4.043 20 0 EIADRP CC(C)=CCC[C@H](C)CC[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000482251116 1040110451 /nfs/dbraw/zinc/11/04/51/1040110451.db2.gz BJAFQIAWIHJSHC-NRFANRHFSA-N 2 0 349.607 4.109 20 0 EIADRP CC(C)(C[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(F)cc1 ZINC000482443619 1040252352 /nfs/dbraw/zinc/25/23/52/1040252352.db2.gz GRJRCCVNOMECOJ-UHFFFAOYSA-N 2 0 332.507 4.490 20 0 EIADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000482456271 1040254898 /nfs/dbraw/zinc/25/48/98/1040254898.db2.gz ZGWQUNFJGWFIJH-QMHWCDLVSA-N 2 0 334.507 4.074 20 0 EIADRP Cc1ncsc1-c1ccc(C[N@H+]2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000668063913 1040310275 /nfs/dbraw/zinc/31/02/75/1040310275.db2.gz ZLESVLDOVAOPIJ-SFHVURJKSA-N 2 0 329.513 4.035 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@H]1CCc2c1cc(Cl)cc2Br ZINC000535508880 1040312325 /nfs/dbraw/zinc/31/23/25/1040312325.db2.gz WMVRCQHXZRAARI-HNNXBMFYSA-N 2 0 345.712 4.021 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCC3(CCCC3)O2)CCN1Cc1ccccc1 ZINC000379655500 1040316811 /nfs/dbraw/zinc/31/68/11/1040316811.db2.gz MBXNYHLZRZDSLD-HMXCVIKNSA-N 2 0 342.527 4.121 20 0 EIADRP C[C@H](C[N@@H+]1CCC[C@@H]2C[NH+](C)CC[C@@H]21)c1ccc(C(F)(F)F)cc1 ZINC000514890642 1040329747 /nfs/dbraw/zinc/32/97/47/1040329747.db2.gz KVYNOJCNKJXPKN-KYJSFNMBSA-N 2 0 340.433 4.225 20 0 EIADRP COc1ccc2oc(C[NH2+]CC3CC[NH+](CCC(C)C)CC3)cc2c1 ZINC000482565295 1040358643 /nfs/dbraw/zinc/35/86/43/1040358643.db2.gz VFRYRRABXBAOSG-UHFFFAOYSA-N 2 0 344.499 4.289 20 0 EIADRP c1ccc(CSCCC[NH+]2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000535583448 1040384923 /nfs/dbraw/zinc/38/49/23/1040384923.db2.gz SOVODWIIOKAOFR-UHFFFAOYSA-N 2 0 332.557 4.118 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cccc(Br)c2C)C[C@H]1C ZINC000535585293 1040386542 /nfs/dbraw/zinc/38/65/42/1040386542.db2.gz LMYGJAYGHLZJDU-CZUORRHYSA-N 2 0 339.321 4.062 20 0 EIADRP CCCCCOc1cc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)ccc1OC ZINC000666995330 1040403519 /nfs/dbraw/zinc/40/35/19/1040403519.db2.gz KGLSDPOMJRHNKK-SFHVURJKSA-N 2 0 346.515 4.029 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+]C/C(C)=C/c2ccccc2OC(F)F)C1 ZINC000515020055 1040420954 /nfs/dbraw/zinc/42/09/54/1040420954.db2.gz MSXKPCDSPVCMGH-RBFDBLARSA-N 2 0 338.442 4.013 20 0 EIADRP Fc1ccc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1-c1cccs1 ZINC000666998477 1040421651 /nfs/dbraw/zinc/42/16/51/1040421651.db2.gz WGKQASZHXFDKCD-HNNXBMFYSA-N 2 0 330.472 4.319 20 0 EIADRP CSC1(C[NH2+]Cc2ccc(-c3ccccc3)s2)CC[NH+](C)CC1 ZINC000515019960 1040436109 /nfs/dbraw/zinc/43/61/09/1040436109.db2.gz LZHXMQRLBIOXCM-UHFFFAOYSA-N 2 0 346.565 4.332 20 0 EIADRP Fc1cccc(-c2ccc(C[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)s2)c1 ZINC000666998149 1040438079 /nfs/dbraw/zinc/43/80/79/1040438079.db2.gz FHRZXLVRACXCSW-INIZCTEOSA-N 2 0 330.472 4.319 20 0 EIADRP c1ccc(COc2ccccc2CN[C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000666999578 1040440598 /nfs/dbraw/zinc/44/05/98/1040440598.db2.gz ZPLDODNPTQOHRN-HXUWFJFHSA-N 2 0 336.479 4.030 20 0 EIADRP CCc1nc(CN2CCC(C[NH2+]C3[C@H](C)CCC[C@H]3C)CC2)cs1 ZINC000482874301 1040532963 /nfs/dbraw/zinc/53/29/63/1040532963.db2.gz NQLNOQIZGVASGL-HZPDHXFCSA-N 2 0 349.588 4.332 20 0 EIADRP CCc1ccc([C@@H](C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)o1 ZINC000482881946 1040546020 /nfs/dbraw/zinc/54/60/20/1040546020.db2.gz FKBKFIPMVFZRIM-QGZVFWFLSA-N 2 0 342.483 4.167 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000482900169 1040566775 /nfs/dbraw/zinc/56/67/75/1040566775.db2.gz ZSZUDPRLLPYMHH-XLIONFOSSA-N 2 0 338.495 4.008 20 0 EIADRP c1csc([C@H]2c3ccsc3CC[N@H+]2CCC2CC[NH2+]CC2)c1 ZINC000479683155 1040567661 /nfs/dbraw/zinc/56/76/61/1040567661.db2.gz DTEZGISEFAUEHD-GOSISDBHSA-N 2 0 332.538 4.147 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000551788675 1040601153 /nfs/dbraw/zinc/60/11/53/1040601153.db2.gz DYZLQAPHTAIMRQ-IRXDYDNUSA-N 2 0 328.422 4.273 20 0 EIADRP C[C@H]([NH2+]CCSc1ccccc1)c1cccc(OCC[NH+](C)C)c1 ZINC000479875862 1040740648 /nfs/dbraw/zinc/74/06/48/1040740648.db2.gz MNCZPFLZGUIUCK-KRWDZBQOSA-N 2 0 344.524 4.070 20 0 EIADRP Cc1ccc(C[C@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)s1 ZINC000483309705 1040814521 /nfs/dbraw/zinc/81/45/21/1040814521.db2.gz UONVPHHMTDPIKQ-DOTOQJQBSA-N 2 0 346.540 4.279 20 0 EIADRP C[C@H](c1cccc(Br)c1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000483404595 1040838621 /nfs/dbraw/zinc/83/86/21/1040838621.db2.gz JNRBUVFOZYMOAQ-CQSZACIVSA-N 2 0 339.321 4.174 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1nc2c(s1)CCCC2 ZINC000537883088 1040872521 /nfs/dbraw/zinc/87/25/21/1040872521.db2.gz QQVZAXXVLDWKCE-IXDOHACOSA-N 2 0 349.588 4.431 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000483483452 1040872743 /nfs/dbraw/zinc/87/27/43/1040872743.db2.gz NNFKUGPRECHSNE-UKPHBRMFSA-N 2 0 326.406 4.183 20 0 EIADRP Cc1cc(-n2ccnc2)ccc1C[NH+]1CCC(c2ccc(O)cc2)CC1 ZINC000483541426 1040887547 /nfs/dbraw/zinc/88/75/47/1040887547.db2.gz GPUBBDICGWFEHK-UHFFFAOYSA-N 2 0 347.462 4.266 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1cncs1 ZINC000537941600 1040905111 /nfs/dbraw/zinc/90/51/11/1040905111.db2.gz XLEMBIUWVDPEBJ-XYJFISCASA-N 2 0 329.513 4.094 20 0 EIADRP Cc1ccc(O[C@H](C)C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000483619034 1040913681 /nfs/dbraw/zinc/91/36/81/1040913681.db2.gz FVGXYQXQAKOHLC-GOSISDBHSA-N 2 0 330.516 4.149 20 0 EIADRP C[C@@H]([NH2+]CC1C[C@H]2CC[C@@H](C1)S2)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000903160613 1040928771 /nfs/dbraw/zinc/92/87/71/1040928771.db2.gz RZMHVBILXVLOSN-HYCNCBECSA-N 2 0 344.568 4.161 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCC[C@H]([C@@H]3CCOC3)C2)cc1 ZINC000462791413 1040941605 /nfs/dbraw/zinc/94/16/05/1040941605.db2.gz PBIFTTZOTRKBHA-BHDDXSALSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)C1CC(F)(F)C1 ZINC000898519772 1040976012 /nfs/dbraw/zinc/97/60/12/1040976012.db2.gz RBKNZMMVEHXVCZ-NFBUACBFSA-N 2 0 348.481 4.311 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](C)Cc1cccs1)c1cccc(OCC[NH+](C)C)c1 ZINC000483748818 1040998893 /nfs/dbraw/zinc/99/88/93/1040998893.db2.gz WPWKFRSQHNKBTI-DLBZAZTESA-N 2 0 346.540 4.218 20 0 EIADRP Cc1cccc(O[C@@H](C)C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000483750992 1041000268 /nfs/dbraw/zinc/00/02/68/1041000268.db2.gz VBEKSKWYTHDRCB-SFHVURJKSA-N 2 0 330.516 4.149 20 0 EIADRP COCCC1(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)CCCCC1 ZINC000436277907 1041023160 /nfs/dbraw/zinc/02/31/60/1041023160.db2.gz ACYJIPRKIYXDJO-UHFFFAOYSA-N 2 0 344.543 4.359 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)C1 ZINC000538060499 1041030820 /nfs/dbraw/zinc/03/08/20/1041030820.db2.gz ZOMVNJIHEARLML-SJCJKPOMSA-N 2 0 327.299 4.376 20 0 EIADRP C(NC1CC[NH+](C2CCCCC2)CC1)[C@H]1CCC[N@@H+]1C1CCCCC1 ZINC000436299354 1041066358 /nfs/dbraw/zinc/06/63/58/1041066358.db2.gz JTPIIKIQTKGQJX-JOCHJYFZSA-N 2 0 347.591 4.170 20 0 EIADRP C[C@H]([NH2+]CC1(c2ccccc2)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000480212273 1041085472 /nfs/dbraw/zinc/08/54/72/1041085472.db2.gz GAKOQMVJPIHLCA-SFHVURJKSA-N 2 0 338.495 4.009 20 0 EIADRP CC[C@H]([NH2+]CC1(CC)CC[NH+](Cc2ccccc2)CC1)[C@@H]1CCOC1 ZINC000540143269 1041166049 /nfs/dbraw/zinc/16/60/49/1041166049.db2.gz OEAZXJIIGDBTEB-RTWAWAEBSA-N 2 0 344.543 4.084 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cc2cc(C)c(C)cc2o1 ZINC000484299169 1041203594 /nfs/dbraw/zinc/20/35/94/1041203594.db2.gz DSUOWGFDLAGAPL-AEFFLSMTSA-N 2 0 332.488 4.057 20 0 EIADRP Cc1ccc(SC2(C[NH2+][C@@H]3CC[N@@H+](C)C[C@@H]3C)CCCC2)cc1 ZINC000484308116 1041205609 /nfs/dbraw/zinc/20/56/09/1041205609.db2.gz LYLMDENCGWLWEA-PKOBYXMFSA-N 2 0 332.557 4.330 20 0 EIADRP c1ccc(C[C@@H]2CC[C@@H]([NH2+]CC3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000436401413 1041207661 /nfs/dbraw/zinc/20/76/61/1041207661.db2.gz PDVVMOACFIUGQX-FCHUYYIVSA-N 2 0 349.522 4.299 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC000484316754 1041208479 /nfs/dbraw/zinc/20/84/79/1041208479.db2.gz ZOTCIHCIKUFDQS-OCCSQVGLSA-N 2 0 333.303 4.001 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000540170830 1041214365 /nfs/dbraw/zinc/21/43/65/1041214365.db2.gz PQQFQAZQSDWNND-OTWHNJEPSA-N 2 0 348.531 4.015 20 0 EIADRP C[C@@H](CCCC(F)(F)F)[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000480332754 1041217195 /nfs/dbraw/zinc/21/71/95/1041217195.db2.gz VLTFOKWHZLJWNP-HNNXBMFYSA-N 2 0 328.422 4.493 20 0 EIADRP Cc1ncsc1-c1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000667663586 1041227471 /nfs/dbraw/zinc/22/74/71/1041227471.db2.gz QSOQHEPXODHSDN-GOSISDBHSA-N 2 0 341.524 4.036 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1cccc(O)c1 ZINC000194852051 1041232313 /nfs/dbraw/zinc/23/23/13/1041232313.db2.gz OSRRLZCQGGDWCB-ROUUACIJSA-N 2 0 338.495 4.475 20 0 EIADRP Cc1cc2c(cc1C)[C@@H](NC1CC[NH+](C(C)(C)C)CC1)CCCO2 ZINC000540189413 1041234589 /nfs/dbraw/zinc/23/45/89/1041234589.db2.gz CFYCMVYDIUZFBM-IBGZPJMESA-N 2 0 330.516 4.370 20 0 EIADRP Cc1ccc(C[C@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C2CC2)cc1 ZINC000484497317 1041275764 /nfs/dbraw/zinc/27/57/64/1041275764.db2.gz FUVIWCYVNDZLLV-QFIPXVFZSA-N 2 0 326.528 4.313 20 0 EIADRP C[C@H]1C[NH+](Cc2ccc(C[NH2+]C3CCCCCC3)cc2)C[C@H](C)O1 ZINC000642242392 1041296745 /nfs/dbraw/zinc/29/67/45/1041296745.db2.gz RGRYOAXLUTWIQB-ROUUACIJSA-N 2 0 330.516 4.108 20 0 EIADRP C[C@H]1C[C@H]([NH2+]Cc2cccc(OCC3CCCCC3)c2)CC[N@@H+]1C ZINC000538411211 1041329854 /nfs/dbraw/zinc/32/98/54/1041329854.db2.gz XUYZHNNVBKUPNU-FXAWDEMLSA-N 2 0 330.516 4.218 20 0 EIADRP C[N@H+]1CC=C(C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000538445500 1041350832 /nfs/dbraw/zinc/35/08/32/1041350832.db2.gz GYRACTDDELWKEB-UHFFFAOYSA-N 2 0 344.405 4.109 20 0 EIADRP COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(C[NH+](C)C)c2)cc1OC ZINC000924796837 1041394490 /nfs/dbraw/zinc/39/44/90/1041394490.db2.gz DIAWULFSVSFOLK-JKSUJKDBSA-N 2 0 342.483 4.177 20 0 EIADRP C[C@H]([NH2+]C1(c2ccc(F)cc2)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000538554213 1041417104 /nfs/dbraw/zinc/41/71/04/1041417104.db2.gz SACZNMBNKKMYJK-INIZCTEOSA-N 2 0 342.458 4.106 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2c(c1)COC2 ZINC000480612953 1041423349 /nfs/dbraw/zinc/42/33/49/1041423349.db2.gz RPJSHZXXKGXWNW-FGTMMUONSA-N 2 0 330.516 4.126 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc2c(c1)COC2 ZINC000480612957 1041423722 /nfs/dbraw/zinc/42/37/22/1041423722.db2.gz RPJSHZXXKGXWNW-KZNAEPCWSA-N 2 0 330.516 4.126 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904337676 1041430725 /nfs/dbraw/zinc/43/07/25/1041430725.db2.gz DQJXSNHXMJNNQU-INMHGKMJSA-N 2 0 329.513 4.157 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(OC(F)F)cc1 ZINC000480629483 1041432899 /nfs/dbraw/zinc/43/28/99/1041432899.db2.gz DVGRKGHDZNNMQG-CVEARBPZSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccccc1OC(F)F ZINC000480618628 1041435787 /nfs/dbraw/zinc/43/57/87/1041435787.db2.gz TZBGZKUIYRRMAZ-JKSUJKDBSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc(OC(F)F)cc1 ZINC000480642876 1041442484 /nfs/dbraw/zinc/44/24/84/1041442484.db2.gz NGWYLMOCFLRDQJ-MRXNPFEDSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(-n2cccn2)cc1 ZINC000480631815 1041445516 /nfs/dbraw/zinc/44/55/16/1041445516.db2.gz QXAXBFPIROSAGF-RTBURBONSA-N 2 0 340.515 4.178 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](CCCC2CCOCC2)CC1 ZINC000463284748 1041474175 /nfs/dbraw/zinc/47/41/75/1041474175.db2.gz WDOGCXQZLWLNJU-LJQANCHMSA-N 2 0 336.564 4.170 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc3cc(OC)ccc3c2)C[C@@H]1C ZINC000538718695 1041487357 /nfs/dbraw/zinc/48/73/57/1041487357.db2.gz IGLRUKDKEUFGHL-OXJNMPFZSA-N 2 0 326.484 4.153 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)[C@@H]1CCOC1 ZINC000480732592 1041493904 /nfs/dbraw/zinc/49/39/04/1041493904.db2.gz ZFZAYCFHVHXCDI-YHBROIRLSA-N 2 0 344.543 4.069 20 0 EIADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1 ZINC000480732566 1041496085 /nfs/dbraw/zinc/49/60/85/1041496085.db2.gz SOZSITHMHXIRFA-HZEGPAAWSA-N 2 0 336.564 4.213 20 0 EIADRP COc1ccc(C[N@@H+]2CC[C@@H](C[NH+](C)CC3CC3)C2)c2ccccc12 ZINC000538751050 1041526361 /nfs/dbraw/zinc/52/63/61/1041526361.db2.gz MZVVMGCGSREMSA-SFHVURJKSA-N 2 0 338.495 4.012 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H](Cc2ccc(Cl)cc2)c2ccccc2)CC1 ZINC000540606583 1041559917 /nfs/dbraw/zinc/55/99/17/1041559917.db2.gz LWOYDULCWRLGHY-OAQYLSRUSA-N 2 0 340.898 4.475 20 0 EIADRP C[C@@H](c1ccc(OC(F)F)cc1)N1CCC([NH+]2CCCCC2)CC1 ZINC000138355717 1041585869 /nfs/dbraw/zinc/58/58/69/1041585869.db2.gz AFAWXMWRSKOGEP-HNNXBMFYSA-N 2 0 338.442 4.299 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+]Cc2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000540941788 1041747084 /nfs/dbraw/zinc/74/70/84/1041747084.db2.gz FXYRHCFTSDSKIQ-UHFFFAOYSA-N 2 0 349.931 4.285 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@@H]1Oc2ccccc2[C@H]1C ZINC000540984010 1041766266 /nfs/dbraw/zinc/76/62/66/1041766266.db2.gz VEULDVVLLLTERW-HYFFOGBASA-N 2 0 342.527 4.326 20 0 EIADRP Cn1cncc1CCC[N@H+]1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000516875846 1041791907 /nfs/dbraw/zinc/79/19/07/1041791907.db2.gz YCCZXVRLAXMLSS-UHFFFAOYSA-N 2 0 349.400 4.161 20 0 EIADRP c1csc(CN2CCC[C@H](C[NH2+]Cc3ccc4[nH]ccc4c3)C2)c1 ZINC000517172218 1041889928 /nfs/dbraw/zinc/88/99/28/1041889928.db2.gz FOFYHLBUHGKCMH-QGZVFWFLSA-N 2 0 339.508 4.231 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000437782360 1041898888 /nfs/dbraw/zinc/89/88/88/1041898888.db2.gz YLPNXWHQAQHSFG-BHUNQDJPSA-N 2 0 326.406 4.201 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000437782368 1041898940 /nfs/dbraw/zinc/89/89/40/1041898940.db2.gz YLPNXWHQAQHSFG-GQGLESIBSA-N 2 0 326.406 4.201 20 0 EIADRP CC(C)c1ccc([C@H](C)[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000541350879 1041899605 /nfs/dbraw/zinc/89/96/05/1041899605.db2.gz HZXWSIYJEJPONY-IBGZPJMESA-N 2 0 344.543 4.448 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000437768968 1041899794 /nfs/dbraw/zinc/89/97/94/1041899794.db2.gz DKPOXJZQDPKUMW-QHGAOEGBSA-N 2 0 332.507 4.389 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H](c2ccco2)c2ccccc2)C1 ZINC000541549262 1042006957 /nfs/dbraw/zinc/00/69/57/1042006957.db2.gz PWOUUFIZYRXYQX-WIYYLYMNSA-N 2 0 326.484 4.471 20 0 EIADRP c1ccc(OCCCC[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC000438072193 1042031040 /nfs/dbraw/zinc/03/10/40/1042031040.db2.gz LGQJCXLEQKNSEC-UHFFFAOYSA-N 2 0 338.495 4.231 20 0 EIADRP C[C@@H](NCc1cccc(OC(C)(C)C)n1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541603188 1042039112 /nfs/dbraw/zinc/03/91/12/1042039112.db2.gz ORGLHWFQCXOBAK-SJORKVTESA-N 2 0 345.531 4.002 20 0 EIADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+]([C@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438094683 1042043236 /nfs/dbraw/zinc/04/32/36/1042043236.db2.gz OBVLVGAIPKHDMW-ILWGZMRPSA-N 2 0 326.528 4.161 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@H]3CCCc4cc(N)ccc43)CC2)C1 ZINC000414928569 1042162204 /nfs/dbraw/zinc/16/22/04/1042162204.db2.gz MVGZCRAKIBUJSF-CNDZOEFASA-N 2 0 341.543 4.279 20 0 EIADRP COc1cccc(CCC[NH2+][C@@H](C)c2cccc(-n3ccnc3)c2)c1 ZINC000542010437 1042230787 /nfs/dbraw/zinc/23/07/87/1042230787.db2.gz NTSAMVYCNWGDFY-KRWDZBQOSA-N 2 0 335.451 4.164 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCCOc2ccc(F)cc2)C1 ZINC000303603352 1042484127 /nfs/dbraw/zinc/48/41/27/1042484127.db2.gz NYEWPCQBRHPXPM-RBUKOAKNSA-N 2 0 348.506 4.181 20 0 EIADRP CC[N@H+](CCNc1cc[nH+]c2cc(F)ccc12)CCC(F)(F)F ZINC000491831249 1042504677 /nfs/dbraw/zinc/50/46/77/1042504677.db2.gz HZHHJNYFWFAVBE-UHFFFAOYSA-N 2 0 329.341 4.060 20 0 EIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]CC1CC[NH+](CCC(C)C)CC1 ZINC000491872512 1042510720 /nfs/dbraw/zinc/51/07/20/1042510720.db2.gz POJRRQJKEHLWNZ-RXVVDRJESA-N 2 0 332.532 4.110 20 0 EIADRP Brc1ccc([C@@H]([NH2+]CCC[NH+]2CCCC2)C2CC2)s1 ZINC000439148343 1042520442 /nfs/dbraw/zinc/52/04/42/1042520442.db2.gz XMMHTOBXEOADRN-HNNXBMFYSA-N 2 0 343.334 4.037 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2ccc(-c3ccccc3)cc2F)CC1 ZINC000426293108 1042525904 /nfs/dbraw/zinc/52/59/04/1042525904.db2.gz QDKBVPPZRAOEHE-UHFFFAOYSA-N 2 0 326.459 4.455 20 0 EIADRP CCOc1ccc([C@H](CC)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1OCC ZINC000295954678 1042541328 /nfs/dbraw/zinc/54/13/28/1042541328.db2.gz MMGJRMGBXOFYGU-IPQPSQTFSA-N 2 0 346.515 4.150 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310473095 1042837902 /nfs/dbraw/zinc/83/79/02/1042837902.db2.gz BXUBODHVCUMBPF-QKLQHJQFSA-N 2 0 326.459 4.387 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc2ccccc2n1 ZINC000178172611 1042860565 /nfs/dbraw/zinc/86/05/65/1042860565.db2.gz WNLFKZDVAGSJHV-KRWDZBQOSA-N 2 0 349.478 4.026 20 0 EIADRP c1cc(C[NH+]2CCCCC2)ccc1C[N@@H+]1CCC[C@@H]1[C@H]1CCCOC1 ZINC000520575618 1042899609 /nfs/dbraw/zinc/89/96/09/1042899609.db2.gz WNIPTQWPYKYQRX-FCHUYYIVSA-N 2 0 342.527 4.064 20 0 EIADRP COC[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(Cl)cc1 ZINC000493884680 1042971187 /nfs/dbraw/zinc/97/11/87/1042971187.db2.gz ZNNQGCITJNPICD-LPHOPBHVSA-N 2 0 338.923 4.272 20 0 EIADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000493897353 1042980624 /nfs/dbraw/zinc/98/06/24/1042980624.db2.gz NOUYNRSJRKELIV-PGRDOPGGSA-N 2 0 338.495 4.148 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000183192170 1043039460 /nfs/dbraw/zinc/03/94/60/1043039460.db2.gz XWFVSDGZTDXWMT-DOADOZAASA-N 2 0 344.543 4.430 20 0 EIADRP C[C@@H]([NH2+]Cc1ccnc2ccccc12)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000388842125 1043061922 /nfs/dbraw/zinc/06/19/22/1043061922.db2.gz YFOLSSDRRPBLHW-NQIIRXRSSA-N 2 0 345.490 4.235 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCC2(O)CCCCC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168008559 1043073209 /nfs/dbraw/zinc/07/32/09/1043073209.db2.gz FMBLGEWCNWKJBB-CEQLMSFQSA-N 2 0 344.543 4.103 20 0 EIADRP C[C@H]([NH2+][C@@H](COc1ccccc1)c1ccccc1)C1CC[NH+](C)CC1 ZINC000678583957 1043075772 /nfs/dbraw/zinc/07/57/72/1043075772.db2.gz HQYGENFWQVOEHR-AVRDEDQJSA-N 2 0 338.495 4.127 20 0 EIADRP CN1CCC([N@H+](C2CCCC2)[C@@H]2Cc3cccc(Cl)c3C2)CC1 ZINC001168743178 1043085409 /nfs/dbraw/zinc/08/54/09/1043085409.db2.gz JOYOKHJDBFDYMH-GOSISDBHSA-N 2 0 332.919 4.146 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]C2CCN(c3ccc(N(C)C)cc3)CC2)[C@@H](C)C1 ZINC000765955666 1043086007 /nfs/dbraw/zinc/08/60/07/1043086007.db2.gz AURCJEFOSLJJBE-WWMYMODYSA-N 2 0 329.532 4.136 20 0 EIADRP Clc1cccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000309909771 1043087777 /nfs/dbraw/zinc/08/77/77/1043087777.db2.gz RLRGFYDHWPCJIU-IBGZPJMESA-N 2 0 328.887 4.342 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)C1CCSCC1 ZINC000187060778 1043324177 /nfs/dbraw/zinc/32/41/77/1043324177.db2.gz UCFYSBFCANCMMK-KRWDZBQOSA-N 2 0 332.557 4.020 20 0 EIADRP C[C@@H]([NH2+][C@H](c1ccccc1)c1cccc(F)c1)C1CC[NH+](C)CC1 ZINC000168565424 1043373340 /nfs/dbraw/zinc/37/33/40/1043373340.db2.gz KWTJSFICBRNXGZ-IIBYNOLFSA-N 2 0 326.459 4.235 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2cccnc2c1 ZINC000674067648 1043386928 /nfs/dbraw/zinc/38/69/28/1043386928.db2.gz MRFXEFYUGRPDEB-XMSQKQJNSA-N 2 0 345.490 4.235 20 0 EIADRP CC[C@](C)([NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C)c1ccc(F)cc1 ZINC000631194862 1043391794 /nfs/dbraw/zinc/39/17/94/1043391794.db2.gz QOXZLAWFGOEAOB-FQEVSTJZSA-N 2 0 338.430 4.130 20 0 EIADRP CCCC[N@H+](C)CCCNC1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168012146 1043415740 /nfs/dbraw/zinc/41/57/40/1043415740.db2.gz WWWWPYMMZRNMTK-WOJBJXKFSA-N 2 0 345.575 4.140 20 0 EIADRP CCC[NH+](CCC)CCNC1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168012329 1043421296 /nfs/dbraw/zinc/42/12/96/1043421296.db2.gz YKOURBMASGIMTP-WOJBJXKFSA-N 2 0 345.575 4.140 20 0 EIADRP C(=C\C[N@@H+]1CCC[C@@H]1c1ccccn1)\C[NH+]1CCC[C@@H]1c1ccccn1 ZINC000674371432 1043646041 /nfs/dbraw/zinc/64/60/41/1043646041.db2.gz QRCNTDULJDXPFL-UQMQSGJDSA-N 2 0 348.494 4.007 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000665281204 1043650086 /nfs/dbraw/zinc/65/00/86/1043650086.db2.gz XBNDKGQOAVEGHH-BLLLJJGKSA-N 2 0 335.492 4.282 20 0 EIADRP CCC1(C[NH2+][C@H]2CCCSC2)CC[NH+](Cc2ccccc2)CC1 ZINC000543074002 1043738295 /nfs/dbraw/zinc/73/82/95/1043738295.db2.gz IKZOLRHLZZVQRP-IBGZPJMESA-N 2 0 332.557 4.164 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cccc(C2CC2)c1 ZINC000658071104 1043744849 /nfs/dbraw/zinc/74/48/49/1043744849.db2.gz UOYWUQCXCMTFJE-KRWDZBQOSA-N 2 0 342.527 4.106 20 0 EIADRP Cc1c([C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cnn1C(C)(C)C ZINC000191179003 1043791866 /nfs/dbraw/zinc/79/18/66/1043791866.db2.gz LYXOUMHVBGSFAD-QGZVFWFLSA-N 2 0 334.552 4.109 20 0 EIADRP C[C@@]12CC3([NH3+])CC([NH2+][C@H]4Cc5cccc(Cl)c5C4)(C1)C[C@](C)(C3)C2 ZINC001168703939 1043797787 /nfs/dbraw/zinc/79/77/87/1043797787.db2.gz KFJZDFFOEUUPCW-DWNRMDAZSA-N 2 0 344.930 4.227 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442790829 1043841658 /nfs/dbraw/zinc/84/16/58/1043841658.db2.gz MIDAJFGJWNJWGA-WMZOPIPTSA-N 2 0 340.433 4.273 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000442793258 1043842988 /nfs/dbraw/zinc/84/29/88/1043842988.db2.gz OAJRERATAJCWEN-RDJZCZTQSA-N 2 0 328.422 4.273 20 0 EIADRP [NH3+]CC[C@H]1CCC[N@H+](Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000442917288 1043889154 /nfs/dbraw/zinc/88/91/54/1043889154.db2.gz DCWFTKXTXGAQOU-CYBMUJFWSA-N 2 0 335.904 4.024 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCc3ccc(F)cc32)cc1 ZINC000479409956 1044247238 /nfs/dbraw/zinc/24/72/38/1044247238.db2.gz KUYOCTBCESFCBL-NRFANRHFSA-N 2 0 326.459 4.445 20 0 EIADRP CCC[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccsc1 ZINC000191207815 1044278646 /nfs/dbraw/zinc/27/86/46/1044278646.db2.gz RHBQFHHIMJZFLF-LJQANCHMSA-N 2 0 332.513 4.320 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)CCC3CC3)CC2)cc1 ZINC000469774560 1044280274 /nfs/dbraw/zinc/28/02/74/1044280274.db2.gz GRFQXVBDQJBQBA-QGZVFWFLSA-N 2 0 330.516 4.076 20 0 EIADRP C[C@H]1CC(NC2(c3ccncc3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168017998 1044320374 /nfs/dbraw/zinc/32/03/74/1044320374.db2.gz YJUOOQRWEDLDMA-ROUUACIJSA-N 2 0 335.495 4.102 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000474065803 1044340435 /nfs/dbraw/zinc/34/04/35/1044340435.db2.gz HBEQVLFMTPOMNV-LJQANCHMSA-N 2 0 330.516 4.270 20 0 EIADRP CC(C)C[C@H]1CCC[C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C1 ZINC000657538368 1044383092 /nfs/dbraw/zinc/38/30/92/1044383092.db2.gz ZQPKXSXOLNFLLZ-UXHICEINSA-N 2 0 336.564 4.072 20 0 EIADRP C[NH+](C)C1CC[NH+](CCCCc2cccc(C(F)(F)F)c2)CC1 ZINC000194990117 1044406273 /nfs/dbraw/zinc/40/62/73/1044406273.db2.gz POVWKONFUOMTRE-UHFFFAOYSA-N 2 0 328.422 4.054 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3c4ccccc4[nH]c32)C1 ZINC000675728293 1044461854 /nfs/dbraw/zinc/46/18/54/1044461854.db2.gz FVLGTTIIQYEYGU-OXQOHEQNSA-N 2 0 325.500 4.255 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc2ccccc2[nH]1 ZINC000675790079 1044502358 /nfs/dbraw/zinc/50/23/58/1044502358.db2.gz RCMADJNBHUDIDA-LAUBAEHRSA-N 2 0 333.479 4.168 20 0 EIADRP C[C@@H]([NH2+]CCCc1ccc(Cl)cc1Cl)C1CC[NH+](C)CC1 ZINC000675926644 1044569394 /nfs/dbraw/zinc/56/93/94/1044569394.db2.gz VGRJZSDCIDBKRK-CYBMUJFWSA-N 2 0 329.315 4.246 20 0 EIADRP C[C@H]([NH2+]C[C@@H](Cc1ccccc1)c1ccccc1)C1CC[NH+](C)CC1 ZINC000675928067 1044585529 /nfs/dbraw/zinc/58/55/29/1044585529.db2.gz QUTIDUFFNRMXEG-WMZHIEFXSA-N 2 0 336.523 4.333 20 0 EIADRP Cc1ccccc1OCCC[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000543461463 1044650898 /nfs/dbraw/zinc/65/08/98/1044650898.db2.gz GYLWTVOGIWUTRG-OALUTQOASA-N 2 0 330.516 4.007 20 0 EIADRP CC1(C[NH2+][C@@H]2CCN(C3CC3)[C@@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000895532368 1044800679 /nfs/dbraw/zinc/80/06/79/1044800679.db2.gz OAUAXHSXRHJXKP-SJLPKXTDSA-N 2 0 334.454 4.380 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CCN(C2CC2)[C@@H](c2ccccc2)C1)[C@H]1CCCOC1 ZINC000895663399 1044843082 /nfs/dbraw/zinc/84/30/82/1044843082.db2.gz KPSUGSYYLBWXJN-YUVXSKOASA-N 2 0 342.527 4.149 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCN(Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000922836940 1044981858 /nfs/dbraw/zinc/98/18/58/1044981858.db2.gz FIBCOBMCMXYNCX-NZSAHSFTSA-N 2 0 330.541 4.057 20 0 EIADRP C[C@H]1CC(Nc2cccc(CC[NH3+])c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168035148 1044999814 /nfs/dbraw/zinc/99/98/14/1044999814.db2.gz ROVCTACJCIWTPX-ROUUACIJSA-N 2 0 337.511 4.041 20 0 EIADRP CC(C)([NH2+]CCC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1nc2ccccc2s1 ZINC000923400425 1045089939 /nfs/dbraw/zinc/08/99/39/1045089939.db2.gz YDBOMMAEDWFDEG-GOOCMWNKSA-N 2 0 329.513 4.042 20 0 EIADRP C[C@H](NCc1scnc1C1CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000487567675 1045227526 /nfs/dbraw/zinc/22/75/26/1045227526.db2.gz YJPUMVZNOLODDQ-YJBOKZPZSA-N 2 0 341.524 4.021 20 0 EIADRP CC[N@@H+]1CC[C@H](N[C@@H]2CCOc3c(Cl)c(Cl)ccc32)[C@@H](C)C1 ZINC000766259415 1045251428 /nfs/dbraw/zinc/25/14/28/1045251428.db2.gz YLSAAUYOGXAUSR-TUKIKUTGSA-N 2 0 343.298 4.137 20 0 EIADRP C[C@@H]([NH2+]CCCCC(=O)OC(C)(C)C)c1ccc(-n2ccnc2)cc1 ZINC000611367598 1045288359 /nfs/dbraw/zinc/28/83/59/1045288359.db2.gz LPVOHNQZPCHEFQ-MRXNPFEDSA-N 2 0 343.471 4.035 20 0 EIADRP COc1ccc2ccccc2c1C[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000237322670 1045381584 /nfs/dbraw/zinc/38/15/84/1045381584.db2.gz PALDRLWLHAVQCA-UHFFFAOYSA-N 2 0 326.484 4.247 20 0 EIADRP C[C@H](CC[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000237463495 1045386260 /nfs/dbraw/zinc/38/62/60/1045386260.db2.gz REHDFNYQZCUUTD-IFMALSPDSA-N 2 0 336.523 4.334 20 0 EIADRP C[C@@H]1C[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CCC[C@@H]1C[NH3+] ZINC001206026688 1045712421 /nfs/dbraw/zinc/71/24/21/1045712421.db2.gz TZBDZPMOSDNFDY-ZYHUDNBSSA-N 2 0 335.706 4.454 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000768100578 1045713312 /nfs/dbraw/zinc/71/33/12/1045713312.db2.gz CQQNULXZPIXBIP-KGLIPLIRSA-N 2 0 328.422 4.129 20 0 EIADRP COc1cc([C@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)ccc1F ZINC000768110215 1045718225 /nfs/dbraw/zinc/71/82/25/1045718225.db2.gz ZBGJRJNJMZXMAK-ZLPCBKJTSA-N 2 0 334.479 4.282 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccc(Br)cc2)cc1 ZINC000768169050 1045734357 /nfs/dbraw/zinc/73/43/57/1045734357.db2.gz CVTAWDHVZQLHDV-UHFFFAOYSA-N 2 0 347.300 4.143 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCSc1ccccc1 ZINC000397977362 1045819874 /nfs/dbraw/zinc/81/98/74/1045819874.db2.gz KZLAHAZGPLXGSG-RXVVDRJESA-N 2 0 340.536 4.279 20 0 EIADRP CCn1cc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)cn1 ZINC000247015354 1045837903 /nfs/dbraw/zinc/83/79/03/1045837903.db2.gz LMFYQAPROZAPJH-MSOLQXFVSA-N 2 0 340.515 4.128 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@H]2CCN(Cc3ccccn3)C[C@H]2C)c(C)s1 ZINC000247166801 1045842938 /nfs/dbraw/zinc/84/29/38/1045842938.db2.gz UKZQYXUZPKLBIO-IIMJZQEZSA-N 2 0 343.540 4.321 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@@H]2CCN(Cc3ccccn3)C[C@H]2C)c(C)s1 ZINC000247166814 1045843490 /nfs/dbraw/zinc/84/34/90/1045843490.db2.gz UKZQYXUZPKLBIO-PTSWNOGYSA-N 2 0 343.540 4.321 20 0 EIADRP CC(C)c1ccc(C2(O)CCC([NH2+]CCC[NH+]3CCCC3)CC2)cc1 ZINC000769005143 1045876138 /nfs/dbraw/zinc/87/61/38/1045876138.db2.gz TWEIJZFGNTVYFK-UHFFFAOYSA-N 2 0 344.543 4.016 20 0 EIADRP COc1cc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)ccc1SC ZINC000769192013 1045885723 /nfs/dbraw/zinc/88/57/23/1045885723.db2.gz FSEQZGFYFVQHBF-UHFFFAOYSA-N 2 0 344.524 4.111 20 0 EIADRP CC[C@H]1C[C@@H]([N@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170188948 1045919430 /nfs/dbraw/zinc/91/94/30/1045919430.db2.gz ABUPYMWCKAGVFT-TUFLPTIASA-N 2 0 330.516 4.025 20 0 EIADRP CC[C@H]1C[C@@H]([N@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170194962 1045933415 /nfs/dbraw/zinc/93/34/15/1045933415.db2.gz PHMNLCQJQTZKDF-TUFLPTIASA-N 2 0 330.516 4.025 20 0 EIADRP CC[C@H]1C[C@@H]([N@H+]2C[C@H]3c4ccccc4[C@H]([NH+](C)C(C)C)[C@H]3C2)CCO1 ZINC001170222648 1045950222 /nfs/dbraw/zinc/95/02/22/1045950222.db2.gz OMOUBGBLPIMZCG-NXQKYAITSA-N 2 0 342.527 4.055 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000161613197 1046006270 /nfs/dbraw/zinc/00/62/70/1046006270.db2.gz BTFUURMQZUDJHZ-JKIFEVAISA-N 2 0 340.433 4.055 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](C)[C@@H](C)c2nc3ccccc3s2)CC1 ZINC000161621928 1046010875 /nfs/dbraw/zinc/01/08/75/1046010875.db2.gz AGSKNECYPUYYIX-CABCVRRESA-N 2 0 331.529 4.252 20 0 EIADRP CCC[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@@H](O)c1ccccc1 ZINC000793235717 1046182299 /nfs/dbraw/zinc/18/22/99/1046182299.db2.gz BAAOBPGUSZIDAJ-YADHBBJMSA-N 2 0 344.543 4.275 20 0 EIADRP CCOc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)CC)c2)cc1 ZINC000124004558 1046211583 /nfs/dbraw/zinc/21/15/83/1046211583.db2.gz NYPNRKVQMARNHS-QGZVFWFLSA-N 2 0 326.484 4.388 20 0 EIADRP CCOc1ccccc1[C@@H](C)[NH2+]Cc1cccc(C[N@H+](C)CC)c1 ZINC000123984411 1046212168 /nfs/dbraw/zinc/21/21/68/1046212168.db2.gz XSEUFDSINBKSKY-QGZVFWFLSA-N 2 0 326.484 4.388 20 0 EIADRP CC[N@H+](C)C[C@@H]1CC[NH+](CCCCc2cccc(C(F)(F)F)c2)C1 ZINC000476006466 1046252316 /nfs/dbraw/zinc/25/23/16/1046252316.db2.gz BURJBNOXFDPDCB-KRWDZBQOSA-N 2 0 342.449 4.302 20 0 EIADRP CC[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(OC(F)F)cc1 ZINC000125440463 1046307012 /nfs/dbraw/zinc/30/70/12/1046307012.db2.gz ZQAYSLFKIJRMER-QGZVFWFLSA-N 2 0 326.431 4.061 20 0 EIADRP COc1ccccc1[C@@H](C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000125472320 1046309807 /nfs/dbraw/zinc/30/98/07/1046309807.db2.gz NHVSZNSNJFRDPB-MRXNPFEDSA-N 2 0 344.524 4.320 20 0 EIADRP C[C@H]([NH2+]CCc1c[nH]c2ccccc12)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508715206 1046360043 /nfs/dbraw/zinc/36/00/43/1046360043.db2.gz XHNHYORWEGNHNP-GHTZIAJQSA-N 2 0 347.506 4.211 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)CC1 ZINC000126203960 1046465237 /nfs/dbraw/zinc/46/52/37/1046465237.db2.gz TVTSNWJIXOCREL-QGZVFWFLSA-N 2 0 341.524 4.119 20 0 EIADRP C[NH+]1C(C)(C)CC(Nc2ccc([C@@H]3CCCC[N@H+]3C)cn2)CC1(C)C ZINC001170450925 1046496416 /nfs/dbraw/zinc/49/64/16/1046496416.db2.gz OBTBFSKBBBBHEN-SFHVURJKSA-N 2 0 344.547 4.302 20 0 EIADRP Cc1cc(N2CCC[C@@H]([NH+](C)C)CC2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000428673147 1046520485 /nfs/dbraw/zinc/52/04/85/1046520485.db2.gz SQWWQSAYCYEKMC-CQSZACIVSA-N 2 0 349.425 4.065 20 0 EIADRP C[N@@H+]1CC[C@@H](c2ccc(NC3CC(C)(C)[NH+](C)C(C)(C)C3)cc2)C1 ZINC001170453380 1046536610 /nfs/dbraw/zinc/53/66/10/1046536610.db2.gz JSDNZSABXJSJTH-QGZVFWFLSA-N 2 0 329.532 4.169 20 0 EIADRP COc1cccc2c(NC3CC(C)(C)[NH+](C)C(C)(C)C3)ccnc12 ZINC001170452052 1046541012 /nfs/dbraw/zinc/54/10/12/1046541012.db2.gz UXHYFUMFOQSHNT-UHFFFAOYSA-N 2 0 327.472 4.307 20 0 EIADRP CCC[N@H+](C)C[C@@H]1CCN(Cc2ccccc2OC2CCCC2)C1 ZINC000536664515 1046635484 /nfs/dbraw/zinc/63/54/84/1046635484.db2.gz OSWBFBCINSPOKI-SFHVURJKSA-N 2 0 330.516 4.172 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2ccc(OC(F)F)c(Cl)c2)[C@H](C)C1 ZINC000536678536 1046663538 /nfs/dbraw/zinc/66/35/38/1046663538.db2.gz CASQGRBTSJJWQA-DOMZBBRYSA-N 2 0 346.849 4.104 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1c(C)nc2scc(C3CC3)n12 ZINC000459465976 1046704426 /nfs/dbraw/zinc/70/44/26/1046704426.db2.gz OKHVOTOVJHWOCU-AWEZNQCLSA-N 2 0 348.560 4.182 20 0 EIADRP C[C@H]1C[C@@H](NCc2cc(F)ccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000379624358 1046714191 /nfs/dbraw/zinc/71/41/91/1046714191.db2.gz JPDRXTPSILBZSN-KXBFYZLASA-N 2 0 330.422 4.108 20 0 EIADRP Cn1cncc1CC[NH+]1CCC(c2ccc(Cl)cc2Cl)CC1 ZINC000459495013 1046723983 /nfs/dbraw/zinc/72/39/83/1046723983.db2.gz SXFLUMAMOXLHID-UHFFFAOYSA-N 2 0 338.282 4.149 20 0 EIADRP Fc1ccc2[nH]cc(CC[NH2+]C3CC[NH+](C4CCCCC4)CC3)c2c1 ZINC000127834510 1046729648 /nfs/dbraw/zinc/72/96/48/1046729648.db2.gz JDUVISARCRDDPG-UHFFFAOYSA-N 2 0 343.490 4.236 20 0 EIADRP CC(C)[C@H](C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)Cc1ccccc1 ZINC000459494721 1046734272 /nfs/dbraw/zinc/73/42/72/1046734272.db2.gz KFNHUSXIWNJLQO-FQEVSTJZSA-N 2 0 337.511 4.155 20 0 EIADRP CCOc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000379643031 1046737296 /nfs/dbraw/zinc/73/72/96/1046737296.db2.gz ASJQLZYYGUZDMV-GHTZIAJQSA-N 2 0 338.495 4.228 20 0 EIADRP CCOCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CCC1 ZINC000536845207 1046817743 /nfs/dbraw/zinc/81/77/43/1046817743.db2.gz KRPJOJPOCREQLT-PZJWPPBQSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@H]([NH2+]Cc1cnc2ccccc2c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000536856922 1046826172 /nfs/dbraw/zinc/82/61/72/1046826172.db2.gz JCFWHSQYHMXORR-KRWDZBQOSA-N 2 0 349.478 4.026 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC(C)(C)c1c(Cl)cccc1Cl ZINC000536865826 1046831594 /nfs/dbraw/zinc/83/15/94/1046831594.db2.gz XXYXFRFIGLYFAS-SWLSCSKDSA-N 2 0 329.315 4.201 20 0 EIADRP Cc1cc(C[NH2+]CC[C@@H]2CCC[N@@H+](C)C2)ccc1Oc1cccnc1 ZINC000459726992 1046865616 /nfs/dbraw/zinc/86/56/16/1046865616.db2.gz GWQAAWQSONFIQZ-SFHVURJKSA-N 2 0 339.483 4.004 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](c2ccccc2OC)C2CCCC2)C1 ZINC000536959192 1046870491 /nfs/dbraw/zinc/87/04/91/1046870491.db2.gz KUXJAFHGOMGCCV-UWJYYQICSA-N 2 0 330.516 4.248 20 0 EIADRP C[NH+]1CCC(C[N@@H+]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000788011355 1047079814 /nfs/dbraw/zinc/07/98/14/1047079814.db2.gz FXPWGXGAANVHQF-KRWDZBQOSA-N 2 0 327.299 4.472 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H](CCc2ccccc2)Cc2ccccc2)CC1 ZINC000537303060 1047084833 /nfs/dbraw/zinc/08/48/33/1047084833.db2.gz AYRWSNIBIVMHFT-QHCPKHFHSA-N 2 0 334.507 4.082 20 0 EIADRP C[NH+]1CCC(C[N@H+](Cc2ccc(C(F)(F)F)cc2)C2CC2)CC1 ZINC000788470982 1047195397 /nfs/dbraw/zinc/19/53/97/1047195397.db2.gz QDPQNCNSXCDBNW-UHFFFAOYSA-N 2 0 326.406 4.012 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1cc[nH]c(=O)c1 ZINC000788582305 1047236714 /nfs/dbraw/zinc/23/67/14/1047236714.db2.gz GJFQWPYFIFWTKA-QGZVFWFLSA-N 2 0 339.483 4.014 20 0 EIADRP CC(C)[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@H](O)c1ccccc1 ZINC000788622277 1047251771 /nfs/dbraw/zinc/25/17/71/1047251771.db2.gz QPYNIWDAVGRGJV-FCHUYYIVSA-N 2 0 344.543 4.131 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000129195711 1047330739 /nfs/dbraw/zinc/33/07/39/1047330739.db2.gz RGRLXTBPPGWPAH-QZTJIDSGSA-N 2 0 340.433 4.493 20 0 EIADRP C[C@@H]1CC[C@H]([NH+]2CCC([NH3+])(c3ccc(C(F)(F)F)cc3)CC2)C1 ZINC001170119547 1047471382 /nfs/dbraw/zinc/47/13/82/1047471382.db2.gz YIKOLXUIUIBEGW-CJNGLKHVSA-N 2 0 326.406 4.144 20 0 EIADRP C[C@H]1CC[C@@H]([NH+]2CCC([NH3+])(c3ccc(C(F)(F)F)cc3)CC2)C1 ZINC001170119551 1047471581 /nfs/dbraw/zinc/47/15/81/1047471581.db2.gz YIKOLXUIUIBEGW-XJKSGUPXSA-N 2 0 326.406 4.144 20 0 EIADRP C=Cc1ccccc1-n1cc(CC[NH+]2CCC([NH3+])CC2)c2ccccc21 ZINC001170528371 1047474288 /nfs/dbraw/zinc/47/42/88/1047474288.db2.gz NWBKAHGTOBVFSY-UHFFFAOYSA-N 2 0 345.490 4.239 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000129862240 1047518325 /nfs/dbraw/zinc/51/83/25/1047518325.db2.gz RWYWXPRYSIXQFK-NQIIRXRSSA-N 3 0 343.559 4.023 20 0 EIADRP CCC[C@H](CC)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556231271 1047597004 /nfs/dbraw/zinc/59/70/04/1047597004.db2.gz UNPJRFAEUQDCEA-RTWAWAEBSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)[C@]1(C)CCCO1 ZINC000556235959 1047600824 /nfs/dbraw/zinc/60/08/24/1047600824.db2.gz KQPARIKCOFEPCD-OPYAIIAOSA-N 2 0 330.516 4.108 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccccc1OC(F)F ZINC000556231107 1047608221 /nfs/dbraw/zinc/60/82/21/1047608221.db2.gz SIWILZIOBUXLGV-OAHLLOKOSA-N 2 0 326.431 4.205 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H](c2ccncc2)C2CC2)CC1 ZINC000898322387 1047615850 /nfs/dbraw/zinc/61/58/50/1047615850.db2.gz KJRQLUABEYKPRQ-CZAAIQMYSA-N 2 0 327.516 4.165 20 0 EIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000556242191 1047622269 /nfs/dbraw/zinc/62/22/69/1047622269.db2.gz RJIGLFQNEXNFOK-HGSOSGBHSA-N 2 0 334.507 4.290 20 0 EIADRP COc1ccc(CCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000130206993 1047651176 /nfs/dbraw/zinc/65/11/76/1047651176.db2.gz MFXHQXABAKSGDY-UHFFFAOYSA-N 2 0 330.516 4.015 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2ccccc2N2CCCCCC2)CC1 ZINC001168295038 1047664400 /nfs/dbraw/zinc/66/44/00/1047664400.db2.gz QWYOCBUGMWMTKE-UHFFFAOYSA-N 2 0 329.532 4.029 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](CCC(=O)c2ccccc2)CC1 ZINC000537517096 1047665711 /nfs/dbraw/zinc/66/57/11/1047665711.db2.gz YIEATYIHOJMBGC-LJQANCHMSA-N 2 0 342.527 4.236 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)CC2 ZINC000106479703 1047679712 /nfs/dbraw/zinc/67/97/12/1047679712.db2.gz FOHDMCYNPMYQQA-QFIPXVFZSA-N 2 0 338.495 4.103 20 0 EIADRP C[NH+](C)C1CCC([NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)CC1 ZINC001168303990 1047731304 /nfs/dbraw/zinc/73/13/04/1047731304.db2.gz IROMNQROFWZODN-UHFFFAOYSA-N 2 0 326.406 4.157 20 0 EIADRP CCCCCCOC(=O)CCCCC[NH2+]C1CCC([NH+](C)C)CC1 ZINC001168304100 1047737255 /nfs/dbraw/zinc/73/72/55/1047737255.db2.gz PCMGUXPWQYAVKK-UHFFFAOYSA-N 2 0 340.552 4.133 20 0 EIADRP Cc1ccc([C@@H](O)C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)cc1 ZINC000763432485 1047753551 /nfs/dbraw/zinc/75/35/51/1047753551.db2.gz MBSRKARZGUVNEJ-KNQAVFIVSA-N 2 0 344.543 4.005 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](C[C@H]2CC2(Cl)Cl)CC1 ZINC000763435101 1047805216 /nfs/dbraw/zinc/80/52/16/1047805216.db2.gz YZZGPKOSEOTUKB-GOEBONIOSA-N 2 0 333.347 4.157 20 0 EIADRP COc1ncc([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1Cl ZINC000556591833 1047835297 /nfs/dbraw/zinc/83/52/97/1047835297.db2.gz NEAROMYZHHBQKU-LSDHHAIUSA-N 2 0 339.911 4.049 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)[C@@H](O)c1ccccc1 ZINC000824401104 1047865595 /nfs/dbraw/zinc/86/55/95/1047865595.db2.gz BPJSDBSBRXMNOE-YLJYHZDGSA-N 2 0 346.559 4.377 20 0 EIADRP Cc1ccc(-c2nc(C[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)co2)cc1 ZINC000556686432 1047873486 /nfs/dbraw/zinc/87/34/86/1047873486.db2.gz IBDCFVUDSPIABP-UHFFFAOYSA-N 2 0 341.499 4.202 20 0 EIADRP [NH3+]C1(c2ccc(N[C@@H](Cc3ccccc3)C[NH+]3CCCC3)cc2)CCC1 ZINC001170751228 1048057827 /nfs/dbraw/zinc/05/78/27/1048057827.db2.gz ANDLMFCLQMEQSQ-QFIPXVFZSA-N 2 0 349.522 4.144 20 0 EIADRP c1c[nH]c([C@H]([NH2+]CCCCC[NH+]2CCCCC2)C2CCCCC2)n1 ZINC000556870424 1048087176 /nfs/dbraw/zinc/08/71/76/1048087176.db2.gz FBSGERWRDKELAA-LJQANCHMSA-N 2 0 332.536 4.277 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+]CCn2ccc3cc(Cl)ccc32)CC1 ZINC000556911567 1048186722 /nfs/dbraw/zinc/18/67/22/1048186722.db2.gz LKIVKGUJFFYEAO-UHFFFAOYSA-N 2 0 333.907 4.147 20 0 EIADRP [NH3+]C1(c2ccccc2)CC[NH+]([C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171110271 1048220183 /nfs/dbraw/zinc/22/01/83/1048220183.db2.gz BTIBMCQCWJKIBD-HXUWFJFHSA-N 2 0 340.898 4.147 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171116229 1048278842 /nfs/dbraw/zinc/27/88/42/1048278842.db2.gz LMEZNVGDTGRZGV-SLFFLAALSA-N 2 0 334.935 4.440 20 0 EIADRP C(=C/c1ccccc1)\C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499136336 1048332266 /nfs/dbraw/zinc/33/22/66/1048332266.db2.gz QMSQLGKQPZZYMG-RWCQXELZSA-N 2 0 332.491 4.485 20 0 EIADRP Cc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1F ZINC000499159621 1048368997 /nfs/dbraw/zinc/36/89/97/1048368997.db2.gz VTWZZCFEDRGFNC-WKCHPHFGSA-N 2 0 338.470 4.419 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)Cc2cc(Cl)c(F)cc2F)CC1 ZINC001144130176 1048454609 /nfs/dbraw/zinc/45/46/09/1048454609.db2.gz ZYJILYATZWIJCM-UHFFFAOYSA-N 2 0 330.850 4.170 20 0 EIADRP Cc1cc(F)ccc1[C@@H](C)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000815589822 1048528229 /nfs/dbraw/zinc/52/82/29/1048528229.db2.gz FDBVOPYSYFSSQV-MRXNPFEDSA-N 2 0 327.447 4.096 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CCC2CC[NH2+]CC2)ccc1SC(F)F ZINC000844924643 1048550317 /nfs/dbraw/zinc/55/03/17/1048550317.db2.gz NFWAQCKCSGXVPC-GFCCVEGCSA-N 2 0 344.471 4.050 20 0 EIADRP CCc1cccc(C[NH+]2CCC3(CC[N@H+](Cc4cccnc4)C3)CC2)c1 ZINC001144322868 1048591186 /nfs/dbraw/zinc/59/11/86/1048591186.db2.gz GQFMGTKELPZYPW-UHFFFAOYSA-N 2 0 349.522 4.132 20 0 EIADRP [NH3+]CCCCCC[N@@H+]1CCC[C@@H]1c1ccc(Br)s1 ZINC000846223925 1048843432 /nfs/dbraw/zinc/84/34/32/1048843432.db2.gz QLNWOGBLEMYBTG-GFCCVEGCSA-N 2 0 331.323 4.167 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cnc(C3CC3)s2)c1 ZINC000134249339 1048914914 /nfs/dbraw/zinc/91/49/14/1048914914.db2.gz JMNFGWREIXLEBI-UHFFFAOYSA-N 2 0 329.513 4.151 20 0 EIADRP C[C@@H]([NH2+][C@H]1CCCc2sccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000134969407 1049047523 /nfs/dbraw/zinc/04/75/23/1049047523.db2.gz VFOXEOGOZRPTLL-BEFAXECRSA-N 2 0 344.524 4.417 20 0 EIADRP CC(C)c1ccc(C2(O)CCC([NH2+]CC3([NH3+])CCCCC3)CC2)cc1 ZINC000817938306 1049061872 /nfs/dbraw/zinc/06/18/72/1049061872.db2.gz IPJILTJXDVQPJE-UHFFFAOYSA-N 2 0 344.543 4.191 20 0 EIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)CCCO2 ZINC000817949209 1049063040 /nfs/dbraw/zinc/06/30/40/1049063040.db2.gz NWSWFDRRUYTKPC-OAQYLSRUSA-N 2 0 338.495 4.315 20 0 EIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2ccc(CC[NH3+])cc2)cc1Cl ZINC000817949140 1049064778 /nfs/dbraw/zinc/06/47/78/1049064778.db2.gz OJIKWJMJRQHTKZ-OAHLLOKOSA-N 2 0 346.902 4.479 20 0 EIADRP FC(F)Sc1ccc2c(c1)CCC[C@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000817967845 1049072656 /nfs/dbraw/zinc/07/26/56/1049072656.db2.gz CSNFXXATLNUJKQ-XJKSGUPXSA-N 2 0 326.456 4.110 20 0 EIADRP COc1ccc([C@H]([NH2+][C@@H](C)CCC[NH3+])c2ccc(Cl)cc2)cc1C ZINC000817977454 1049074934 /nfs/dbraw/zinc/07/49/34/1049074934.db2.gz KOJVJOCRWUKVMA-MGPUTAFESA-N 2 0 346.902 4.463 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@@H]2CCc3cccc(Cl)c3C2)C[C@@](C)(C[NH3+])C1 ZINC001170901555 1049151232 /nfs/dbraw/zinc/15/12/32/1049151232.db2.gz FCERWBKLJRSPNM-GQIGUUNPSA-N 2 0 334.935 4.331 20 0 EIADRP [NH3+]CCC[C@H]([NH3+])Nc1ccccc1-n1c2ccccc2c2ccccc21 ZINC001170902438 1049158276 /nfs/dbraw/zinc/15/82/76/1049158276.db2.gz CCLXZRCPEYLIRM-JOCHJYFZSA-N 2 0 344.462 4.219 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170918102 1049231196 /nfs/dbraw/zinc/23/11/96/1049231196.db2.gz SVGFFPWVVAYPCK-KZNAEPCWSA-N 2 0 334.935 4.440 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170918100 1049233963 /nfs/dbraw/zinc/23/39/63/1049233963.db2.gz SVGFFPWVVAYPCK-KURKYZTESA-N 2 0 334.935 4.440 20 0 EIADRP CC[NH+](CC)Cc1cc(C(F)(F)F)ccc1NC[C@H]1CCCC[NH2+]1 ZINC001171341925 1049415806 /nfs/dbraw/zinc/41/58/06/1049415806.db2.gz ZWLSKVBSXLVXIP-MRXNPFEDSA-N 2 0 343.437 4.101 20 0 EIADRP Fc1cc(F)c2c(c1)CC[C@@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)C2 ZINC001170678388 1049503624 /nfs/dbraw/zinc/50/36/24/1049503624.db2.gz YHOGXBZUTLPUAX-GOSISDBHSA-N 2 0 348.481 4.209 20 0 EIADRP Fc1cc(F)c2c(c1)C[C@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)CC2 ZINC001171353217 1049504969 /nfs/dbraw/zinc/50/49/69/1049504969.db2.gz FECBCHIXLRHQEL-LJQANCHMSA-N 2 0 348.481 4.066 20 0 EIADRP CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cccc(C[NH+](C)C)c2)C12CCCC2 ZINC000820813119 1049557226 /nfs/dbraw/zinc/55/72/26/1049557226.db2.gz YYIHBXIKJQZKEL-PWIZWCRZSA-N 2 0 330.516 4.137 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@@H]2CCc3cc(F)cc(F)c3C2)CC1 ZINC001170685410 1049567832 /nfs/dbraw/zinc/56/78/32/1049567832.db2.gz MHHDJKQCWLNUMR-KZNAEPCWSA-N 2 0 336.470 4.065 20 0 EIADRP CCC1(C[NH2+][C@@H](C)C[C@H]2CCOC2)CC[NH+](Cc2ccccc2)CC1 ZINC000773105040 1049583485 /nfs/dbraw/zinc/58/34/85/1049583485.db2.gz HHJNZRJZMNZCKT-PZJWPPBQSA-N 2 0 344.543 4.084 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389392 1049600360 /nfs/dbraw/zinc/60/03/60/1049600360.db2.gz STKBZOJBHIFBSU-OTWHNJEPSA-N 2 0 348.481 4.161 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389391 1049600698 /nfs/dbraw/zinc/60/06/98/1049600698.db2.gz STKBZOJBHIFBSU-IPMKNSEASA-N 2 0 348.481 4.161 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@H]2CCc3c(F)cccc3C2)CC1 ZINC001171413609 1049645313 /nfs/dbraw/zinc/64/53/13/1049645313.db2.gz HWOLOUXLANFNET-WDSOQIARSA-N 2 0 330.491 4.198 20 0 EIADRP CC(C)(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2c(F)cccc2C1 ZINC001171414303 1049647495 /nfs/dbraw/zinc/64/74/95/1049647495.db2.gz PRYURWAFNMPKPZ-BZSNNMDCSA-N 2 0 332.507 4.301 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)c1cccc(O)c1 ZINC000716693175 1049701396 /nfs/dbraw/zinc/70/13/96/1049701396.db2.gz OGBURNTVXIMOMX-YRLHULLVSA-N 2 0 336.479 4.096 20 0 EIADRP FC1(F)CCC[C@H]([NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)C1 ZINC000716629312 1049702082 /nfs/dbraw/zinc/70/20/82/1049702082.db2.gz YFYJBWDGYJSGDB-OKYOBFRVSA-N 2 0 334.454 4.207 20 0 EIADRP CC(C)(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cccc(F)c2C1 ZINC001170972573 1049702919 /nfs/dbraw/zinc/70/29/19/1049702919.db2.gz QSABAKZILKQCBP-KZNAEPCWSA-N 2 0 332.507 4.301 20 0 EIADRP COc1ccccc1[C@@H]1CC[N@@H+](C2CC(C)(C)[NH+](C)C(C)(C)C2)C1 ZINC001171628587 1049761679 /nfs/dbraw/zinc/76/16/79/1049761679.db2.gz BYCHIOWWIQFDHD-MRXNPFEDSA-N 2 0 330.516 4.136 20 0 EIADRP C[NH+]1C(C)(C)CC(NC2CC[NH+](C[C@@H]3CC=CCC3)CC2)CC1(C)C ZINC001171629923 1049762074 /nfs/dbraw/zinc/76/20/74/1049762074.db2.gz ZTTBSGQMDKEKMW-GOSISDBHSA-N 2 0 347.591 4.048 20 0 EIADRP COc1ccc(CC2(C[NH2+]C3CC(C)(C)[NH+](C)C(C)(C)C3)CC2)cc1 ZINC001171630112 1049762741 /nfs/dbraw/zinc/76/27/41/1049762741.db2.gz JNUGDKLIOQVMJE-UHFFFAOYSA-N 2 0 344.543 4.259 20 0 EIADRP C[NH+]1C(C)(C)CC([NH+]2CCC(OCc3ccccc3)CC2)CC1(C)C ZINC001171636543 1049779930 /nfs/dbraw/zinc/77/99/30/1049779930.db2.gz HYBIKOWCCDILSE-UHFFFAOYSA-N 2 0 344.543 4.319 20 0 EIADRP C[N@H+](CC[C@@H]1CC1(Cl)Cl)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000822654602 1049781661 /nfs/dbraw/zinc/78/16/61/1049781661.db2.gz NTGAGONNOWMHJP-IAGOWNOFSA-N 2 0 341.326 4.024 20 0 EIADRP C[C@H]([NH3+])c1ccc2c(ccn2[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC001171726744 1049784810 /nfs/dbraw/zinc/78/48/10/1049784810.db2.gz HYUKEBSYGJXHJT-FIKGOQFSSA-N 2 0 333.479 4.497 20 0 EIADRP Cc1ccc2c(c1)c(CC[NH3+])cn2[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171727765 1049784829 /nfs/dbraw/zinc/78/48/29/1049784829.db2.gz XPSVBZMJBISYAB-NQIIRXRSSA-N 2 0 347.506 4.286 20 0 EIADRP Cc1c(CC[NH3+])c2ccccc2n1[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171727248 1049785061 /nfs/dbraw/zinc/78/50/61/1049785061.db2.gz TXZBBCIPFWARSQ-FXAWDEMLSA-N 2 0 347.506 4.286 20 0 EIADRP Cc1cc2cc(C[NH3+])ccc2n1[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171727133 1049785588 /nfs/dbraw/zinc/78/55/88/1049785588.db2.gz QCDLNLPDTIOJRR-HRAATJIYSA-N 2 0 333.479 4.244 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1CCc2cccc(F)c2C1 ZINC001171005853 1049819550 /nfs/dbraw/zinc/81/95/50/1049819550.db2.gz RMTJOBAMWPCHOP-FHWLQOOXSA-N 2 0 330.491 4.022 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H]([NH2+][C@H](C)Cc2ccc(C(F)(F)F)cc2)[C@@H](C)C1 ZINC001171961718 1049825288 /nfs/dbraw/zinc/82/52/88/1049825288.db2.gz BGGPRKUOGFDREG-HDMKZQKVSA-N 2 0 342.449 4.345 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[C@H]([NH+](C)C)CC1 ZINC001171962883 1049825302 /nfs/dbraw/zinc/82/53/02/1049825302.db2.gz GDGQLTDPUXAMAP-KBRIMQKVSA-N 2 0 328.422 4.099 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[C@H]([NH+](C)C)CC1 ZINC001171962881 1049825434 /nfs/dbraw/zinc/82/54/34/1049825434.db2.gz GDGQLTDPUXAMAP-JQFCIGGWSA-N 2 0 328.422 4.099 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[N@@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001171966410 1049826782 /nfs/dbraw/zinc/82/67/82/1049826782.db2.gz VBEFQJBELLSBHQ-RDJZCZTQSA-N 2 0 342.449 4.477 20 0 EIADRP CC(C)([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1ccncc1 ZINC001171974435 1049835741 /nfs/dbraw/zinc/83/57/41/1049835741.db2.gz FVURXICCLFARJN-HXUWFJFHSA-N 2 0 337.511 4.350 20 0 EIADRP CC1(C)C[C@H]([NH+]2CC[C@H](c3ccncc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171983724 1049838479 /nfs/dbraw/zinc/83/84/79/1049838479.db2.gz GNPYKHHGKJIARF-FCHUYYIVSA-N 2 0 349.522 4.314 20 0 EIADRP CCCOC1CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171980374 1049838719 /nfs/dbraw/zinc/83/87/19/1049838719.db2.gz DVWSNFQCAGDUHN-HXUWFJFHSA-N 2 0 344.543 4.321 20 0 EIADRP CSC1CC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171986340 1049839836 /nfs/dbraw/zinc/83/98/36/1049839836.db2.gz HOBXSHMDMWGVOT-SFHVURJKSA-N 2 0 332.557 4.257 20 0 EIADRP C[N@H+](CCc1ccncc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172074724 1049845096 /nfs/dbraw/zinc/84/50/96/1049845096.db2.gz LHVISXUEMLNOIP-NUNAXRQHSA-N 2 0 349.522 4.142 20 0 EIADRP CC(C)([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccncc1 ZINC001172077400 1049846058 /nfs/dbraw/zinc/84/60/58/1049846058.db2.gz QXQIDDDCSUOZRJ-DKUWSORSSA-N 2 0 349.522 4.492 20 0 EIADRP c1cc2c(o1)CCN([C@H]1C[C@H]3CCC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC001172081315 1049847937 /nfs/dbraw/zinc/84/79/37/1049847937.db2.gz FERKYOBUOFAEEA-AERCQKQUSA-N 2 0 336.479 4.223 20 0 EIADRP [NH3+]Cc1cccc(N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172065755 1049851273 /nfs/dbraw/zinc/85/12/73/1049851273.db2.gz QIUDNHRGKGWTEN-DKUWSORSSA-N 2 0 335.495 4.143 20 0 EIADRP C[C@@H](Cc1cccs1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245770357 1049853282 /nfs/dbraw/zinc/85/32/82/1049853282.db2.gz XEBGOLFGCFCYGV-FRYIKTPZSA-N 2 0 340.536 4.464 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)c(Cl)c1)C2 ZINC001172105059 1049856394 /nfs/dbraw/zinc/85/63/94/1049856394.db2.gz FSXNUWOIJKQUEQ-BTTYYORXSA-N 2 0 346.824 4.464 20 0 EIADRP CC(C)(C[NH3+])C[NH2+]C1CCC(c2ccc(Br)cc2)CC1 ZINC001246253545 1049861288 /nfs/dbraw/zinc/86/12/88/1049861288.db2.gz ZNFPMIGYFTXPQT-UHFFFAOYSA-N 2 0 339.321 4.050 20 0 EIADRP CC(C)(C)[PH+](CCC[NH2+][C@H]1CCN2C(=O)CC[C@@H]2C1)C(C)(C)C ZINC001172176192 1049863602 /nfs/dbraw/zinc/86/36/02/1049863602.db2.gz UHPDFYPUZUDUPX-JKSUJKDBSA-N 2 0 340.492 4.198 20 0 EIADRP CCC(CC)[NH+]1CCC([NH2+][C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171021620 1049864355 /nfs/dbraw/zinc/86/43/55/1049864355.db2.gz HDVXSWLBBHOISZ-QGZVFWFLSA-N 2 0 334.935 4.440 20 0 EIADRP [NH3+]C1(c2ccccc2)CC[NH+]([C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171024324 1049868292 /nfs/dbraw/zinc/86/82/92/1049868292.db2.gz CKTXNXHQZAKTFY-SFHVURJKSA-N 2 0 340.898 4.147 20 0 EIADRP [NH3+]C1(c2ccccc2)CC[NH+]([C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171024323 1049868370 /nfs/dbraw/zinc/86/83/70/1049868370.db2.gz CKTXNXHQZAKTFY-GOSISDBHSA-N 2 0 340.898 4.147 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H](CC(C)C)c2cccc(F)c2)CC1 ZINC001172246848 1049872389 /nfs/dbraw/zinc/87/23/89/1049872389.db2.gz XBESEDUEWBCENS-HXUWFJFHSA-N 2 0 336.495 4.003 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC001172344323 1049890273 /nfs/dbraw/zinc/89/02/73/1049890273.db2.gz AOXQDIUGAREQQK-BLKABHOGSA-N 2 0 344.543 4.034 20 0 EIADRP CC[C@@H](C)OCC[C@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1C ZINC001172353460 1049892992 /nfs/dbraw/zinc/89/29/92/1049892992.db2.gz XAHPKWRBVBHRPK-DYQZNNLLSA-N 2 0 346.559 4.328 20 0 EIADRP CC(C)OCC[C@H](C)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001172450543 1049914946 /nfs/dbraw/zinc/91/49/46/1049914946.db2.gz ISVVISJCXZMORL-FQEVSTJZSA-N 2 0 344.543 4.178 20 0 EIADRP CC(C)OCC[C@H](C)[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001172459672 1049917677 /nfs/dbraw/zinc/91/76/77/1049917677.db2.gz KPSHRPILUNLAIX-NNWRFLSQSA-N 2 0 344.543 4.034 20 0 EIADRP CCCCCC[C@H](CCCC)[NH+]1CCN(CC[NH+]2CCCC2)CC1 ZINC001172512814 1049927124 /nfs/dbraw/zinc/92/71/24/1049927124.db2.gz UXALXRPQTIOEOI-NRFANRHFSA-N 2 0 337.596 4.229 20 0 EIADRP [NH3+]C1(Cc2ccccc2)CC[NH+]([C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172558556 1049932237 /nfs/dbraw/zinc/93/22/37/1049932237.db2.gz YRDIIVXMMTXTPR-YADHBBJMSA-N 2 0 334.507 4.359 20 0 EIADRP Cc1c[nH+]ccc1N([C@H]1CC[C@@H](c2ccccc2)C1)C1CC[NH2+]CC1 ZINC001172565765 1049935822 /nfs/dbraw/zinc/93/58/22/1049935822.db2.gz MVZZEUKCWGTPRD-CTNGQTDRSA-N 2 0 335.495 4.285 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CCCCC[NH+](C)C ZINC001172576012 1049942471 /nfs/dbraw/zinc/94/24/71/1049942471.db2.gz KYRJCELGWUAJHX-CYBMUJFWSA-N 2 0 332.866 4.261 20 0 EIADRP Cc1c[nH+]ccc1N1CC[NH+]([C@@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172548687 1049947871 /nfs/dbraw/zinc/94/78/71/1049947871.db2.gz HNIGAXJHIFJNKM-NHCUHLMSSA-N 2 0 335.495 4.238 20 0 EIADRP c1ccc(N2CCC(C[NH2+]C3CCC4(CCCC4)CC3)CC2)nc1 ZINC001172724524 1049965848 /nfs/dbraw/zinc/96/58/48/1049965848.db2.gz UGFIOAIDBWNUMA-UHFFFAOYSA-N 2 0 327.516 4.391 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc2c(c1)OCCCO2 ZINC000247007972 1050009728 /nfs/dbraw/zinc/00/97/28/1050009728.db2.gz LBPMRJVUTZSQRU-ZWKOTPCHSA-N 2 0 346.515 4.153 20 0 EIADRP CCc1nc(C)c([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)s1 ZINC000248404245 1050054155 /nfs/dbraw/zinc/05/41/55/1050054155.db2.gz PUNVBVCRHVONDB-YCPHGPKFSA-N 2 0 335.561 4.318 20 0 EIADRP Cc1c([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)cnn1C(C)C ZINC000248679987 1050072191 /nfs/dbraw/zinc/07/21/91/1050072191.db2.gz CLDQIXNBMIJRJN-KURKYZTESA-N 2 0 334.552 4.181 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000249163590 1050093701 /nfs/dbraw/zinc/09/37/01/1050093701.db2.gz ZXQGROWEKLXDSQ-KZNAEPCWSA-N 2 0 340.433 4.219 20 0 EIADRP Cc1nccnc1[C@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000249208291 1050094229 /nfs/dbraw/zinc/09/42/29/1050094229.db2.gz WXTIOXPRGQORKZ-AEFFLSMTSA-N 2 0 338.499 4.010 20 0 EIADRP Clc1cc2c(c(Cl)c1)CC[C@@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000089696004 1050128739 /nfs/dbraw/zinc/12/87/39/1050128739.db2.gz PRPLALUPGOEJQE-DIFFPNOSSA-N 2 0 325.283 4.055 20 0 EIADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC001206297302 1050168593 /nfs/dbraw/zinc/16/85/93/1050168593.db2.gz XOEJTDQWTDNJOQ-JOCHJYFZSA-N 2 0 338.495 4.217 20 0 EIADRP CCO[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC001177256389 1050174716 /nfs/dbraw/zinc/17/47/16/1050174716.db2.gz DYPAKMVNKXKTPW-STZQEDGTSA-N 2 0 344.543 4.356 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2cncc3ccccc32)C1 ZINC001177289662 1050177360 /nfs/dbraw/zinc/17/73/60/1050177360.db2.gz HLYQWRQWYHWYCN-QZTJIDSGSA-N 2 0 325.500 4.083 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C)CC2 ZINC001172843751 1050182286 /nfs/dbraw/zinc/18/22/86/1050182286.db2.gz OKODCFULFVWSGI-FDFHNCONSA-N 2 0 326.528 4.191 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC001172863705 1050200268 /nfs/dbraw/zinc/20/02/68/1050200268.db2.gz ZELFCDGGFCUOPS-HNNXBMFYSA-N 2 0 338.898 4.218 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC001172863706 1050200865 /nfs/dbraw/zinc/20/08/65/1050200865.db2.gz ZELFCDGGFCUOPS-OAHLLOKOSA-N 2 0 338.898 4.218 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](C)CSc2ccc(Cl)cc2)CC1 ZINC001172876270 1050218106 /nfs/dbraw/zinc/21/81/06/1050218106.db2.gz YQFJMRCELPXJER-AWEZNQCLSA-N 2 0 326.937 4.285 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](c2ccc(OC)cc2)C2CC2)c1 ZINC000091333116 1050252074 /nfs/dbraw/zinc/25/20/74/1050252074.db2.gz TYCDJABIEABCAS-JOCHJYFZSA-N 2 0 338.495 4.388 20 0 EIADRP Cc1cc(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)ccc1Cl ZINC001177669166 1050274881 /nfs/dbraw/zinc/27/48/81/1050274881.db2.gz SAIKJPVKBMDQHD-FQEVSTJZSA-N 2 0 342.914 4.303 20 0 EIADRP CCCOC1CCC([NH2+]C2CC[NH+](CC3CCCCC3)CC2)CC1 ZINC001173093373 1050286249 /nfs/dbraw/zinc/28/62/49/1050286249.db2.gz FEFATBBSXKDGOO-UHFFFAOYSA-N 2 0 336.564 4.359 20 0 EIADRP CC[NH+](CC)CCCC[NH2+][C@@H](C)Cc1ccc(OC(F)(F)F)cc1 ZINC001173083246 1050297039 /nfs/dbraw/zinc/29/70/39/1050297039.db2.gz SCSZYUUSAAIUIV-HNNXBMFYSA-N 2 0 346.437 4.228 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2cc(-c3ccccc3)no2)CC1 ZINC001173101353 1050301727 /nfs/dbraw/zinc/30/17/27/1050301727.db2.gz GZZHIBKUYIZSSG-UHFFFAOYSA-N 2 0 327.472 4.084 20 0 EIADRP CCCCN(CCCC)CC[NH2+]C1CCC([NH+](CC)CC)CC1 ZINC001173101639 1050302874 /nfs/dbraw/zinc/30/28/74/1050302874.db2.gz MMJLCUVDGFGFSQ-UHFFFAOYSA-N 2 0 325.585 4.131 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3)c(Cl)c2)C1 ZINC001177795547 1050303035 /nfs/dbraw/zinc/30/30/35/1050303035.db2.gz VPEUZJQTAAUGPX-KRWDZBQOSA-N 2 0 328.887 4.438 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCOc2cccc3ccccc32)CC1 ZINC001173104788 1050304982 /nfs/dbraw/zinc/30/49/82/1050304982.db2.gz VQERPVVZBYSQKH-UHFFFAOYSA-N 2 0 340.511 4.461 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](C)COc2c(C)cccc2C)CC1 ZINC001173104003 1050305282 /nfs/dbraw/zinc/30/52/82/1050305282.db2.gz ZRSKCANSNRRLBU-HDYDNRTBSA-N 2 0 332.532 4.313 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccccc2OC(F)F)CC1 ZINC001173103577 1050305589 /nfs/dbraw/zinc/30/55/89/1050305589.db2.gz MROJVWBVXZVQJE-UHFFFAOYSA-N 2 0 326.431 4.031 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](C)COc2cc(C)cc(C)c2)CC1 ZINC001173102590 1050306035 /nfs/dbraw/zinc/30/60/35/1050306035.db2.gz AMYLZXGRPVMKHL-XEVCZEQESA-N 2 0 332.532 4.313 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2(c3ccccc3F)CCOCC2)CC1 ZINC001173107481 1050307558 /nfs/dbraw/zinc/30/75/58/1050307558.db2.gz TUWLIZKIHXTECR-UHFFFAOYSA-N 2 0 348.506 4.074 20 0 EIADRP CC[NH+](CC)C1CCC([N@H+](C)Cc2nc3ccccc3s2)CC1 ZINC001173110161 1050308307 /nfs/dbraw/zinc/30/83/07/1050308307.db2.gz PTDWPLAWSQOJEF-UHFFFAOYSA-N 2 0 331.529 4.381 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCc2cccc(Cl)c2F)CC1 ZINC001173106752 1050308472 /nfs/dbraw/zinc/30/84/72/1050308472.db2.gz RJBNGNTYZMPVPZ-UHFFFAOYSA-N 2 0 326.887 4.264 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCc3c4ccccc4oc3C2)CC1 ZINC001173112646 1050309556 /nfs/dbraw/zinc/30/95/56/1050309556.db2.gz DARWBNKPHQLXOK-UHFFFAOYSA-N 2 0 326.484 4.444 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@@H]2c2ccc(OC)cc2)CC1 ZINC001173111579 1050309924 /nfs/dbraw/zinc/30/99/24/1050309924.db2.gz HQSSXLTYSJTWNY-GZNCHQMQSA-N 2 0 330.516 4.485 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@@H](OCc3ccccc3)C2)CC1 ZINC001173112953 1050309947 /nfs/dbraw/zinc/30/99/47/1050309947.db2.gz FLCRDDSRQNRHOI-LZBANZJXSA-N 2 0 344.543 4.321 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCO[C@](C)(c3ccc(C)cc3)C2)CC1 ZINC001173114342 1050310894 /nfs/dbraw/zinc/31/08/94/1050310894.db2.gz HGZKEXMBNSFIHV-HRTMPFAESA-N 2 0 344.543 4.195 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC(OC)(c3ccccc3)CC2)CC1 ZINC001173113572 1050311084 /nfs/dbraw/zinc/31/10/84/1050311084.db2.gz VHJFLWALZFPNNG-UHFFFAOYSA-N 2 0 344.543 4.277 20 0 EIADRP CC1CC[NH+](CCC[NH2+]C2CCC(Oc3ccccc3)CC2)CC1 ZINC001173195796 1050340237 /nfs/dbraw/zinc/34/02/37/1050340237.db2.gz YBCQLUHBKSXKNZ-UHFFFAOYSA-N 2 0 330.516 4.088 20 0 EIADRP C[C@H](C[NH2+]C1CCC(Oc2ccccc2)CC1)CC(C)(C)CC[NH3+] ZINC001173199121 1050342403 /nfs/dbraw/zinc/34/24/03/1050342403.db2.gz TWRDUVIUWCCVDZ-ZJRDLVKKSA-N 2 0 332.532 4.367 20 0 EIADRP [NH3+]CCC[C@@H]1CCCC[N@@H+](C2CCC(Oc3ccccc3)CC2)C1 ZINC001173201967 1050345100 /nfs/dbraw/zinc/34/51/00/1050345100.db2.gz KUVONQWGPBJSRA-JSOIOWGOSA-N 2 0 330.516 4.218 20 0 EIADRP CCCC[C@@H](CC(C)C)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC001173255840 1050381854 /nfs/dbraw/zinc/38/18/54/1050381854.db2.gz GVRKVCCOCLPPSD-NRFANRHFSA-N 2 0 331.548 4.488 20 0 EIADRP CCCC[C@@H](CC(C)C)[N@@H+]1CCc2c(CN(C)C)nn(C(C)C)c2C1 ZINC001173263766 1050387169 /nfs/dbraw/zinc/38/71/69/1050387169.db2.gz WWFWKXPTDRBYPD-SFHVURJKSA-N 2 0 348.579 4.489 20 0 EIADRP CCNc1ccccc1C[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC001178280696 1050425588 /nfs/dbraw/zinc/42/55/88/1050425588.db2.gz PDARQOXWANOCOD-UHFFFAOYSA-N 2 0 329.532 4.251 20 0 EIADRP C([NH2+][C@@H]1CCCC2(CCCCC2)C1)C1CC[NH+](C2CCOCC2)CC1 ZINC001173344914 1050434962 /nfs/dbraw/zinc/43/49/62/1050434962.db2.gz PIXUORCFDUDJOW-HXUWFJFHSA-N 2 0 348.575 4.360 20 0 EIADRP CC[N@@H+]1CC[C@H](n2c(C)c(CC[NH3+])c3c2cc(Cl)cc3Cl)C1 ZINC001173354837 1050441578 /nfs/dbraw/zinc/44/15/78/1050441578.db2.gz JVEQMMGNFJCULS-ZDUSSCGKSA-N 2 0 340.298 4.024 20 0 EIADRP CSCc1ccc(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC001178458104 1050474563 /nfs/dbraw/zinc/47/45/63/1050474563.db2.gz PTDPNSDNBIBCTM-VQIMIIECSA-N 2 0 332.557 4.292 20 0 EIADRP COc1ccsc1C[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC001178647522 1050521898 /nfs/dbraw/zinc/52/18/98/1050521898.db2.gz LEGOWJXPAXEFJR-UHFFFAOYSA-N 2 0 344.524 4.278 20 0 EIADRP Cc1cc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)ccc1Oc1ccccc1 ZINC001206209690 1050536501 /nfs/dbraw/zinc/53/65/01/1050536501.db2.gz IBHJEAWSWLQLRE-RBUKOAKNSA-N 2 0 328.431 4.049 20 0 EIADRP CCCCCCOc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC001178741492 1050538908 /nfs/dbraw/zinc/53/89/08/1050538908.db2.gz FLYMLJIXIXVYIV-IHWFROFDSA-N 2 0 330.516 4.361 20 0 EIADRP C[N@@H+](Cc1cccc2[nH]ccc21)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000093337026 1050569935 /nfs/dbraw/zinc/56/99/35/1050569935.db2.gz LVBNOXXXJFINIM-IBGZPJMESA-N 2 0 333.479 4.122 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccccc2N(C)C)c1 ZINC000093944630 1050726210 /nfs/dbraw/zinc/72/62/10/1050726210.db2.gz FNJFWYRTBHWAKF-KRWDZBQOSA-N 2 0 325.500 4.055 20 0 EIADRP CC(C)(C)[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCCCC2)CCO1 ZINC000763533254 1050727927 /nfs/dbraw/zinc/72/79/27/1050727927.db2.gz ZETWSAUIDQAPDU-SFTDATJTSA-N 2 0 344.543 4.356 20 0 EIADRP C[C@@]1(C[N@@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)CCCS1 ZINC001179864190 1050808291 /nfs/dbraw/zinc/80/82/91/1050808291.db2.gz UUAYLZCESMAYMU-LEWJYISDSA-N 2 0 344.568 4.260 20 0 EIADRP CC[N@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)CC1(OC)CCCCC1 ZINC001179947913 1050828835 /nfs/dbraw/zinc/82/88/35/1050828835.db2.gz ZEZSXAKQSKSRFJ-OAQYLSRUSA-N 2 0 344.543 4.180 20 0 EIADRP C[C@H]([NH2+]CCc1cn2c(n1)CCCC2)c1ccc(Cl)c(Cl)c1 ZINC000152754398 1050842824 /nfs/dbraw/zinc/84/28/24/1050842824.db2.gz MFIAXIWZGBYNQN-LBPRGKRZSA-N 2 0 338.282 4.420 20 0 EIADRP c1c(CC[NH2+][C@H](Cc2ccccc2)c2ccccc2)nc2n1CCCC2 ZINC000152752514 1050843355 /nfs/dbraw/zinc/84/33/55/1050843355.db2.gz XNDQEAQJGCHYII-JOCHJYFZSA-N 2 0 345.490 4.336 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](CCCc2ccc(F)c(F)c2)CC1 ZINC001180125013 1050891618 /nfs/dbraw/zinc/89/16/18/1050891618.db2.gz ORBYJSKOHZCJGA-UHFFFAOYSA-N 2 0 338.486 4.341 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](C[C@@H]2CCc3ccccc3C2)CC1 ZINC001180125402 1050891865 /nfs/dbraw/zinc/89/18/65/1050891865.db2.gz YEACTWANRZFUPT-HXUWFJFHSA-N 2 0 328.544 4.235 20 0 EIADRP Cc1cc(C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)cc(C)c1O ZINC001180225162 1050920560 /nfs/dbraw/zinc/92/05/60/1050920560.db2.gz OQAUJZYSHKCFLC-IBGZPJMESA-N 2 0 344.543 4.486 20 0 EIADRP C[C@@H](CCC1CCCCC1)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC001180802466 1051086750 /nfs/dbraw/zinc/08/67/50/1051086750.db2.gz QWLFDKWMGRIRJH-PGRDOPGGSA-N 2 0 344.543 4.092 20 0 EIADRP C[C@@H](CCc1cncc2ccccc21)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC001180809152 1051087878 /nfs/dbraw/zinc/08/78/78/1051087878.db2.gz BDMZYUYXTYLOER-OALUTQOASA-N 2 0 339.527 4.410 20 0 EIADRP COc1cccc(CCC[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c1 ZINC001190317098 1051149059 /nfs/dbraw/zinc/14/90/59/1051149059.db2.gz ASOALABATOZILD-UHFFFAOYSA-N 2 0 344.543 4.216 20 0 EIADRP C(CCC[NH2+][C@@H]1CC[C@H]2SCCS[C@H]12)CCC[NH+]1CCCC1 ZINC000775385089 1051176799 /nfs/dbraw/zinc/17/67/99/1051176799.db2.gz IXZRFYXGVGZKRO-KZNAEPCWSA-N 2 0 342.618 4.002 20 0 EIADRP CC(C)(C)[C@@]1(C[NH2+][C@@H]2CSC2(C)C)CC[N@H+](Cc2ccccc2)C1 ZINC001181204826 1051180745 /nfs/dbraw/zinc/18/07/45/1051180745.db2.gz IMBBSNPNWGJUDA-WIYYLYMNSA-N 2 0 346.584 4.408 20 0 EIADRP C[C@@H](Cc1ccc2c(c1)CCCC2)[NH2+]CCN1CCCC(C)(C)C1 ZINC001181243912 1051182482 /nfs/dbraw/zinc/18/24/82/1051182482.db2.gz LKSDUQXKTLGGSQ-SFHVURJKSA-N 2 0 328.544 4.208 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000775388776 1051187537 /nfs/dbraw/zinc/18/75/37/1051187537.db2.gz TVIZAXSSTPSNNB-GUYCJALGSA-N 2 0 340.483 4.310 20 0 EIADRP CC(C)c1ccc(C[N@@H+]2CCO[C@H](CCC[NH+](C)C)C2)c(C(C)C)c1 ZINC001174933822 1051257128 /nfs/dbraw/zinc/25/71/28/1051257128.db2.gz OWLWOSKBVPOHLJ-OAQYLSRUSA-N 2 0 346.559 4.476 20 0 EIADRP Cc1cc(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)cs1 ZINC001190793110 1051279679 /nfs/dbraw/zinc/27/96/79/1051279679.db2.gz ZRSGTAPEEUQBDL-UHFFFAOYSA-N 2 0 328.525 4.401 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C(C)C)CC2 ZINC000154854277 1051344882 /nfs/dbraw/zinc/34/48/82/1051344882.db2.gz YZIPBRPUWSOBNF-JOCHJYFZSA-N 2 0 338.495 4.313 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cc1 ZINC000154873371 1051347342 /nfs/dbraw/zinc/34/73/42/1051347342.db2.gz UFPRYDRLQIXZSL-QGZVFWFLSA-N 2 0 326.484 4.386 20 0 EIADRP CC[N@@H+]1CCCC[C@H]1C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C ZINC001182001605 1051368896 /nfs/dbraw/zinc/36/88/96/1051368896.db2.gz MGSGDZATHOBDRT-INIZCTEOSA-N 2 0 342.508 4.446 20 0 EIADRP C[C@H]([NH2+]C1CCC(C)([NH+]2CCOCC2)CC1)c1cccc(C2CC2)c1 ZINC001182031934 1051377557 /nfs/dbraw/zinc/37/75/57/1051377557.db2.gz KORVJBCTRNFQRF-YTXWROIDSA-N 2 0 342.527 4.248 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ccc(OC)c(COC)c1 ZINC000268727343 1051386484 /nfs/dbraw/zinc/38/64/84/1051386484.db2.gz KJFQISVVQSIZHC-IRXDYDNUSA-N 2 0 336.520 4.003 20 0 EIADRP c1ccc([C@H]2C[C@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)CCO2)cc1 ZINC000155269280 1051399175 /nfs/dbraw/zinc/39/91/75/1051399175.db2.gz RHVSVJWHKBVIDY-IFMALSPDSA-N 2 0 342.527 4.293 20 0 EIADRP COC1CCC(C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)CC1 ZINC001182196752 1051423909 /nfs/dbraw/zinc/42/39/09/1051423909.db2.gz VYPCYJWRXXRGSQ-NJEKYYFSSA-N 2 0 344.543 4.084 20 0 EIADRP Clc1ccc([C@@H]2CC[C@@H]([NH2+]Cc3ccc4c[nH+]cn4c3)C2)cc1 ZINC001182249672 1051441065 /nfs/dbraw/zinc/44/10/65/1051441065.db2.gz FYTFTULKKNNNBO-SJLPKXTDSA-N 2 0 325.843 4.414 20 0 EIADRP CCc1ccc(C[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)s1 ZINC000156285373 1051516044 /nfs/dbraw/zinc/51/60/44/1051516044.db2.gz XIVDFLQBRZNTQW-HNNXBMFYSA-N 2 0 332.513 4.102 20 0 EIADRP c1[nH]c2ccccc2c1CCC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000156316424 1051518690 /nfs/dbraw/zinc/51/86/90/1051518690.db2.gz GKEPGGAJRXQSJA-UHFFFAOYSA-N 2 0 339.527 4.487 20 0 EIADRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2cc(Cl)ccc2C(F)(F)F)CC1 ZINC001205571021 1051549819 /nfs/dbraw/zinc/54/98/19/1051549819.db2.gz RSJKGHJSRFFWAR-CQSZACIVSA-N 2 0 338.776 4.012 20 0 EIADRP c1cc(Nc2ccc(C[NH+]3CCCCC3)cc2)cc(N2CCCC2)[nH+]1 ZINC001175362643 1051550292 /nfs/dbraw/zinc/55/02/92/1051550292.db2.gz UDMCPFIJMZLZAM-UHFFFAOYSA-N 2 0 336.483 4.411 20 0 EIADRP Cc1csc2sc(C[N@@H+]3CCC[C@@](F)(C[NH3+])CC3)c(C)c12 ZINC001205571608 1051556405 /nfs/dbraw/zinc/55/64/05/1051556405.db2.gz VYEMVODJFJPIQO-INIZCTEOSA-N 2 0 326.506 4.233 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1ccc2cc(OC)ccc2c1 ZINC000163255770 1051558627 /nfs/dbraw/zinc/55/86/27/1051558627.db2.gz FLZBKIBHOAJHLJ-HRAATJIYSA-N 2 0 326.484 4.231 20 0 EIADRP [NH3+]C[C@]1(F)CCCN(Cc2cc(Cl)cc(Cl)c2Cl)CC1 ZINC001205571826 1051558586 /nfs/dbraw/zinc/55/85/86/1051558586.db2.gz YQEVOZBHXNXWIE-AWEZNQCLSA-N 2 0 339.669 4.300 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc2c(c1)OCCCO2 ZINC000157954449 1051687834 /nfs/dbraw/zinc/68/78/34/1051687834.db2.gz CTIPVIOBBJWKRF-MSOLQXFVSA-N 2 0 346.515 4.011 20 0 EIADRP COCC[N@H+](C)CCCC1CC[NH+](Cc2cccc(C(C)C)c2)CC1 ZINC001192324263 1051692659 /nfs/dbraw/zinc/69/26/59/1051692659.db2.gz HXQZKKIXIDPYKP-UHFFFAOYSA-N 2 0 346.559 4.380 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(SCC(F)F)cc1 ZINC000158103227 1051710840 /nfs/dbraw/zinc/71/08/40/1051710840.db2.gz BFFSAQLGOJJYKT-UONOGXRCSA-N 2 0 328.472 4.036 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]C[C@H]3CCC[N@H+](C)C3)cs2)cs1 ZINC000158172875 1051721757 /nfs/dbraw/zinc/72/17/57/1051721757.db2.gz QRAPHEGZORWBNI-TZMCWYRMSA-N 2 0 335.542 4.172 20 0 EIADRP COc1cc(C[N@H+](C)CCCC[NH+]2CCCCC2)ccc1SC ZINC001175687091 1051729771 /nfs/dbraw/zinc/72/97/71/1051729771.db2.gz IXQXSTZQHFSGBG-UHFFFAOYSA-N 2 0 336.545 4.115 20 0 EIADRP C[C@]1(C[NH3+])CCCCN(Cc2cccc(Cl)c2Br)C1 ZINC001206548274 1051754345 /nfs/dbraw/zinc/75/43/45/1051754345.db2.gz IMLMJJOICAKHNY-OAHLLOKOSA-N 2 0 345.712 4.053 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)C1 ZINC000158559672 1051757790 /nfs/dbraw/zinc/75/77/90/1051757790.db2.gz JRJVZSFWPOBSIO-PMACEKPBSA-N 3 0 349.607 4.131 20 0 EIADRP CC[C@H](CSC)[N@H+](C)CCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC001192635004 1051784787 /nfs/dbraw/zinc/78/47/87/1051784787.db2.gz IEJPDYZHJJWUBU-OAQYLSRUSA-N 2 0 348.600 4.405 20 0 EIADRP CC[C@@H](CSC)[N@H+](C)CCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC001192634996 1051785993 /nfs/dbraw/zinc/78/59/93/1051785993.db2.gz IEJPDYZHJJWUBU-NRFANRHFSA-N 2 0 348.600 4.405 20 0 EIADRP COCCC[NH+]1CCC(N[C@H](C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000159082972 1051810714 /nfs/dbraw/zinc/81/07/14/1051810714.db2.gz YMCWTSIPGJNTDX-CYBMUJFWSA-N 2 0 345.314 4.145 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+](Cc1ccc(CC(F)(F)F)cc1)CC2 ZINC001183256846 1051818619 /nfs/dbraw/zinc/81/86/19/1051818619.db2.gz SDONZANAFBUOOT-UHFFFAOYSA-N 2 0 340.433 4.099 20 0 EIADRP CCCc1ccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)s1 ZINC000621370605 1051842388 /nfs/dbraw/zinc/84/23/88/1051842388.db2.gz MZUSIOJFTIAOCB-UHFFFAOYSA-N 2 0 343.540 4.097 20 0 EIADRP C[C@@]12C[NH+](Cc3ccccc3)C[C@@H]1C[N@@H+](CC[C@@H]1CCCC1(F)F)C2 ZINC001175974395 1051856507 /nfs/dbraw/zinc/85/65/07/1051856507.db2.gz UUXHMSUGLUUFPK-SLFFLAALSA-N 2 0 348.481 4.266 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+][C@@H]1CC[C@](C)(c2ccccc2)C1)c1cccnc1 ZINC001183919255 1051927222 /nfs/dbraw/zinc/92/72/22/1051927222.db2.gz HXVPKHKAUOOSPB-FSSWDIPSSA-N 2 0 337.511 4.174 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCOC23CCCCC3)CC1 ZINC001184067499 1051942607 /nfs/dbraw/zinc/94/26/07/1051942607.db2.gz RRXJRILXVFAMII-HOJAQTOUSA-N 2 0 334.548 4.111 20 0 EIADRP CCOc1ccc(CC[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)cc1 ZINC001184143086 1051954634 /nfs/dbraw/zinc/95/46/34/1051954634.db2.gz NTWDKKNXMHLCIX-WIYYLYMNSA-N 2 0 344.543 4.261 20 0 EIADRP c1ccc(C(C[NH+]2CCC([NH2+]C3CCC3)CC2)c2ccccc2)cc1 ZINC001184197437 1051963819 /nfs/dbraw/zinc/96/38/19/1051963819.db2.gz PFFLYZSNCZOZBS-UHFFFAOYSA-N 2 0 334.507 4.425 20 0 EIADRP CC[C@@H]([NH2+]C1CCN(c2ccc(C)cn2)CC1)c1ccc(F)cc1F ZINC000163499819 1051991578 /nfs/dbraw/zinc/99/15/78/1051991578.db2.gz KWVORGMIVPFZJS-LJQANCHMSA-N 2 0 345.437 4.378 20 0 EIADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@H](CCc3ccccc3)Cc3ccccc3)[C@@H]2C1 ZINC001184389482 1052002117 /nfs/dbraw/zinc/00/21/17/1052002117.db2.gz XKFWUXZHWNYIKD-KEZOAJOQSA-N 2 0 348.534 4.160 20 0 EIADRP Cc1ccsc1[C@H](C)[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000165309714 1052058043 /nfs/dbraw/zinc/05/80/43/1052058043.db2.gz DLVLXDIJMLATDM-HKUYNNGSSA-N 2 0 328.525 4.272 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000166070927 1052081363 /nfs/dbraw/zinc/08/13/63/1052081363.db2.gz VWBXYYKZJJVMQK-IFMALSPDSA-N 2 0 338.495 4.006 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1ccc(-c2nc3ccccc3[nH]2)cc1 ZINC000167511223 1052121184 /nfs/dbraw/zinc/12/11/84/1052121184.db2.gz PEXOPKSNMZTDDZ-VWKPWSFCSA-N 2 0 348.494 4.048 20 0 EIADRP CCC[C@H]([NH2+]C[C@H]1CN(Cc2ccccc2)CCCO1)C(C)(C)C ZINC001194426544 1052146882 /nfs/dbraw/zinc/14/68/82/1052146882.db2.gz LBWINWMPIAIAMK-PMACEKPBSA-N 2 0 332.532 4.082 20 0 EIADRP C[N@@H+]1CCC[C@@]2(CC[NH+](CCCOc3cccc(C(C)(C)C)c3)C2)C1 ZINC001194641022 1052184201 /nfs/dbraw/zinc/18/42/01/1052184201.db2.gz LEEWUXXFUFXLRO-JOCHJYFZSA-N 2 0 344.543 4.171 20 0 EIADRP COCc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cc1 ZINC001177127481 1052227979 /nfs/dbraw/zinc/22/79/79/1052227979.db2.gz BOIWAESNLKPHRA-UHFFFAOYSA-N 2 0 338.495 4.109 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cccc(Br)c1 ZINC000171128248 1052396266 /nfs/dbraw/zinc/39/62/66/1052396266.db2.gz HANVSTFWQDTLHP-AWEZNQCLSA-N 2 0 347.300 4.362 20 0 EIADRP CCOc1ccc([C@@H](C)N[C@@H]2CC[N@H+](C)C(C)(C)C2)cc1OCC ZINC000623339360 1052626915 /nfs/dbraw/zinc/62/69/15/1052626915.db2.gz WNGHTURHUOWGAX-NVXWUHKLSA-N 2 0 334.504 4.007 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CN[C@H]2CC[NH+](C)C(C)(C)C2)cc1 ZINC000623357194 1052634358 /nfs/dbraw/zinc/63/43/58/1052634358.db2.gz BZJDZANHKHMQGR-NQIIRXRSSA-N 3 0 343.559 4.023 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623382629 1052640733 /nfs/dbraw/zinc/64/07/33/1052640733.db2.gz NQGYSOUHKZLTGJ-CJNGLKHVSA-N 2 0 328.422 4.099 20 0 EIADRP CC1CC[NH+](Cc2cccc(C[NH2+]Cc3cccc4n[nH]cc43)c2)CC1 ZINC000623403759 1052644928 /nfs/dbraw/zinc/64/49/28/1052644928.db2.gz GRSZVULTPJJWTK-UHFFFAOYSA-N 2 0 348.494 4.085 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1)CC2 ZINC000177977495 1052695708 /nfs/dbraw/zinc/69/57/08/1052695708.db2.gz ORMSKNVXGPHRJA-QFIPXVFZSA-N 2 0 338.495 4.313 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+]C[C@H]2CCCC[N@H+](C)C2)cc1 ZINC000623656266 1052698596 /nfs/dbraw/zinc/69/85/96/1052698596.db2.gz QMZCRKWVRIJEII-LJQANCHMSA-N 2 0 338.495 4.184 20 0 EIADRP C[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccoc1 ZINC000178284371 1052704253 /nfs/dbraw/zinc/70/42/53/1052704253.db2.gz KIKYURUNPPVXTQ-GOSISDBHSA-N 2 0 342.483 4.002 20 0 EIADRP Clc1ccc2c(c1)[C@@H]([NH2+]Cc1ccnn1-c1cc[nH+]cc1)CCC2 ZINC000623751621 1052775169 /nfs/dbraw/zinc/77/51/69/1052775169.db2.gz GOWHAEYISMPPQF-IBGZPJMESA-N 2 0 338.842 4.088 20 0 EIADRP CC[NH+](CC)Cc1cccc(CN[C@@H]2CCCc3scnc32)c1 ZINC000623867324 1052830201 /nfs/dbraw/zinc/83/02/01/1052830201.db2.gz YBNRKUSUSILHAM-QGZVFWFLSA-N 2 0 329.513 4.152 20 0 EIADRP C[C@H]([NH2+]CCSc1ccccc1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185706691 1053021095 /nfs/dbraw/zinc/02/10/95/1053021095.db2.gz JJEFSPWWSXWCRU-HOTGVXAUSA-N 2 0 336.520 4.160 20 0 EIADRP Fc1cc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1Cl ZINC000380910870 1053047559 /nfs/dbraw/zinc/04/75/59/1053047559.db2.gz LQOYBRAFXOJGPH-KRWDZBQOSA-N 2 0 332.850 4.091 20 0 EIADRP CC[N@H+](Cc1cccc(C[NH+]2CCCCC2)c1)[C@@H]1CCOC(C)(C)C1 ZINC001194781834 1053091628 /nfs/dbraw/zinc/09/16/28/1053091628.db2.gz INGGEAXNQHOVSE-OAQYLSRUSA-N 2 0 344.543 4.452 20 0 EIADRP FC1(F)CCCC[C@@H]1C[N@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC000381874506 1053111116 /nfs/dbraw/zinc/11/11/16/1053111116.db2.gz JUQCFDHXBDZFCH-HSALFYBXSA-N 2 0 348.481 4.266 20 0 EIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cc2ccccc2[nH]1 ZINC000775627901 1053225877 /nfs/dbraw/zinc/22/58/77/1053225877.db2.gz ACEGNXWPRMAYHO-INIZCTEOSA-N 2 0 334.467 4.130 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)C1CCCCC1 ZINC000850516957 1053278141 /nfs/dbraw/zinc/27/81/41/1053278141.db2.gz LUEMHWCWZDFXDE-NRFANRHFSA-N 2 0 329.532 4.242 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@@H]2CCOC2(C)C)ccc1OC ZINC000850570786 1053324010 /nfs/dbraw/zinc/32/40/10/1053324010.db2.gz IWTBLYHAACMWCY-LPHOPBHVSA-N 2 0 348.531 4.003 20 0 EIADRP Cc1ccc(F)cc1C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000383507517 1053346365 /nfs/dbraw/zinc/34/63/65/1053346365.db2.gz KMZPZKCAKOAWAU-IEBWSBKVSA-N 2 0 326.459 4.134 20 0 EIADRP CCOc1cccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000794829650 1053441976 /nfs/dbraw/zinc/44/19/76/1053441976.db2.gz VOZNHRGEJZUUDX-UYAOXDASSA-N 2 0 338.495 4.258 20 0 EIADRP CCOc1cccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000794829644 1053442062 /nfs/dbraw/zinc/44/20/62/1053442062.db2.gz VOZNHRGEJZUUDX-AZUAARDMSA-N 2 0 338.495 4.258 20 0 EIADRP Fc1cccc2cc(C[NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)cnc12 ZINC000865405515 1053491531 /nfs/dbraw/zinc/49/15/31/1053491531.db2.gz KUCQLULZUDAVRT-UHFFFAOYSA-N 2 0 349.453 4.260 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cnc(Cl)c(F)c2)c1 ZINC000865417372 1053496841 /nfs/dbraw/zinc/49/68/41/1053496841.db2.gz IKSVFLZJAPARIK-UHFFFAOYSA-N 2 0 335.854 4.006 20 0 EIADRP COc1ccc2c(NC[C@H](c3ccsc3)[NH+](C)C)cc[nH+]c2c1 ZINC000765465277 1053560188 /nfs/dbraw/zinc/56/01/88/1053560188.db2.gz QNHJGMBWWQDTLD-GOSISDBHSA-N 2 0 327.453 4.020 20 0 EIADRP CC(C)c1ncc(C[NH2+]CC2(c3ccccc3)CC[NH+](C)CC2)s1 ZINC000865773662 1053588984 /nfs/dbraw/zinc/58/89/84/1053588984.db2.gz GKPKWTDKWWPZTK-UHFFFAOYSA-N 2 0 343.540 4.020 20 0 EIADRP CC(C)[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C(C)C)c1ccccn1 ZINC000866231827 1053658790 /nfs/dbraw/zinc/65/87/90/1053658790.db2.gz AQJMBHBIRKOZEW-OAQYLSRUSA-N 2 0 325.500 4.409 20 0 EIADRP CC(C)[C@@H]([NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1)c1ccccn1 ZINC000866247032 1053662164 /nfs/dbraw/zinc/66/21/64/1053662164.db2.gz QHTYVMMTLAXZDL-OAQYLSRUSA-N 2 0 325.500 4.409 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H](CCc2ccccc2)c2ccccn2)CC1 ZINC000866259463 1053667318 /nfs/dbraw/zinc/66/73/18/1053667318.db2.gz MPUOITCVXOJGTP-JOCHJYFZSA-N 2 0 337.511 4.077 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(OC)cc1 ZINC000386441172 1053728200 /nfs/dbraw/zinc/72/82/00/1053728200.db2.gz PULPQTXNCZANRX-UGKGYDQZSA-N 2 0 338.495 4.258 20 0 EIADRP FC(F)(F)c1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000386455771 1053732033 /nfs/dbraw/zinc/73/20/33/1053732033.db2.gz RYUZVZIOURDVMB-SFHVURJKSA-N 2 0 348.412 4.317 20 0 EIADRP C[C@H]([NH2+]CCC1CC[NH+](Cc2ccccc2)CC1)c1cscn1 ZINC000866468829 1053740640 /nfs/dbraw/zinc/74/06/40/1053740640.db2.gz DJQWTPCOFIIZFT-INIZCTEOSA-N 2 0 329.513 4.096 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)cc1 ZINC000866516576 1053764226 /nfs/dbraw/zinc/76/42/26/1053764226.db2.gz CSFNXNIYFYROCC-VMDYBPHESA-N 2 0 330.516 4.040 20 0 EIADRP COc1cc([C@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)ccc1SC ZINC000866515654 1053764850 /nfs/dbraw/zinc/76/48/50/1053764850.db2.gz GJMANVXATXXBHJ-ASFAAARLSA-N 2 0 336.545 4.331 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccnc(Cl)c1 ZINC000123041713 1054084342 /nfs/dbraw/zinc/08/43/42/1054084342.db2.gz VDLHMUHDUAKBBF-HNNXBMFYSA-N 2 0 329.875 4.182 20 0 EIADRP CC(C)[N@H+](C)Cc1cc(O[C@H]2CC[NH+](CCCC(C)(C)C)C2)ccn1 ZINC000856604483 1054091824 /nfs/dbraw/zinc/09/18/24/1054091824.db2.gz NZYAQMLBJOIJSM-FQEVSTJZSA-N 2 0 347.547 4.201 20 0 EIADRP CC[C@@H](CCC(F)(F)F)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000872066304 1054375289 /nfs/dbraw/zinc/37/52/89/1054375289.db2.gz GWMCKXHFCUYFPH-SJORKVTESA-N 2 0 328.422 4.219 20 0 EIADRP CCO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)C1 ZINC001199265875 1054377001 /nfs/dbraw/zinc/37/70/01/1054377001.db2.gz FANKTOINVGYHLA-VLCRHTCISA-N 2 0 344.543 4.498 20 0 EIADRP Clc1ccc2c(n1)[C@H]([NH2+]C1CCC([NH+]3CCCCC3)CC1)CC2 ZINC000857906653 1054381605 /nfs/dbraw/zinc/38/16/05/1054381605.db2.gz FQASJMRRXTYBDA-OFLPRAFFSA-N 2 0 333.907 4.109 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+][C@@H]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC001199321084 1054392694 /nfs/dbraw/zinc/39/26/94/1054392694.db2.gz UYJZZTKBYDONBH-SNRWMIJCSA-N 2 0 344.543 4.210 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2ccc(CC(F)(F)F)cc2)CC1 ZINC001199329198 1054392752 /nfs/dbraw/zinc/39/27/52/1054392752.db2.gz PMSAWIUTAZKXEA-UHFFFAOYSA-N 2 0 342.449 4.393 20 0 EIADRP CN(C)c1ccncc1C[NH2+]CC1(c2ccc(F)cc2)CCCCC1 ZINC001199751348 1054462502 /nfs/dbraw/zinc/46/25/02/1054462502.db2.gz PEEOXFNFJRYAPA-UHFFFAOYSA-N 2 0 341.474 4.278 20 0 EIADRP COc1ccc(CC[C@H](C)[NH2+]CC(C)(C)[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC001199760309 1054464274 /nfs/dbraw/zinc/46/42/74/1054464274.db2.gz PSZOPWJJRUCZSB-FHWLQOOXSA-N 2 0 346.559 4.362 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cccc2ncccc12 ZINC000873009706 1054477589 /nfs/dbraw/zinc/47/75/89/1054477589.db2.gz SDXRCOPYOVLUGF-UHFFFAOYSA-N 2 0 333.479 4.366 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1cccc2ncccc12 ZINC000873012329 1054477647 /nfs/dbraw/zinc/47/76/47/1054477647.db2.gz QMHWBDXGQKGKAF-UHFFFAOYSA-N 2 0 333.479 4.365 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CC[C@@H](C)[C@H](C)C3)CC2)cc1 ZINC001199883531 1054491039 /nfs/dbraw/zinc/49/10/39/1054491039.db2.gz JTHYCUMYQDIHCM-DBXWQHBBSA-N 2 0 344.543 4.322 20 0 EIADRP CS[C@H]1CCC[C@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)C1 ZINC001199883256 1054491186 /nfs/dbraw/zinc/49/11/86/1054491186.db2.gz HSTZIYCBNTXBLS-IRXDYDNUSA-N 2 0 338.586 4.224 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CC(C)(C)C[C@H]3C)CC2)cc1 ZINC001199883387 1054491261 /nfs/dbraw/zinc/49/12/61/1054491261.db2.gz JATRSYMPUHYAAI-UTKZUKDTSA-N 2 0 344.543 4.322 20 0 EIADRP [NH3+][C@@H](C[C@@H]1CCC[N@H+](Cc2cnc(C3CC3)s2)C1)C1CCCC1 ZINC000873232528 1054511019 /nfs/dbraw/zinc/51/10/19/1054511019.db2.gz SDZZWXWQRPDLKB-KSSFIOAISA-N 2 0 333.545 4.140 20 0 EIADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000873249600 1054514387 /nfs/dbraw/zinc/51/43/87/1054514387.db2.gz BFYDZOASPCSQLG-IEAZIUSSSA-N 2 0 326.406 4.059 20 0 EIADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)C1 ZINC000873256688 1054518224 /nfs/dbraw/zinc/51/82/24/1054518224.db2.gz OTVWISKPCACGMF-KCPJHIHWSA-N 2 0 347.915 4.168 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873271774 1054519558 /nfs/dbraw/zinc/51/95/58/1054519558.db2.gz LARJONVFBVMMNO-QWHCGFSZSA-N 2 0 347.503 4.296 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccc(SCC(F)F)cc1 ZINC000873271922 1054520153 /nfs/dbraw/zinc/52/01/53/1054520153.db2.gz MGCQVBRNYZJGLG-OLZOCXBDSA-N 2 0 328.472 4.083 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(OC)c(OC)c2)c1 ZINC000173387735 1054557514 /nfs/dbraw/zinc/55/75/14/1054557514.db2.gz CIUHDTVTKQXEAV-INIZCTEOSA-N 2 0 342.483 4.006 20 0 EIADRP C[N@H+](CCC[NH2+]Cc1cccc(C(F)(F)F)c1)Cc1ccccc1 ZINC000061556847 1054762362 /nfs/dbraw/zinc/76/23/62/1054762362.db2.gz UDHGTSKAJMDLKQ-UHFFFAOYSA-N 2 0 336.401 4.317 20 0 EIADRP COc1cccc(C[NH+]2CCC3(CC2)CC[NH+](CC(C)(C)C)CC3)c1 ZINC001201434373 1054808598 /nfs/dbraw/zinc/80/85/98/1054808598.db2.gz ITEAYIJJFCZTBE-UHFFFAOYSA-N 2 0 344.543 4.419 20 0 EIADRP Cc1c(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)ccnc1F ZINC000862270939 1055041000 /nfs/dbraw/zinc/04/10/00/1055041000.db2.gz AMSVKXUJQVLLHH-INIZCTEOSA-N 2 0 341.474 4.051 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CS1 ZINC000877546917 1055076421 /nfs/dbraw/zinc/07/64/21/1055076421.db2.gz NPUPSUNBSGIMEB-VJNRDTIXSA-N 2 0 330.541 4.056 20 0 EIADRP C[NH+](C)[C@H]1CCCC[C@@H]1Nc1ccc2c(c1)C[N@@H+](Cc1ccccc1)C2 ZINC001168600887 1055101340 /nfs/dbraw/zinc/10/13/40/1055101340.db2.gz HOMUDHIEDHZFRE-GOTSBHOMSA-N 2 0 349.522 4.487 20 0 EIADRP COc1ccc(CC[C@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000119148309 1055121947 /nfs/dbraw/zinc/12/19/47/1055121947.db2.gz DKXSCJPQAQVQKD-KRWDZBQOSA-N 2 0 330.516 4.013 20 0 EIADRP C[C@H]([NH2+]Cc1nc2c(s1)CCCC2)c1cccc(-n2ccnc2)c1 ZINC000776367156 1055223745 /nfs/dbraw/zinc/22/37/45/1055223745.db2.gz YZQZTBXYYGNTBA-AWEZNQCLSA-N 2 0 338.480 4.058 20 0 EIADRP Cc1c(Cl)c(C[NH+]2CCC(CC[NH+](C)C)CC2)nc2ccccc12 ZINC000056523591 1055877505 /nfs/dbraw/zinc/87/75/05/1055877505.db2.gz BZKMABFDAYEMTO-UHFFFAOYSA-N 2 0 345.918 4.360 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)C1CCC(C(F)(F)F)CC1 ZINC000474600229 1055922534 /nfs/dbraw/zinc/92/25/34/1055922534.db2.gz GWIKZVMTOBZFPB-WLYUNCDWSA-N 2 0 332.454 4.350 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@H]2CC3c4ccccc4C2c2ccccc23)C1 ZINC000656193726 1056692280 /nfs/dbraw/zinc/69/22/80/1056692280.db2.gz QMNHHEIZZGCSKS-LINZTHPZSA-N 2 0 332.491 4.143 20 0 EIADRP CSc1ccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000062426732 1056724272 /nfs/dbraw/zinc/72/42/72/1056724272.db2.gz KJRBCKLMSDCTHQ-HXUWFJFHSA-N 2 0 340.536 4.410 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cccc3cnccc32)C1 ZINC000183201045 1059949731 /nfs/dbraw/zinc/94/97/31/1059949731.db2.gz TWOMJUITTMQFJZ-RTBURBONSA-N 2 0 337.511 4.321 20 0 EIADRP Fc1ccc2c(c1)[C@H]([NH2+]C1CCC([NH+]3CCCCC3)CC1)CCCO2 ZINC000766514478 1060469954 /nfs/dbraw/zinc/46/99/54/1060469954.db2.gz XJBQBWMJRMJIPT-AFMYVXGZSA-N 2 0 346.490 4.426 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1ccc(F)cc1N(C)C ZINC000766514507 1060473187 /nfs/dbraw/zinc/47/31/87/1060473187.db2.gz XXGFFJSIOSGPTO-IPJUCJBFSA-N 2 0 347.522 4.339 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1(c3ccccc3C(F)(F)F)CCC1)C2 ZINC001169109312 1060658785 /nfs/dbraw/zinc/65/87/85/1060658785.db2.gz AMUNRFDXAIFHRZ-QKDCVEJESA-N 2 0 338.417 4.299 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc(C(C)(C)C)c2)[C@@H](C)C1 ZINC001169555160 1060856553 /nfs/dbraw/zinc/85/65/53/1060856553.db2.gz NQRBEKGDIJDOAC-RXVVDRJESA-N 2 0 346.559 4.211 20 0 EIADRP CC1(C)CC[N@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CCS1 ZINC001169871919 1061014983 /nfs/dbraw/zinc/01/49/83/1061014983.db2.gz DNFIIZQNXAPJNB-UHFFFAOYSA-N 2 0 332.557 4.390 20 0 EIADRP CC(C)(C)C[N@H+](Cc1ccccc1C(F)(F)F)C1CC[NH2+]CC1 ZINC000036093128 202315019 /nfs/dbraw/zinc/31/50/19/202315019.db2.gz NYTKHXFTKWNXNT-UHFFFAOYSA-N 2 0 328.422 4.306 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cc(F)c(F)c(F)c1 ZINC000067946123 520759265 /nfs/dbraw/zinc/75/92/65/520759265.db2.gz ZBSBGRYWTJIOKZ-UHFFFAOYSA-N 2 0 336.401 4.236 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc3c(c2)CC(C)(C)O3)C1 ZINC000729678963 1032128361 /nfs/dbraw/zinc/12/83/61/1032128361.db2.gz YIUYZORGKRSIDT-QGZVFWFLSA-N 2 0 330.516 4.002 20 0 EIADRP C[C@H](c1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)cc1)C(F)(F)F ZINC000450265887 1032386389 /nfs/dbraw/zinc/38/63/89/1032386389.db2.gz LTZCAIYRIKIZFZ-CQSZACIVSA-N 2 0 328.422 4.126 20 0 EIADRP C[C@@H](Cc1ccc(Cl)cc1)[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC001168152286 1032406394 /nfs/dbraw/zinc/40/63/94/1032406394.db2.gz OCRXZNDDFAKPPJ-INIZCTEOSA-N 2 0 346.902 4.001 20 0 EIADRP FC1(F)CC(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)C1 ZINC000450451538 1032508934 /nfs/dbraw/zinc/50/89/34/1032508934.db2.gz HWCBVUCYSLUPBZ-IBGZPJMESA-N 2 0 334.454 4.020 20 0 EIADRP CCC[N@H+](CCC(C)(C)C)C1CCN(c2cc(C)nc(C)n2)CC1 ZINC000533380829 1032701451 /nfs/dbraw/zinc/70/14/51/1032701451.db2.gz GSDFYIRKZBKILK-UHFFFAOYSA-N 2 0 332.536 4.210 20 0 EIADRP CCc1nocc1C[NH2+]CC1(CC)CC[NH+](Cc2ccccc2)CC1 ZINC000339322173 1018786402 /nfs/dbraw/zinc/78/64/02/1018786402.db2.gz VPUHLJTVARRUBP-UHFFFAOYSA-N 2 0 341.499 4.019 20 0 EIADRP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccc(-c4ccc(F)cc4)s3)C2)C1 ZINC000430144600 1018844902 /nfs/dbraw/zinc/84/49/02/1018844902.db2.gz CCLDXDNBNLTLPO-LJQANCHMSA-N 2 0 330.472 4.082 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+]C2(c3ccc(Cl)cc3)CC2)cc1 ZINC000069878610 1019710220 /nfs/dbraw/zinc/71/02/20/1019710220.db2.gz SAQPEVPIYKGUTJ-UHFFFAOYSA-N 2 0 344.886 4.059 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1ccc(Cl)cn1 ZINC000274928806 1019867610 /nfs/dbraw/zinc/86/76/10/1019867610.db2.gz QKRPMVDXCBDSCF-HNNXBMFYSA-N 2 0 331.891 4.426 20 0 EIADRP CCCC[NH+]1CCC([NH2+]C/C(C)=C\c2ccccc2COC)CC1 ZINC000510208063 1020455438 /nfs/dbraw/zinc/45/54/38/1020455438.db2.gz FPSIQKJMNYBANT-SDXDJHTJSA-N 2 0 330.516 4.090 20 0 EIADRP CCCC[NH+]1CCC([NH2+]C/C(C)=C/c2ccccc2COC)CC1 ZINC000510208062 1020456267 /nfs/dbraw/zinc/45/62/67/1020456267.db2.gz FPSIQKJMNYBANT-OBGWFSINSA-N 2 0 330.516 4.090 20 0 EIADRP CC(C)n1ccc(C[C@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)n1 ZINC000543993053 1020944212 /nfs/dbraw/zinc/94/42/12/1020944212.db2.gz SRGFQMDQNGKURV-SFHVURJKSA-N 2 0 342.531 4.025 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000655804785 1020972616 /nfs/dbraw/zinc/97/26/16/1020972616.db2.gz BLJNHRGXQSCYHH-DQLDELGASA-N 2 0 344.449 4.178 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@H]2[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1 ZINC000655805179 1020972816 /nfs/dbraw/zinc/97/28/16/1020972816.db2.gz KBUAMTBNQHKRAW-AGKXRFJRSA-N 2 0 330.516 4.040 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655806183 1020975916 /nfs/dbraw/zinc/97/59/16/1020975916.db2.gz QRCOGRZSAYMOJK-YUELXQCFSA-N 2 0 347.503 4.248 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@H]2C[C@@H]3[C@H](C2)C3(F)F)CC1 ZINC001167307625 1021003113 /nfs/dbraw/zinc/00/31/13/1021003113.db2.gz ZHPPXFDOCRJVQA-ACDBMABISA-N 2 0 348.481 4.122 20 0 EIADRP C[C@@H](NCc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1ccncc1F ZINC000340469444 1021072926 /nfs/dbraw/zinc/07/29/26/1021072926.db2.gz JRMTVAAEYVEIHA-IAGOWNOFSA-N 2 0 341.474 4.303 20 0 EIADRP COc1ccc(C(C)C)cc1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC001167322494 1021094361 /nfs/dbraw/zinc/09/43/61/1021094361.db2.gz WLKDEHCTGDEPOB-UHFFFAOYSA-N 2 0 332.532 4.371 20 0 EIADRP Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000683693642 1021103928 /nfs/dbraw/zinc/10/39/28/1021103928.db2.gz JMCXFBHOWNUIRW-YOEHRIQHSA-N 2 0 328.422 4.308 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1nc(Br)cs1 ZINC000834487864 1021671046 /nfs/dbraw/zinc/67/10/46/1021671046.db2.gz PFHGUCBPLUQSGE-VXGBXAGGSA-N 2 0 348.354 4.067 20 0 EIADRP CC[NH+](CC)Cc1ccc(NC(=O)CC[N@H+](C)C2CCCCC2)cc1 ZINC000548064088 1021671341 /nfs/dbraw/zinc/67/13/41/1021671341.db2.gz SOSNWKUEHSQBJZ-UHFFFAOYSA-N 2 0 345.531 4.122 20 0 EIADRP Fc1ccc(CC[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000685845600 1021711839 /nfs/dbraw/zinc/71/18/39/1021711839.db2.gz CFXDXEQRMMONLO-KRWDZBQOSA-N 2 0 346.877 4.133 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccc3cnccc3c2)C1 ZINC000683827230 1021723930 /nfs/dbraw/zinc/72/39/30/1021723930.db2.gz ADAVNNOGCLNGDG-UYAOXDASSA-N 2 0 337.511 4.321 20 0 EIADRP C[N@@H+](Cc1ccc2cnccc2c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000683830923 1021747833 /nfs/dbraw/zinc/74/78/33/1021747833.db2.gz ZNVJAAIGYURHSZ-OAQYLSRUSA-N 2 0 345.490 4.189 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1cccc(C[NH+](C)C)c1 ZINC000924566496 1021748449 /nfs/dbraw/zinc/74/84/49/1021748449.db2.gz DQYNFDKPJZUVGP-CQSZACIVSA-N 2 0 334.410 4.200 20 0 EIADRP C[C@H](c1cccc2ccccc21)[NH+]1CCC([C@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000580294958 1021827434 /nfs/dbraw/zinc/82/74/34/1021827434.db2.gz BTLCMYNLDKGBJS-URZJWIJPSA-N 2 0 338.495 4.119 20 0 EIADRP c1c2ccccc2[nH]c1C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000683926953 1021990687 /nfs/dbraw/zinc/99/06/87/1021990687.db2.gz CDYQQPJLVGTYRF-UHFFFAOYSA-N 2 0 333.479 4.444 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000398053771 1022051412 /nfs/dbraw/zinc/05/14/12/1022051412.db2.gz YTONRPZHVFJZJR-QRWLVFNGSA-N 2 0 346.877 4.479 20 0 EIADRP Cc1cc(Cl)c2c(c1)[C@H]([NH2+]Cc1ccc3c[nH+]cn3c1)CCCO2 ZINC000414198050 1022113984 /nfs/dbraw/zinc/11/39/84/1022113984.db2.gz YAYRBUQVIGBONE-GOSISDBHSA-N 2 0 341.842 4.300 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cccc(Cl)c1 ZINC000069645310 1022144744 /nfs/dbraw/zinc/14/47/44/1022144744.db2.gz OMCZAZSLZKXWRW-OAHLLOKOSA-N 2 0 332.875 4.131 20 0 EIADRP Clc1cccc2c1SCC[C@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447555106 1033032331 /nfs/dbraw/zinc/03/23/31/1033032331.db2.gz BVPXPGNZXWMDHT-QGZVFWFLSA-N 2 0 336.932 4.341 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccccc2OC(F)F)CC1 ZINC000613491086 1022155684 /nfs/dbraw/zinc/15/56/84/1022155684.db2.gz FCDXGIGFBGYSCH-UHFFFAOYSA-N 2 0 340.458 4.232 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](CCOc2ccccc2Cl)CC1 ZINC000613491618 1022166324 /nfs/dbraw/zinc/16/63/24/1022166324.db2.gz ZIZFPWGOFJJAKM-UHFFFAOYSA-N 2 0 338.923 4.163 20 0 EIADRP FC(F)(F)c1cccc(C2([NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)CCC2)c1 ZINC000245925492 1033038804 /nfs/dbraw/zinc/03/88/04/1033038804.db2.gz SCHWLBLEPDEOJM-IRXDYDNUSA-N 2 0 338.417 4.301 20 0 EIADRP COc1ccsc1[C@@H](C)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000471597219 1022248218 /nfs/dbraw/zinc/24/82/18/1022248218.db2.gz NOMQGQAOQACUAC-KLAILNCOSA-N 2 0 336.545 4.450 20 0 EIADRP CCC[NH+]1CCC(C[NH2+]Cc2cccc(OC3CCCC3)c2)CC1 ZINC000518777837 1022504805 /nfs/dbraw/zinc/50/48/05/1022504805.db2.gz ZSKASCJCHYVPSV-UHFFFAOYSA-N 2 0 330.516 4.220 20 0 EIADRP Cc1nn(C(C)C)c(C)c1C[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000893188699 1022607473 /nfs/dbraw/zinc/60/74/73/1022607473.db2.gz HQEDEDYCANHWGX-UHFFFAOYSA-N 2 0 346.563 4.214 20 0 EIADRP C[C@@]1(C[NH2+]Cc2cccc3[nH]ccc32)CC[N@H+](Cc2ccccc2)C1 ZINC000310940638 1022680853 /nfs/dbraw/zinc/68/08/53/1022680853.db2.gz WAPMIJIMYZVXIW-QFIPXVFZSA-N 2 0 333.479 4.170 20 0 EIADRP Cc1cc(F)ccc1-c1ccc(C[N@H+]2CCCC23CC[NH+](C)CC3)o1 ZINC000472594124 1022706569 /nfs/dbraw/zinc/70/65/69/1022706569.db2.gz AIKGOAWZKIJCBQ-UHFFFAOYSA-N 2 0 342.458 4.454 20 0 EIADRP c1nc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)sc1-c1ccccc1 ZINC000647542748 1022780074 /nfs/dbraw/zinc/78/00/74/1022780074.db2.gz BJFDCXQURDSEQC-ZWKOTPCHSA-N 2 0 341.524 4.022 20 0 EIADRP Brc1ccc([C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C2CC2)cc1 ZINC000378431634 1022817408 /nfs/dbraw/zinc/81/74/08/1022817408.db2.gz ODKQNFPVEZOZLG-RCCFBDPRSA-N 2 0 349.316 4.117 20 0 EIADRP COc1ccccc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000311058167 1022818945 /nfs/dbraw/zinc/81/89/45/1022818945.db2.gz WIHIIKPSQURYFO-AZUAARDMSA-N 2 0 338.495 4.258 20 0 EIADRP COc1ccccc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000311058173 1022819238 /nfs/dbraw/zinc/81/92/38/1022819238.db2.gz WIHIIKPSQURYFO-UYAOXDASSA-N 2 0 338.495 4.258 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000511551380 1022827469 /nfs/dbraw/zinc/82/74/69/1022827469.db2.gz DOFVSUQXMFVQAB-SDXDJHTJSA-N 2 0 342.527 4.233 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)C[C@H](C)O1 ZINC000581231724 1022892535 /nfs/dbraw/zinc/89/25/35/1022892535.db2.gz GVIPEHBNXGJLGA-RMFSNUHRSA-N 2 0 330.516 4.108 20 0 EIADRP Cn1ccnc1C[C@H]([NH2+]C1CC(C)(c2ccccc2)C1)c1ccccc1 ZINC000656503610 1023075041 /nfs/dbraw/zinc/07/50/41/1023075041.db2.gz QKSVEFGFTANNQN-QKDPSFTKSA-N 2 0 345.490 4.414 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1OC(F)F)c1cccc(C[NH+](C)C)c1 ZINC000924591800 1023126381 /nfs/dbraw/zinc/12/63/81/1023126381.db2.gz KKVXFQRHWPSEAX-AWEZNQCLSA-N 2 0 334.410 4.200 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](CC)c2cccc(F)c2)[C@@H](C)C1 ZINC000188019242 1023132818 /nfs/dbraw/zinc/13/28/18/1023132818.db2.gz ZJIIEAWNBLZGIC-VDGAXYAQSA-N 2 0 336.495 4.003 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417338815 1023272405 /nfs/dbraw/zinc/27/24/05/1023272405.db2.gz ZFWHXMSZUDDDLK-OJAHFUOMSA-N 2 0 340.536 4.352 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H](C)c2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC000188143617 1023293370 /nfs/dbraw/zinc/29/33/70/1023293370.db2.gz XENCLJLFTDPAAX-CPUCHLNUSA-N 2 0 328.422 4.129 20 0 EIADRP CC[N@H+](CCC1CC[NH+](C[C@H]2CCC3(CCCC3)O2)CC1)CC1CC1 ZINC000549136810 1023363348 /nfs/dbraw/zinc/36/33/48/1023363348.db2.gz YUDPKQXWGVKNRQ-OAQYLSRUSA-N 2 0 348.575 4.312 20 0 EIADRP Cc1cc(C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)cnc1F ZINC000892750913 1023366484 /nfs/dbraw/zinc/36/64/84/1023366484.db2.gz YFHNDYBHCDAVRF-UHFFFAOYSA-N 2 0 341.474 4.195 20 0 EIADRP Clc1csc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000309697142 1023399703 /nfs/dbraw/zinc/39/97/03/1023399703.db2.gz FINUGCRLXFDSGC-INIZCTEOSA-N 2 0 334.916 4.403 20 0 EIADRP CC(C)COc1cccc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)c1 ZINC000415052442 1023410111 /nfs/dbraw/zinc/41/01/11/1023410111.db2.gz LFQSFEICJBGBJL-OAQYLSRUSA-N 2 0 326.484 4.291 20 0 EIADRP Cc1cc(Br)ccc1C[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415059016 1023410576 /nfs/dbraw/zinc/41/05/76/1023410576.db2.gz UJYXPASUSJUVJO-GOSISDBHSA-N 2 0 347.300 4.327 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cc(Br)cs1)c1ccccc1 ZINC000415067453 1023415006 /nfs/dbraw/zinc/41/50/06/1023415006.db2.gz PIMPFYNRVGAKAA-OAHLLOKOSA-N 2 0 339.302 4.080 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000415082778 1023431584 /nfs/dbraw/zinc/43/15/84/1023431584.db2.gz OVJHQYXCWCQMHB-ZBFHGGJFSA-N 2 0 329.513 4.077 20 0 EIADRP Clc1ccccc1OCc1ccccc1C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000415082950 1023432738 /nfs/dbraw/zinc/43/27/38/1023432738.db2.gz PEQKJPKBSOANAG-GOSISDBHSA-N 2 0 344.886 4.151 20 0 EIADRP Brc1ccc([C@@H]([NH2+][C@@H]2CCC[NH2+]CC2)C2CCC2)cc1 ZINC000415090354 1023435823 /nfs/dbraw/zinc/43/58/23/1023435823.db2.gz ZBMXOSARXIWCHD-SJORKVTESA-N 2 0 337.305 4.022 20 0 EIADRP COc1ccc([C@H]([NH2+]CC2CC[NH2+]CC2)c2ccccc2Cl)cc1 ZINC000415095226 1023441043 /nfs/dbraw/zinc/44/10/43/1023441043.db2.gz YYTZWIRAPHQSKL-FQEVSTJZSA-N 2 0 344.886 4.027 20 0 EIADRP CN1CC[C@@H]([NH2+]CC(C)(C)Oc2ccccc2)C[C@H]1c1ccccc1 ZINC000581621798 1023441297 /nfs/dbraw/zinc/44/12/97/1023441297.db2.gz HGAOZWZIEBGCFV-CTNGQTDRSA-N 2 0 338.495 4.269 20 0 EIADRP [NH3+]C1CCC([NH2+]C[C@@H]2CC3c4ccccc4C2c2ccccc23)CC1 ZINC000415111545 1023445276 /nfs/dbraw/zinc/44/52/76/1023445276.db2.gz RBWVMQGJRBLIFH-KBZVZAMTSA-N 2 0 332.491 4.143 20 0 EIADRP c1ccc2c(c1)C1C[C@H](C[NH2+][C@@H]3CCC[NH2+]CC3)C2c2ccccc21 ZINC000415110159 1023448342 /nfs/dbraw/zinc/44/83/42/1023448342.db2.gz QDUXIUBJNUNLBT-TWVWUCKLSA-N 2 0 332.491 4.015 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1)c1ccc(C(F)(F)F)cc1 ZINC000415114453 1023448735 /nfs/dbraw/zinc/44/87/35/1023448735.db2.gz XTPASHBJPWWOON-NKGKWGDASA-N 2 0 340.433 4.319 20 0 EIADRP C[C@H](c1cccc2ccccc21)[NH+]1CCC([C@@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000580294959 1023453239 /nfs/dbraw/zinc/45/32/39/1023453239.db2.gz BTLCMYNLDKGBJS-XGRCMKMKSA-N 2 0 338.495 4.119 20 0 EIADRP CC[C@@H](c1ccc(Br)cc1)[N@H+](C)C[C@H]1CCCN(C)C1 ZINC000472737618 1023475826 /nfs/dbraw/zinc/47/58/26/1023475826.db2.gz KLPBVDSFEFTOMX-YOEHRIQHSA-N 2 0 339.321 4.174 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]C1CCC2(CCCO2)CC1 ZINC000581641958 1023475857 /nfs/dbraw/zinc/47/58/57/1023475857.db2.gz QNUPIJZBGGADIX-UHFFFAOYSA-N 2 0 330.516 4.110 20 0 EIADRP C[C@@H](C[N@H+](C)C[C@@H]1CCC[NH+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500078114 1023491536 /nfs/dbraw/zinc/49/15/36/1023491536.db2.gz ZUTLUDNOUHBORZ-LSDHHAIUSA-N 2 0 328.422 4.083 20 0 EIADRP CC(C)c1ccc(-c2ncc(CN(C)C3CC[NH2+]CC3)s2)cc1 ZINC000430627027 1023495904 /nfs/dbraw/zinc/49/59/04/1023495904.db2.gz LTKWRHHSDXQMAX-UHFFFAOYSA-N 2 0 329.513 4.117 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ccc(-n2ccnc2)cc1 ZINC000120152105 1023502131 /nfs/dbraw/zinc/50/21/31/1023502131.db2.gz SUQDTGIAZZTQOI-QZTJIDSGSA-N 2 0 328.504 4.033 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(-n2ccnc2)cc1 ZINC000120151832 1023502807 /nfs/dbraw/zinc/50/28/07/1023502807.db2.gz SUQDTGIAZZTQOI-MSOLQXFVSA-N 2 0 328.504 4.033 20 0 EIADRP CCC[N@H+](C)C[C@H]1CC[NH+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500125069 1023513819 /nfs/dbraw/zinc/51/38/19/1023513819.db2.gz OZSFSCZNMILEBA-JKSUJKDBSA-N 2 0 342.449 4.473 20 0 EIADRP CCC[N@H+](C)C[C@@H]1CC[NH+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500125066 1023514219 /nfs/dbraw/zinc/51/42/19/1023514219.db2.gz OZSFSCZNMILEBA-CVEARBPZSA-N 2 0 342.449 4.473 20 0 EIADRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCC[N@H+](Cc3cccc(C4CCCC4)c3)C2)C1 ZINC000656786430 1023532951 /nfs/dbraw/zinc/53/29/51/1023532951.db2.gz MNUMTVRDIVJSBK-BDTNDASRSA-N 2 0 342.527 4.063 20 0 EIADRP COc1ccsc1[C@H](C)[NH2+]C[C@H]1CC[N@H+](C)[C@@H]1c1ccccc1 ZINC000364312266 1023605013 /nfs/dbraw/zinc/60/50/13/1023605013.db2.gz BTBQEGLLVHVWBE-YXJHDRRASA-N 2 0 330.497 4.100 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCCCC1(F)F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000394556598 1023607040 /nfs/dbraw/zinc/60/70/40/1023607040.db2.gz IXSPKLHYOKXVBD-YTQUADARSA-N 2 0 336.470 4.312 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCCOc3cc4c(cc32)CCCC4)cc1 ZINC000581825087 1023736804 /nfs/dbraw/zinc/73/68/04/1023736804.db2.gz YMWDTJHKOYBDHW-NRFANRHFSA-N 2 0 336.479 4.028 20 0 EIADRP CC[C@H](CC(F)F)C[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C)s2)C1 ZINC000660496211 1023869244 /nfs/dbraw/zinc/86/92/44/1023869244.db2.gz FSTHSQXEIAAZCJ-CVEARBPZSA-N 2 0 344.515 4.492 20 0 EIADRP c1ccc(CN2CC[C@H]([NH2+]CCC[C@@H]3CCCCO3)CC23CC3)cc1 ZINC000647201803 1023884961 /nfs/dbraw/zinc/88/49/61/1023884961.db2.gz ANVBJSKPENWUDH-SFTDATJTSA-N 2 0 342.527 4.123 20 0 EIADRP FC(F)(F)[C@@H]1CCCC[C@@H]1[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000131044759 1023939900 /nfs/dbraw/zinc/93/99/00/1023939900.db2.gz WIEREYJCQXRWES-SJORKVTESA-N 2 0 332.454 4.494 20 0 EIADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCCN(Cc2cccs2)C1 ZINC000510719951 1024314068 /nfs/dbraw/zinc/31/40/68/1024314068.db2.gz KMJLHEZDTASOJB-LNLFQRSKSA-N 2 0 338.536 4.468 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000510735628 1024372131 /nfs/dbraw/zinc/37/21/31/1024372131.db2.gz ONUHUSMTAVQWHW-OLMNPRSZSA-N 2 0 340.433 4.243 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CCN(C)[C@H](C)C1 ZINC000510737089 1024379460 /nfs/dbraw/zinc/37/94/60/1024379460.db2.gz RVTIFRMEUHRMFC-CKEIUWERSA-N 2 0 328.422 4.099 20 0 EIADRP C[C@H]([NH2+]C1(c2ccc(C(F)(F)F)cc2)CC1)C1CC[NH+](C)CC1 ZINC000652329631 1024614793 /nfs/dbraw/zinc/61/47/93/1024614793.db2.gz BVECMFSXNAAKMG-ZDUSSCGKSA-N 2 0 326.406 4.014 20 0 EIADRP COCc1ccnc(NC2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC000652331136 1024625871 /nfs/dbraw/zinc/62/58/71/1024625871.db2.gz ZDSRFHIAVSCMNJ-UHFFFAOYSA-N 2 0 339.483 4.083 20 0 EIADRP Fc1cc2c(c(F)c1)CC[C@@H]2[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000684556849 1024657719 /nfs/dbraw/zinc/65/77/19/1024657719.db2.gz CRAJJJLTJLUNBK-KKSFZXQISA-N 2 0 342.433 4.064 20 0 EIADRP Oc1cccc2c(NCc3cccc(C[NH+]4CCCC4)c3)cc[nH+]c12 ZINC000684569308 1024810933 /nfs/dbraw/zinc/81/09/33/1024810933.db2.gz SUMBNFSRQWLTRL-UHFFFAOYSA-N 2 0 333.435 4.148 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(c2cc[nH+]c3c(O)cccc23)C1 ZINC000684575019 1024828196 /nfs/dbraw/zinc/82/81/96/1024828196.db2.gz IZRMWAWKYAIKLM-IAGOWNOFSA-N 2 0 339.483 4.031 20 0 EIADRP CS[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)C(C)(C)C ZINC000548486108 1024836202 /nfs/dbraw/zinc/83/62/02/1024836202.db2.gz NUSRTGGYACPLJY-YTQUADARSA-N 2 0 334.573 4.264 20 0 EIADRP CC[C@@H](C)[C@H](C)[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000341980424 1025019503 /nfs/dbraw/zinc/01/95/03/1025019503.db2.gz QGAYTACBDVALBY-MOPGFXCFSA-N 2 0 332.532 4.082 20 0 EIADRP C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662295627 1025045804 /nfs/dbraw/zinc/04/58/04/1025045804.db2.gz VYYDMTBTTWHOLV-APWZRJJASA-N 2 0 339.483 4.114 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2coc(-c3ccc(Cl)cc3)n2)[C@@H]1CCC[NH3+] ZINC000662312729 1025063242 /nfs/dbraw/zinc/06/32/42/1025063242.db2.gz CLUIEJBAVYGYLD-RDTXWAMCSA-N 2 0 347.890 4.334 20 0 EIADRP CC[NH+](CC)CCOC1CC[NH+]([C@@H](C)c2ccccc2Cl)CC1 ZINC000342084237 1025153817 /nfs/dbraw/zinc/15/38/17/1025153817.db2.gz BBUNNMOLOJFGFL-INIZCTEOSA-N 2 0 338.923 4.224 20 0 EIADRP c1cc(OCC[NH+]2CCCC2)ccc1C[NH+](C1CCC1)C1CCC1 ZINC000644843173 1025345271 /nfs/dbraw/zinc/34/52/71/1025345271.db2.gz ZHAVCKOJMYZADP-UHFFFAOYSA-N 2 0 328.500 4.068 20 0 EIADRP c1ccc2c(c1)[nH]c1c2CCC[C@H]1[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663466120 1025390655 /nfs/dbraw/zinc/39/06/55/1025390655.db2.gz OGPKONRAAXYPMH-DYESRHJHSA-N 2 0 337.511 4.257 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]C1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 ZINC000643458774 1025556023 /nfs/dbraw/zinc/55/60/23/1025556023.db2.gz ZWUNBTARHTUDAG-VWYCJHECSA-N 2 0 334.348 4.003 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000156750937 1025600923 /nfs/dbraw/zinc/60/09/23/1025600923.db2.gz KONLRZOCZDDPFA-SJORKVTESA-N 2 0 330.516 4.184 20 0 EIADRP Cc1cc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cs1 ZINC000390838346 1025616221 /nfs/dbraw/zinc/61/62/21/1025616221.db2.gz AWZUNWJQGIBPAJ-IHWFROFDSA-N 2 0 326.509 4.342 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(Oc2cccc(F)c2)CC1 ZINC001167827829 1025672903 /nfs/dbraw/zinc/67/29/03/1025672903.db2.gz YBULMZPDMDFJGO-KRWDZBQOSA-N 2 0 336.495 4.179 20 0 EIADRP Clc1ccccc1C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1cccs1 ZINC000643535905 1025727119 /nfs/dbraw/zinc/72/71/19/1025727119.db2.gz KXIQXVSGZIDLLJ-FUHWJXTLSA-N 2 0 346.927 4.417 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cc(COC)cs1 ZINC000657296229 1025745910 /nfs/dbraw/zinc/74/59/10/1025745910.db2.gz DBPIKKYYZHNATK-UHFFFAOYSA-N 2 0 332.513 4.026 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000415010693 1025824586 /nfs/dbraw/zinc/82/45/86/1025824586.db2.gz GPEIWXWSJJBFFU-XOKHGSTOSA-N 2 0 328.422 4.449 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@H](OCc2ccccc2)C1 ZINC001167837909 1025849889 /nfs/dbraw/zinc/84/98/89/1025849889.db2.gz NSONGBWXQUSDOW-FPOVZHCZSA-N 2 0 332.532 4.178 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@@H](OCc2ccccc2)C1 ZINC001167837911 1025850388 /nfs/dbraw/zinc/85/03/88/1025850388.db2.gz NSONGBWXQUSDOW-TZIWHRDSSA-N 2 0 332.532 4.178 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+]Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000415023766 1025857570 /nfs/dbraw/zinc/85/75/70/1025857570.db2.gz NOZXJOJVTFVAAG-NSHDSACASA-N 2 0 343.418 4.046 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC2(CCc3ccccc3O2)CC1 ZINC001167840077 1025857662 /nfs/dbraw/zinc/85/76/62/1025857662.db2.gz DOBYXNFOCDQEGL-LJQANCHMSA-N 2 0 344.543 4.357 20 0 EIADRP Clc1cccc2c1CC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167968284 1025893093 /nfs/dbraw/zinc/89/30/93/1025893093.db2.gz ORNUMDWIBACICN-KOLWVEQXSA-N 2 0 330.903 4.322 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)c1ccc(Oc2cccnc2)cc1 ZINC000344090901 1025999667 /nfs/dbraw/zinc/99/96/67/1025999667.db2.gz JPIJOTDWBMGIDZ-WMZOPIPTSA-N 2 0 325.456 4.009 20 0 EIADRP [NH3+][C@H]1CCc2c3ccccc3n(C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)c2C1 ZINC001167969833 1026030918 /nfs/dbraw/zinc/03/09/18/1026030918.db2.gz FRZCUZAOTXHITM-HTUJPFKRSA-N 2 0 349.522 4.035 20 0 EIADRP c1cc2c(o1)CCC[NH+](CCCCC[N@@H+]1CCCc3occc3C1)C2 ZINC000344240468 1026171235 /nfs/dbraw/zinc/17/12/35/1026171235.db2.gz CCGZRZAGSXKGKJ-UHFFFAOYSA-N 2 0 342.483 4.240 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC([C@H](F)c2ccccc2F)CC1 ZINC000511075253 1026188169 /nfs/dbraw/zinc/18/81/69/1026188169.db2.gz RGDCFJQBNDXMSG-XLIONFOSSA-N 2 0 336.470 4.423 20 0 EIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3cccc4cccnc43)C2)CC1 ZINC000512177109 1026234677 /nfs/dbraw/zinc/23/46/77/1026234677.db2.gz FBOXIQKXCAHMEX-IBGZPJMESA-N 2 0 337.511 4.179 20 0 EIADRP Fc1cccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C2CC2)c1 ZINC001167975357 1026253742 /nfs/dbraw/zinc/25/37/42/1026253742.db2.gz NULPOPBQMBSAJM-OTYNDTSQSA-N 2 0 328.475 4.272 20 0 EIADRP Fc1cccc(CC2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)c1 ZINC001167978164 1026343808 /nfs/dbraw/zinc/34/38/08/1026343808.db2.gz LFHKEGNRRDMQJB-SEJPIABJSA-N 2 0 342.502 4.143 20 0 EIADRP Clc1ccc([C@H]2C[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167982176 1026387981 /nfs/dbraw/zinc/38/79/81/1026387981.db2.gz ZLDWSDAWESBIHG-NOSIKRSBSA-N 2 0 330.903 4.191 20 0 EIADRP Fc1cc(-c2ccncc2)ccc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000550266709 1026448402 /nfs/dbraw/zinc/44/84/02/1026448402.db2.gz ZWLBXXGQRPKPGJ-UHFFFAOYSA-N 2 0 341.474 4.243 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000582328345 1026454617 /nfs/dbraw/zinc/45/46/17/1026454617.db2.gz VBLBLQNFEDQMQK-WBVHZDCISA-N 2 0 342.449 4.346 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cccc(OC)c2OC(C)C)CC1 ZINC000506885000 1026486894 /nfs/dbraw/zinc/48/68/94/1026486894.db2.gz NYHAXDWCUHYKLM-UHFFFAOYSA-N 2 0 348.531 4.036 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(OC(C)C)c(OC)c2)CC1 ZINC000506926679 1026526024 /nfs/dbraw/zinc/52/60/24/1026526024.db2.gz FORHPZRJVVHJLH-UHFFFAOYSA-N 2 0 348.531 4.036 20 0 EIADRP CC(C)(C)c1ccc(-c2ccc(NC(=[NH2+])NCCCC[NH3+])cc2)cc1 ZINC001167879563 1026558443 /nfs/dbraw/zinc/55/84/43/1026558443.db2.gz XMOMPKGQCXQJQS-UHFFFAOYSA-N 2 0 338.499 4.326 20 0 EIADRP Fc1ccc(C[N@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)cc1F ZINC000432671164 1026714076 /nfs/dbraw/zinc/71/40/76/1026714076.db2.gz PQQIMJPZIOOJHG-SFHVURJKSA-N 2 0 348.462 4.171 20 0 EIADRP COc1ccccc1[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)C1CCCC1 ZINC000507424020 1026789542 /nfs/dbraw/zinc/78/95/42/1026789542.db2.gz SPSGYNKQEWYCOC-HXUWFJFHSA-N 2 0 330.516 4.248 20 0 EIADRP c1cnc2c(c1)CCC[C@H]2[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000684953382 1026887680 /nfs/dbraw/zinc/88/76/80/1026887680.db2.gz FVHHUHSWWLVAHI-OAQYLSRUSA-N 2 0 335.495 4.235 20 0 EIADRP C1=CC2(CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)c2ccccc21 ZINC001167987102 1026888328 /nfs/dbraw/zinc/88/83/28/1026888328.db2.gz KJUMRRYZORPKAN-CBQGHPETSA-N 2 0 348.534 4.452 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)[C@@H](C)C1 ZINC000342810182 1027093296 /nfs/dbraw/zinc/09/32/96/1027093296.db2.gz PDDILRIQBHIENG-LLGFUMIMSA-N 2 0 330.516 4.074 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)C1CCSCC1 ZINC000474481215 1027116791 /nfs/dbraw/zinc/11/67/91/1027116791.db2.gz XBOMAEPZBSJEEF-QGZVFWFLSA-N 2 0 332.557 4.294 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000474481611 1027117615 /nfs/dbraw/zinc/11/76/15/1027117615.db2.gz YJTDCRICZLBETR-OTWHNJEPSA-N 2 0 332.532 4.289 20 0 EIADRP Cc1cc(Cl)cc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000657612588 1027284710 /nfs/dbraw/zinc/28/47/10/1027284710.db2.gz ANUBAIOSCCKUBH-UHFFFAOYSA-N 2 0 343.902 4.045 20 0 EIADRP c1cc(C[NH+]2CCC(C[NH2+]C3CCC4(CCCC4)CC3)CC2)ccn1 ZINC000657613475 1027290840 /nfs/dbraw/zinc/29/08/40/1027290840.db2.gz KXKUSXDCDIRJIQ-UHFFFAOYSA-N 2 0 341.543 4.386 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccccc1OC(F)(F)F ZINC000520206071 1027313684 /nfs/dbraw/zinc/31/36/84/1027313684.db2.gz VFAQCTYPZOWCSD-OAHLLOKOSA-N 2 0 344.421 4.329 20 0 EIADRP C[C@@H]1CC([N@@H+]2CCc3ccccc3C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168039976 1027352474 /nfs/dbraw/zinc/35/24/74/1027352474.db2.gz JEZKLHMOMIMYEP-RTBURBONSA-N 2 0 334.507 4.486 20 0 EIADRP Cc1ccc(C[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)o1 ZINC000520247408 1027360167 /nfs/dbraw/zinc/36/01/67/1027360167.db2.gz IQISBLSTNYDFLY-UHFFFAOYSA-N 2 0 340.511 4.413 20 0 EIADRP CC(C)C[C@H](C[NH2+]CC1(N2CCCC2)CCOCC1)c1ccccc1 ZINC000474722806 1027441385 /nfs/dbraw/zinc/44/13/85/1027441385.db2.gz MPHFRTSQUMEUMW-OAQYLSRUSA-N 2 0 344.543 4.051 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474814766 1027537348 /nfs/dbraw/zinc/53/73/48/1027537348.db2.gz DPGHMMAIHRQAML-VYDRJRHOSA-N 2 0 326.937 4.356 20 0 EIADRP c1ccc(CC[C@@H]2CCC[C@@H]2[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000475548675 1027585815 /nfs/dbraw/zinc/58/58/15/1027585815.db2.gz NHTDLEWMVKHETP-SAZYNNDCSA-N 2 0 326.528 4.394 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1cncs1 ZINC000121045974 1027659335 /nfs/dbraw/zinc/65/93/35/1027659335.db2.gz NXTCJCGPUISBJW-MRXNPFEDSA-N 2 0 329.513 4.226 20 0 EIADRP CC(C)O[C@@H](C[NH+]1CCC(Nc2ccccn2)CC1)c1ccccc1 ZINC000582941084 1027722414 /nfs/dbraw/zinc/72/24/14/1027722414.db2.gz HZDSMLXJAHKUEK-FQEVSTJZSA-N 2 0 339.483 4.124 20 0 EIADRP CSc1ccc(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)s1 ZINC000583053837 1027909477 /nfs/dbraw/zinc/90/94/77/1027909477.db2.gz XMZJYULVDVTIDD-UHFFFAOYSA-N 2 0 332.538 4.356 20 0 EIADRP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+]CCC1CC[NH+](C)CC1 ZINC000583077053 1027960705 /nfs/dbraw/zinc/96/07/05/1027960705.db2.gz WJBPYNMVZWIODK-QINSGFPZSA-N 2 0 340.433 4.430 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000188657842 1028013245 /nfs/dbraw/zinc/01/32/45/1028013245.db2.gz FWUYJXWUEOMHOY-CPUCHLNUSA-N 2 0 340.433 4.055 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2oc(C(C)C)nc2C)CC1)CC1CC1 ZINC000428311493 1028044340 /nfs/dbraw/zinc/04/43/40/1028044340.db2.gz RAXAUFXBTOLBGI-UHFFFAOYSA-N 2 0 347.547 4.440 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC000346132380 1028272599 /nfs/dbraw/zinc/27/25/99/1028272599.db2.gz BWYYVVKMKXQPBB-FQEVSTJZSA-N 2 0 346.478 4.030 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](Cc1ccccc1)C(C)(C)C ZINC000346146248 1028281018 /nfs/dbraw/zinc/28/10/18/1028281018.db2.gz HUXAJRUUEIAIIM-UHFFFAOYSA-N 2 0 334.467 4.376 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)Cc1ccc2ccccc2c1 ZINC000346170767 1028303952 /nfs/dbraw/zinc/30/39/52/1028303952.db2.gz JUWRNMFLNLQIHV-UHFFFAOYSA-N 2 0 342.446 4.361 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1C[C@H](c2ccccc2C)C[C@H]1C ZINC000346197002 1028322547 /nfs/dbraw/zinc/32/25/47/1028322547.db2.gz DCWIQCSVWHXZCT-IEBWSBKVSA-N 2 0 346.478 4.262 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCCCC[C@H]1c1ccco1 ZINC000346205021 1028329478 /nfs/dbraw/zinc/32/94/78/1028329478.db2.gz QAKRBTJUXGIRQL-IBGZPJMESA-N 2 0 336.439 4.286 20 0 EIADRP COc1cc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)ccc1SC ZINC000125918318 1028496586 /nfs/dbraw/zinc/49/65/86/1028496586.db2.gz DHNDXJXUWVLVFG-HOTGVXAUSA-N 2 0 336.545 4.188 20 0 EIADRP c1cc2c(cccc2C[N@@H+]2C[C@H]3CC[NH+](Cc4ccccc4)C[C@H]3C2)[nH]1 ZINC000583423336 1028715729 /nfs/dbraw/zinc/71/57/29/1028715729.db2.gz FEADJNLCWBKOGV-CTNGQTDRSA-N 2 0 345.490 4.122 20 0 EIADRP c1cc2c(cccc2C[N@@H+]2C[C@@H]3CC[NH+](Cc4ccccc4)C[C@H]3C2)[nH]1 ZINC000583423337 1028717023 /nfs/dbraw/zinc/71/70/23/1028717023.db2.gz FEADJNLCWBKOGV-FPOVZHCZSA-N 2 0 345.490 4.122 20 0 EIADRP CC(C)O[C@H](C[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1 ZINC000428325950 1028884985 /nfs/dbraw/zinc/88/49/85/1028884985.db2.gz OMVAWMLDOVTIHS-KAGYGMCKSA-N 2 0 344.543 4.395 20 0 EIADRP COCCC[C@@H]([NH2+]C1CC[NH+](CC(C)C)CC1)c1ccc(F)cc1 ZINC000281929862 1028973841 /nfs/dbraw/zinc/97/38/41/1028973841.db2.gz KICPIFRHHMOXSH-HXUWFJFHSA-N 2 0 336.495 4.003 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1nccc2ccccc21 ZINC000583686088 1029038510 /nfs/dbraw/zinc/03/85/10/1029038510.db2.gz MLCNGRUKQIIWEU-GOSISDBHSA-N 2 0 325.500 4.398 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)CC1 ZINC000650744984 1029074280 /nfs/dbraw/zinc/07/42/80/1029074280.db2.gz ZJFUHZHERGQMQJ-OAHLLOKOSA-N 2 0 345.487 4.045 20 0 EIADRP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650753776 1029159272 /nfs/dbraw/zinc/15/92/72/1029159272.db2.gz VMJYNJOCWPRXFQ-LLVKDONJSA-N 2 0 335.492 4.198 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650754192 1029168568 /nfs/dbraw/zinc/16/85/68/1029168568.db2.gz CTROUEAOZNYEEG-HXUWFJFHSA-N 2 0 342.458 4.411 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]Cc2ccccc2C[NH2+]C)cc1 ZINC000650756034 1029182191 /nfs/dbraw/zinc/18/21/91/1029182191.db2.gz SAMNUBKMCIJHIY-KRWDZBQOSA-N 2 0 326.484 4.436 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCCOc2c(Cl)cccc21 ZINC000650758429 1029212432 /nfs/dbraw/zinc/21/24/32/1029212432.db2.gz PIRCLXQTWBKCJU-GOSISDBHSA-N 2 0 330.859 4.063 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CCSCc2cccc3ccccc32)CC[N@@H+]1C ZINC000151159313 1029218969 /nfs/dbraw/zinc/21/89/69/1029218969.db2.gz QMXJVMOVDKUQIQ-VQIMIIECSA-N 2 0 328.525 4.145 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H]1CCCOc2ccc(Cl)cc21 ZINC000650758856 1029224392 /nfs/dbraw/zinc/22/43/92/1029224392.db2.gz ZEECXFARUBXHFJ-SFHVURJKSA-N 2 0 330.859 4.063 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1ccccc1Br ZINC000650759795 1029229910 /nfs/dbraw/zinc/22/99/10/1029229910.db2.gz QGYXVGFEHKEAEW-ZDUSSCGKSA-N 2 0 333.273 4.019 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CCC1CC[NH2+]CC1 ZINC000650763954 1029278133 /nfs/dbraw/zinc/27/81/33/1029278133.db2.gz MWHIVTOBDONVNG-CYBMUJFWSA-N 2 0 347.503 4.298 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)CCS2 ZINC000343471351 1029319264 /nfs/dbraw/zinc/31/92/64/1029319264.db2.gz TUFFXURMILMSDW-WMZOPIPTSA-N 2 0 336.545 4.188 20 0 EIADRP CC(C)CC[NH+]1CCC([NH2+][C@@H]2CCO[C@H](c3cccs3)C2)CC1 ZINC000926536924 1029325430 /nfs/dbraw/zinc/32/54/30/1029325430.db2.gz INYXHSYBUGPLMC-MSOLQXFVSA-N 2 0 336.545 4.068 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCCc3occc32)cc1 ZINC000192682784 1029361615 /nfs/dbraw/zinc/36/16/15/1029361615.db2.gz UEBSSHDGUJJDTJ-HXUWFJFHSA-N 2 0 342.483 4.167 20 0 EIADRP c1ccc(CC(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)Cc2ccccc2)cc1 ZINC000562200281 1029362329 /nfs/dbraw/zinc/36/23/29/1029362329.db2.gz CPMUCCNELPYRDZ-QFIPXVFZSA-N 2 0 348.534 4.162 20 0 EIADRP CC(C)(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)CS1 ZINC000475291257 1029504835 /nfs/dbraw/zinc/50/48/35/1029504835.db2.gz NRATXTNUWIULCC-FHWLQOOXSA-N 2 0 332.557 4.018 20 0 EIADRP CCCC[C@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)c1ccc(F)cc1 ZINC000133028545 1029543473 /nfs/dbraw/zinc/54/34/73/1029543473.db2.gz KGEINMZDFLTEKZ-UTKZUKDTSA-N 2 0 348.506 4.148 20 0 EIADRP C[C@@H]([NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1)C1C(C)(C)C1(C)C ZINC000475355000 1029571850 /nfs/dbraw/zinc/57/18/50/1029571850.db2.gz UILRYSULPRYBRG-LRVUVFPRSA-N 2 0 346.481 4.452 20 0 EIADRP CCO[C@H](C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1)c1ccccc1 ZINC000446852780 1029602968 /nfs/dbraw/zinc/60/29/68/1029602968.db2.gz QWVCEESGFMOVEZ-STZQEDGTSA-N 2 0 344.543 4.397 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cc2cnccc2o1 ZINC000657828245 1029623902 /nfs/dbraw/zinc/62/39/02/1029623902.db2.gz QEMNUSRNDJXMFD-MRXNPFEDSA-N 2 0 335.451 4.274 20 0 EIADRP Cc1c(F)cccc1-c1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)o1 ZINC000446885654 1029632082 /nfs/dbraw/zinc/63/20/82/1029632082.db2.gz APVDKQQOTZERDM-UHFFFAOYSA-N 2 0 342.458 4.358 20 0 EIADRP Fc1ccc(C2CC([NH2+]C[C@@H]3CC[N@H+](Cc4ccccc4)C3)C2)cc1 ZINC000192929907 1029648125 /nfs/dbraw/zinc/64/81/25/1029648125.db2.gz KSZQKISOYVJIOZ-NLMOZGTASA-N 2 0 338.470 4.183 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000447025847 1029666724 /nfs/dbraw/zinc/66/67/24/1029666724.db2.gz FDHGICDVWZXNTI-CYBMUJFWSA-N 2 0 326.406 4.230 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1cc2ccncc2s1 ZINC000657838296 1029728740 /nfs/dbraw/zinc/72/87/40/1029728740.db2.gz QNIMILYZHITDBU-INIZCTEOSA-N 2 0 331.529 4.459 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cc2ccncc2s1 ZINC000657837991 1029733410 /nfs/dbraw/zinc/73/34/10/1029733410.db2.gz LTXXPTONJRQIOW-JKSUJKDBSA-N 2 0 331.529 4.459 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNCc1ccccc1Cl ZINC000708519856 1029743241 /nfs/dbraw/zinc/74/32/41/1029743241.db2.gz KCVXAEZIGVYGHM-QFBILLFUSA-N 2 0 328.887 4.198 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1CNCc1ccccc1Cl ZINC000708519851 1029743432 /nfs/dbraw/zinc/74/34/32/1029743432.db2.gz KCVXAEZIGVYGHM-APWZRJJASA-N 2 0 328.887 4.198 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(Br)c(Cl)c2)C1 ZINC000657840430 1029747196 /nfs/dbraw/zinc/74/71/96/1029747196.db2.gz GHSFFXIHYYXJAN-VXGBXAGGSA-N 2 0 345.712 4.095 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000708525631 1029812744 /nfs/dbraw/zinc/81/27/44/1029812744.db2.gz WTWGNUQRWUBCHO-CRAIPNDOSA-N 2 0 346.877 4.337 20 0 EIADRP C[C@H]([NH2+][C@H]1c2ccccc2C[C@@H]1C)c1ccc(OCC[NH+](C)C)cc1 ZINC000089613784 1029851018 /nfs/dbraw/zinc/85/10/18/1029851018.db2.gz CDQUDJXWYJOLAG-PNLZDCPESA-N 2 0 338.495 4.211 20 0 EIADRP C[N@@H+]1CC[C@H](C[NH2+]C/C=C/c2ccc(F)c(F)c2)[C@H]1c1cccs1 ZINC000375752047 1029859972 /nfs/dbraw/zinc/85/99/72/1029859972.db2.gz YWUBBPJFJMGRDR-WYLRSBHASA-N 2 0 348.462 4.322 20 0 EIADRP CC(C)[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C(C)C)c1cccnc1 ZINC000091285232 1029882274 /nfs/dbraw/zinc/88/22/74/1029882274.db2.gz SDUTVYCMARHVRD-NRFANRHFSA-N 2 0 325.500 4.409 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCSc2ccccc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183183535 1029988602 /nfs/dbraw/zinc/98/86/02/1029988602.db2.gz UDTWLPJFSYPALN-JTDSTZFVSA-N 2 0 330.541 4.466 20 0 EIADRP Cc1ccc(C)c([C@@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)c1 ZINC000392266644 1030080487 /nfs/dbraw/zinc/08/04/87/1030080487.db2.gz OQQNUZCYDRYQMX-CVDCTZTESA-N 2 0 334.507 4.467 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1OCC ZINC000447570763 1030154941 /nfs/dbraw/zinc/15/49/41/1030154941.db2.gz VKGAMLMKQJOJDB-INIZCTEOSA-N 2 0 346.515 4.009 20 0 EIADRP Clc1cc2c(c(Cl)c1)[C@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CC2 ZINC000447574509 1030161518 /nfs/dbraw/zinc/16/15/18/1030161518.db2.gz VSTOZOZNKTYVGS-QGZVFWFLSA-N 2 0 339.310 4.445 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccccc1OC(F)F ZINC000447582808 1030182010 /nfs/dbraw/zinc/18/20/10/1030182010.db2.gz YMFSKJCVYUMSLW-QGZVFWFLSA-N 2 0 338.442 4.203 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(C(F)F)nc1 ZINC000657884147 1030185605 /nfs/dbraw/zinc/18/56/05/1030185605.db2.gz LCHJYOFIJHZSIO-GFCCVEGCSA-N 2 0 337.389 4.071 20 0 EIADRP OC1CC[NH+](Cc2ccccc2C[NH2+]CCC2CCCCCC2)CC1 ZINC000685425368 1030302661 /nfs/dbraw/zinc/30/26/61/1030302661.db2.gz QOTWNPQRNXIRFG-UHFFFAOYSA-N 2 0 344.543 4.093 20 0 EIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C1CC(CF)(CF)C1 ZINC000657890855 1030334910 /nfs/dbraw/zinc/33/49/10/1030334910.db2.gz SMMHNBGQTQGQRG-UHFFFAOYSA-N 2 0 348.437 4.089 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2nc3c(s2)CCC3)CC1)CC(C)C ZINC000685462596 1030343577 /nfs/dbraw/zinc/34/35/77/1030343577.db2.gz BSVLXSPDJUBWCL-UHFFFAOYSA-N 2 0 349.588 4.212 20 0 EIADRP CSCC1CCC([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000708573362 1030396999 /nfs/dbraw/zinc/39/69/99/1030396999.db2.gz IWENDDZNZUOBEN-AFVILVPDSA-N 2 0 346.584 4.266 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1cc2ccncc2s1 ZINC000657899386 1030410583 /nfs/dbraw/zinc/41/05/83/1030410583.db2.gz AGLZUSOGHOCNCM-CQSZACIVSA-N 2 0 329.513 4.354 20 0 EIADRP Cc1nccn1CCCCN1C[C@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000189494603 1030472653 /nfs/dbraw/zinc/47/26/53/1030472653.db2.gz NIYCUVXXUYJCJW-HNAYVOBHSA-N 2 0 347.890 4.087 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3ccc(F)c(F)c3)CC2)C1 ZINC000527291164 1030614846 /nfs/dbraw/zinc/61/48/46/1030614846.db2.gz RAZJNCDDQSBPLZ-QAPCUYQASA-N 2 0 336.470 4.140 20 0 EIADRP COC[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cccc(Cl)c1 ZINC000685645166 1030615509 /nfs/dbraw/zinc/61/55/09/1030615509.db2.gz KLIOHYXLUTZTLB-QFBILLFUSA-N 2 0 338.923 4.129 20 0 EIADRP CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000527349639 1030641479 /nfs/dbraw/zinc/64/14/79/1030641479.db2.gz PVYVVBGCFVMPMX-JQHSSLGASA-N 2 0 342.449 4.464 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000398133007 1030714293 /nfs/dbraw/zinc/71/42/93/1030714293.db2.gz KDLIBUYHNUNNGB-LAUBAEHRSA-N 2 0 333.479 4.168 20 0 EIADRP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000658027978 1030775185 /nfs/dbraw/zinc/77/51/85/1030775185.db2.gz BHTOSNKYBKKERI-CSNJMZFVSA-N 2 0 340.433 4.241 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CC(C)(C)Cc2occc21 ZINC000122316036 1030801259 /nfs/dbraw/zinc/80/12/59/1030801259.db2.gz KSPLBZSQAMBPLD-SFHVURJKSA-N 2 0 342.483 4.023 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(Br)c(Cl)c1 ZINC000658047193 1030804923 /nfs/dbraw/zinc/80/49/23/1030804923.db2.gz OVYJPCUFLMMXJW-WZRBSPASSA-N 2 0 345.712 4.093 20 0 EIADRP CN1CCC[C@@H](C[NH2+]Cc2ccc3cc[nH]c3c2)[C@H]1c1cccs1 ZINC000527669030 1030807450 /nfs/dbraw/zinc/80/74/50/1030807450.db2.gz WSPZSNIJISZGCE-PXNSSMCTSA-N 2 0 339.508 4.402 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)c2ccccc21 ZINC000658069999 1030815064 /nfs/dbraw/zinc/81/50/64/1030815064.db2.gz SNSVLWCDJBTGDT-VGOFRKELSA-N 2 0 342.527 4.106 20 0 EIADRP CCC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)C1CCCC1 ZINC000658162146 1030858899 /nfs/dbraw/zinc/85/88/99/1030858899.db2.gz BWRHQNJPJMOYJB-NRFANRHFSA-N 2 0 329.532 4.242 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1csc(Cl)c1 ZINC000658163727 1030861382 /nfs/dbraw/zinc/86/13/82/1030861382.db2.gz AJGNYBJPBNBYFW-CQSZACIVSA-N 2 0 349.931 4.359 20 0 EIADRP Cc1ccsc1[C@H](C)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658164785 1030861432 /nfs/dbraw/zinc/86/14/32/1030861432.db2.gz FLTIBAHKVITGRB-INIZCTEOSA-N 2 0 329.513 4.014 20 0 EIADRP c1ccc([C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C2CC2)cc1 ZINC000658166178 1030864925 /nfs/dbraw/zinc/86/49/25/1030864925.db2.gz MXIKIOUEBWXYDM-QFIPXVFZSA-N 2 0 335.495 4.035 20 0 EIADRP c1cnc2c(c1)CC[C@@H]([NH2+]Cc1ccc(C[NH+]3CCCCC3)cc1)CC2 ZINC000421820525 1031025001 /nfs/dbraw/zinc/02/50/01/1031025001.db2.gz MQVWICVQPLDEAX-JOCHJYFZSA-N 2 0 349.522 4.105 20 0 EIADRP C[C@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ncccc1F ZINC000528036453 1031051682 /nfs/dbraw/zinc/05/16/82/1031051682.db2.gz SQQIVYJXZWLHGS-IVMQYODDSA-N 2 0 341.474 4.315 20 0 EIADRP Fc1ccccc1-c1ncc(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)s1 ZINC000449015209 1031342716 /nfs/dbraw/zinc/34/27/16/1031342716.db2.gz KQADVHDIAVVFNI-ZDUSSCGKSA-N 2 0 342.443 4.052 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)[C@H](C)O1 ZINC000449074685 1031429689 /nfs/dbraw/zinc/42/96/89/1031429689.db2.gz LPAWPAPXKDYULF-HYFFOGBASA-N 2 0 338.495 4.071 20 0 EIADRP Clc1ccc(C[C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000449090469 1031449266 /nfs/dbraw/zinc/44/92/66/1031449266.db2.gz NDBVQOMVJODAMD-RNQOJCNYSA-N 2 0 332.919 4.268 20 0 EIADRP COc1cc(C[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)cc2ccccc21 ZINC000449133137 1031468693 /nfs/dbraw/zinc/46/86/93/1031468693.db2.gz XFFDDVFUNJBPBV-KRWDZBQOSA-N 2 0 326.484 4.058 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H]2CSCCc3ccccc32)C1 ZINC000531681416 1031473841 /nfs/dbraw/zinc/47/38/41/1031473841.db2.gz VHWIFIOIVVOQKZ-YLJYHZDGSA-N 2 0 332.557 4.119 20 0 EIADRP c1c2cccnc2oc1C[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000449142414 1031478367 /nfs/dbraw/zinc/47/83/67/1031478367.db2.gz OESMOHQWNVQIPN-UHFFFAOYSA-N 2 0 349.478 4.494 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccc(OC2CCCCC2)cc1 ZINC000531708620 1031494829 /nfs/dbraw/zinc/49/48/29/1031494829.db2.gz VUPLVKCBIUSEEW-WWMYMODYSA-N 2 0 330.516 4.216 20 0 EIADRP CCO[C@H](CC[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)C(C)C ZINC000449180794 1031519116 /nfs/dbraw/zinc/51/91/16/1031519116.db2.gz CCTVAUJPHYYWEH-SIKLNZKXSA-N 2 0 346.559 4.123 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1cc(-c2ccccc2)nn1C ZINC000453067200 1031530130 /nfs/dbraw/zinc/53/01/30/1031530130.db2.gz YVKUSOHWJMQNMW-QZTJIDSGSA-N 2 0 342.531 4.248 20 0 EIADRP CCC[NH+]1CCC(NC2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CC1 ZINC000449219853 1031553104 /nfs/dbraw/zinc/55/31/04/1031553104.db2.gz OPUJQEZDXGJJTC-UHFFFAOYSA-N 2 0 337.596 4.130 20 0 EIADRP CC(C)[C@H]1C[C@@H]([NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CCO1 ZINC000449255027 1031571995 /nfs/dbraw/zinc/57/19/95/1031571995.db2.gz ZLEYEFMFUWYLHL-RBUKOAKNSA-N 2 0 338.580 4.459 20 0 EIADRP C[C@H]1C[C@@H](CC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CCO1 ZINC000449240904 1031578195 /nfs/dbraw/zinc/57/81/95/1031578195.db2.gz PSONSVGXWUTHOI-ROUUACIJSA-N 2 0 338.580 4.460 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)CCCc2cccnc2)c1 ZINC000453107483 1031599261 /nfs/dbraw/zinc/59/92/61/1031599261.db2.gz LELYOUNGXLHLAN-SFHVURJKSA-N 2 0 325.500 4.034 20 0 EIADRP C[C@@H](c1ccncc1)N1CCC([NH2+]C2CCc3ccccc3CC2)CC1 ZINC000453174811 1031648090 /nfs/dbraw/zinc/64/80/90/1031648090.db2.gz PCWJSJOEUBWCAK-SFHVURJKSA-N 2 0 349.522 4.144 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C2CC(C(F)(F)F)C2)CC1 ZINC000449335411 1031652436 /nfs/dbraw/zinc/65/24/36/1031652436.db2.gz ZSVCZUOMVALMCL-NXVRBGIVSA-N 2 0 340.433 4.013 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)c2sccc21 ZINC000453162598 1031665457 /nfs/dbraw/zinc/66/54/57/1031665457.db2.gz PBWLPFYIQKBPFZ-ZWQIFLOQSA-N 2 0 348.556 4.044 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H]3CCOC4(CCCC4)C3)CC2)C1 ZINC000127342423 1031687366 /nfs/dbraw/zinc/68/73/66/1031687366.db2.gz MATZZTSUOAOGQV-MISYRCLQSA-N 2 0 334.548 4.111 20 0 EIADRP CC1(C)C[N@H+](Cc2ccncc2)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449417513 1031701359 /nfs/dbraw/zinc/70/13/59/1031701359.db2.gz YOTGVOHOVWQSCD-QFIPXVFZSA-N 2 0 349.522 4.204 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCCCC1(F)F)c1ccc(OCC[NH+](C)C)cc1 ZINC000453242070 1031798963 /nfs/dbraw/zinc/79/89/63/1031798963.db2.gz FBEINZABQYEUEP-NVXWUHKLSA-N 2 0 340.458 4.103 20 0 EIADRP C[C@H](C[NH2+]C(C)(C)CCC[NH+](C)C)c1cccc(Br)c1 ZINC000449529459 1031816607 /nfs/dbraw/zinc/81/66/07/1031816607.db2.gz XGPPBSSGEJQYBR-CQSZACIVSA-N 2 0 341.337 4.263 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(Br)cc2)CC1 ZINC000531959158 1031877893 /nfs/dbraw/zinc/87/78/93/1031877893.db2.gz APSJPMIPYZDYLI-AWEZNQCLSA-N 2 0 339.321 4.222 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([N@@H+]2CCC[C@@]3(CCOC3)C2)CC1 ZINC000453384693 1031894648 /nfs/dbraw/zinc/89/46/48/1031894648.db2.gz TYKQGDOUNFDYDD-OAQYLSRUSA-N 2 0 336.564 4.168 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]C1CCN(c2ccccc2)CC1 ZINC000531979747 1031923107 /nfs/dbraw/zinc/92/31/07/1031923107.db2.gz OPTABOOIXBGRHC-SIKLNZKXSA-N 2 0 343.559 4.146 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1nc(-c2ccccc2)cs1 ZINC000453390051 1031955673 /nfs/dbraw/zinc/95/56/73/1031955673.db2.gz CUHUMLCOOUALAF-OAHLLOKOSA-N 2 0 329.513 4.335 20 0 EIADRP CC[C@@H]1CCC[C@@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000531994587 1031959315 /nfs/dbraw/zinc/95/93/15/1031959315.db2.gz BDBLDWSQQHSIIN-IRLDBZIGSA-N 2 0 344.543 4.226 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@H](Cc1ccccc1)c1ccccc1 ZINC000531993770 1031959661 /nfs/dbraw/zinc/95/96/61/1031959661.db2.gz LEIBZYUZJOKJCW-PJIZGREPSA-N 2 0 336.523 4.331 20 0 EIADRP CC[C@H]1CCC[C@@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000531994589 1031960506 /nfs/dbraw/zinc/96/05/06/1031960506.db2.gz BDBLDWSQQHSIIN-UNMCSNQZSA-N 2 0 344.543 4.226 20 0 EIADRP CC(C)C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1cccs1 ZINC000459371797 1031979984 /nfs/dbraw/zinc/97/99/84/1031979984.db2.gz KEYJLCWPPMHRHI-SFHVURJKSA-N 2 0 329.513 4.489 20 0 EIADRP C[C@@H](C[NH2+]CCCC[N@H+](C)C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000453591453 1032037094 /nfs/dbraw/zinc/03/70/94/1032037094.db2.gz CCAAJQZVGFDLBI-AWEZNQCLSA-N 2 0 328.422 4.273 20 0 EIADRP C[C@H](C[NH2+]CCCC[N@H+](C)C1CC1)c1cccc(Br)c1 ZINC000453601702 1032038181 /nfs/dbraw/zinc/03/81/81/1032038181.db2.gz VHCRROJRXCBRID-CQSZACIVSA-N 2 0 339.321 4.017 20 0 EIADRP CCO[C@H](C[NH2+]C1CCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000193431196 1032048450 /nfs/dbraw/zinc/04/84/50/1032048450.db2.gz XVTXMSDUAFMTTL-JOCHJYFZSA-N 2 0 338.495 4.018 20 0 EIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH2+]CC4CCSCC4)[C@H]3C2)cc1 ZINC000512612347 1033492732 /nfs/dbraw/zinc/49/27/32/1033492732.db2.gz OMBCFARABUWQKZ-PCCBWWKXSA-N 2 0 344.568 4.020 20 0 EIADRP Clc1cccc(N2CCCC2)c1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000549868137 1033646068 /nfs/dbraw/zinc/64/60/68/1033646068.db2.gz OPEQQYQKHRSZAK-UHFFFAOYSA-N 2 0 349.950 4.296 20 0 EIADRP CC(C)Oc1ccc(C[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000512831766 1034031190 /nfs/dbraw/zinc/03/11/90/1034031190.db2.gz DNTGUKHDIYOVHM-RTBURBONSA-N 2 0 332.532 4.322 20 0 EIADRP C[N@H+](C/C=C/c1ccc(F)cc1)C1CCN(Cc2ccccc2)CC1 ZINC000513496994 1034986441 /nfs/dbraw/zinc/98/64/41/1034986441.db2.gz OUWZEPXQWUHAFW-VMPITWQZSA-N 2 0 338.470 4.435 20 0 EIADRP Clc1ccc(OCC2CC2)c(C[NH2+]CC2CC[NH+](C3CC3)CC2)c1 ZINC000430020608 1035013120 /nfs/dbraw/zinc/01/31/20/1035013120.db2.gz HNMZGUYAPRZSBE-UHFFFAOYSA-N 2 0 348.918 4.093 20 0 EIADRP CCc1nc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cs1 ZINC000513546754 1035027931 /nfs/dbraw/zinc/02/79/31/1035027931.db2.gz ZPSJVNKCPWTJRS-FUHWJXTLSA-N 2 0 343.540 4.096 20 0 EIADRP Cc1ccc([C@H](Cn2ccnc2)[NH2+][C@@H](C)c2cccc(CO)c2)c(C)c1 ZINC000345246455 1035169723 /nfs/dbraw/zinc/16/97/23/1035169723.db2.gz HGFIOBNZYAMDBU-AVRDEDQJSA-N 2 0 349.478 4.084 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2cc3ccnc(Cl)c3s2)C1 ZINC000894242023 1035307994 /nfs/dbraw/zinc/30/79/94/1035307994.db2.gz QSHBQICFSUEPQO-ZDUSSCGKSA-N 2 0 337.920 4.160 20 0 EIADRP Cc1cccc([C@H]([NH2+]CCCN2CC[NH+](C(C)C)CC2)C(C)(C)C)c1 ZINC000500988449 1035338686 /nfs/dbraw/zinc/33/86/86/1035338686.db2.gz CPIRTZQSEPCGDH-NRFANRHFSA-N 2 0 345.575 4.088 20 0 EIADRP C[N@H+](CC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCc2ccc(F)cc21 ZINC000501072136 1035372083 /nfs/dbraw/zinc/37/20/83/1035372083.db2.gz ZEHMPFFFSFJTNN-NRFANRHFSA-N 2 0 339.458 4.056 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000501378236 1035432708 /nfs/dbraw/zinc/43/27/08/1035432708.db2.gz PACLTWOMMVQFQZ-IIZPIQPGSA-N 2 0 343.559 4.456 20 0 EIADRP CC[NH+]1CCC([NH2+]C/C(C)=C\c2ccccc2C(F)(F)F)CC1 ZINC000501413787 1035438196 /nfs/dbraw/zinc/43/81/96/1035438196.db2.gz QLJMOQMUEKOIHP-OWBHPGMISA-N 2 0 326.406 4.183 20 0 EIADRP Cc1cc(F)ccc1-c1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)o1 ZINC000513713811 1035445020 /nfs/dbraw/zinc/44/50/20/1035445020.db2.gz UHSNEZIJQXVHSO-UHFFFAOYSA-N 2 0 330.447 4.168 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)CC[N@@H+]1C ZINC000501465711 1035449904 /nfs/dbraw/zinc/44/99/04/1035449904.db2.gz GLQWXKQJLVHTFW-MGPUTAFESA-N 2 0 344.449 4.169 20 0 EIADRP C[C@H]([NH3+])C1CC[NH+](Cc2nc(-c3ccccc3Cl)cs2)CC1 ZINC000420284113 1035498042 /nfs/dbraw/zinc/49/80/42/1035498042.db2.gz CJDZGVIEFPBXKH-LBPRGKRZSA-N 2 0 335.904 4.023 20 0 EIADRP C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](CC[C@H]1CC[NH2+]C1)C1CC1 ZINC000420299093 1035502544 /nfs/dbraw/zinc/50/25/44/1035502544.db2.gz GGBHINVZIOAIMJ-ZIAGYGMSSA-N 2 0 326.406 4.230 20 0 EIADRP CC[C@H](c1ccc(Cl)cc1)[NH+]1CCC([C@@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000420374528 1035541233 /nfs/dbraw/zinc/54/12/33/1035541233.db2.gz HLEMUUBLFXBLHT-OTWHNJEPSA-N 2 0 336.907 4.009 20 0 EIADRP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC([C@@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420389097 1035564042 /nfs/dbraw/zinc/56/40/42/1035564042.db2.gz LXPLISWVTBIJPM-HBGVWJBISA-N 2 0 344.543 4.263 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2c(Cl)ccc3cccnc32)CC1 ZINC000501798571 1035610862 /nfs/dbraw/zinc/61/08/62/1035610862.db2.gz ZQGSRWTWHFAGLL-UHFFFAOYSA-N 2 0 345.918 4.442 20 0 EIADRP Cc1ccc(-c2nc(C[NH+]3CCC(CCC[NH+](C)C)CC3)co2)cc1 ZINC000501803710 1035613111 /nfs/dbraw/zinc/61/31/11/1035613111.db2.gz IGBJLHGOPVWNKM-UHFFFAOYSA-N 2 0 341.499 4.204 20 0 EIADRP C[C@@H](C[N@@H+]1CCC[C@@H]([NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000501951054 1035753784 /nfs/dbraw/zinc/75/37/84/1035753784.db2.gz OBQYKHKYSRXORP-WMLDXEAASA-N 2 0 328.422 4.225 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000491058793 1035795546 /nfs/dbraw/zinc/79/55/46/1035795546.db2.gz YOBVLXLBHKXMMF-FQEVSTJZSA-N 2 0 346.877 4.500 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000491058795 1035798075 /nfs/dbraw/zinc/79/80/75/1035798075.db2.gz YOBVLXLBHKXMMF-HXUWFJFHSA-N 2 0 346.877 4.500 20 0 EIADRP FC1(F)CC[C@H](C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)C1 ZINC000485496600 1035971344 /nfs/dbraw/zinc/97/13/44/1035971344.db2.gz UMTJKSGMZBODCB-IBGZPJMESA-N 2 0 348.481 4.410 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@H]4C[C@]43C)CC2)cc1 ZINC000502267142 1036003652 /nfs/dbraw/zinc/00/36/52/1036003652.db2.gz HGVCINPVRKZYCJ-KSEOMHKRSA-N 2 0 342.527 4.076 20 0 EIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@@H]1CCCC12CCOCC2 ZINC000502250873 1036008716 /nfs/dbraw/zinc/00/87/16/1036008716.db2.gz GFPVHTIOBKOETM-OAQYLSRUSA-N 2 0 342.527 4.111 20 0 EIADRP CC[C@@H](NCc1nc2c(s1)C[N@@H+](C(C)C)CC2)c1ccccc1 ZINC000414497292 1036044647 /nfs/dbraw/zinc/04/46/47/1036044647.db2.gz SJZNJGNPWQTXMA-MRXNPFEDSA-N 2 0 329.513 4.151 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C[C@@H]2CCCC(F)(F)C2)CC1 ZINC000502317413 1036071437 /nfs/dbraw/zinc/07/14/37/1036071437.db2.gz NCGMIHLFXBBAIJ-JFIYKMOQSA-N 2 0 328.491 4.445 20 0 EIADRP c1c(C2CC[NH2+]CC2)c2ccccc2n1C1CC[NH+](CC2CC2)CC1 ZINC001168379507 1036086601 /nfs/dbraw/zinc/08/66/01/1036086601.db2.gz LBNQTOXDDCNLBH-UHFFFAOYSA-N 2 0 337.511 4.155 20 0 EIADRP COCC[C@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000502431912 1036195141 /nfs/dbraw/zinc/19/51/41/1036195141.db2.gz CKJFUFNZIRTMAG-KNQAVFIVSA-N 2 0 344.543 4.213 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H](C)c2cnn(C3CCCC3)c2)CC1 ZINC000502483113 1036264984 /nfs/dbraw/zinc/26/49/84/1036264984.db2.gz UCIDAAOBBLFIQR-SFHVURJKSA-N 2 0 346.563 4.407 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]C/C=C\c2ccccc2OC)cc1 ZINC000588177110 1036284394 /nfs/dbraw/zinc/28/43/94/1036284394.db2.gz ICHPALBFKJIQLV-NTMALXAHSA-N 2 0 338.495 4.340 20 0 EIADRP C[C@H](CCc1ccc(OC(F)F)cc1)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421365789 1036312353 /nfs/dbraw/zinc/31/23/53/1036312353.db2.gz BCZHLHNBOYPGSF-ODIFPOPNSA-N 2 0 340.458 4.072 20 0 EIADRP C[NH+](C)C1CCC([NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CC1 ZINC000421371692 1036316919 /nfs/dbraw/zinc/31/69/19/1036316919.db2.gz KHPMSOBSIQACPM-UHFFFAOYSA-N 3 0 337.596 4.128 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000502593153 1036386052 /nfs/dbraw/zinc/38/60/52/1036386052.db2.gz SBWKFVNKBMACOG-HZPDHXFCSA-N 2 0 340.458 4.103 20 0 EIADRP Clc1ccc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1Cl ZINC000668582679 1036471671 /nfs/dbraw/zinc/47/16/71/1036471671.db2.gz YHUIKHJOZTVXPS-UHFFFAOYSA-N 2 0 336.266 4.147 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000502699178 1036519497 /nfs/dbraw/zinc/51/94/97/1036519497.db2.gz XMMPUJWYZLAFAR-NYVOZVTQSA-N 2 0 344.543 4.356 20 0 EIADRP Cc1cc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)oc1C ZINC000502699805 1036528658 /nfs/dbraw/zinc/52/86/58/1036528658.db2.gz SXIBJEAXROFGKU-KRWDZBQOSA-N 2 0 326.484 4.459 20 0 EIADRP CSC1CC[NH+](CCC(C)CC[NH+]2CCC(SC)CC2)CC1 ZINC000602921148 1036679358 /nfs/dbraw/zinc/67/93/58/1036679358.db2.gz PWVWAYFQABMQJR-UHFFFAOYSA-N 2 0 344.634 4.058 20 0 EIADRP c1ccc(C[N@H+](C2CCCCC2)C2CC[NH+](CC3CC3)CC2)nc1 ZINC001168387899 1036710974 /nfs/dbraw/zinc/71/09/74/1036710974.db2.gz XSVLVISNRSIUQL-UHFFFAOYSA-N 2 0 327.516 4.091 20 0 EIADRP CC[N@H+](Cc1ccc(C(F)(F)F)cc1)C1CC[NH+](CC2CC2)CC1 ZINC001168389634 1036759048 /nfs/dbraw/zinc/75/90/48/1036759048.db2.gz UXVPOGONXUQEJE-UHFFFAOYSA-N 2 0 340.433 4.402 20 0 EIADRP CSC1(C[NH2+][C@@H]2C[C@@H](C(C)C)c3ccccc32)CC[NH+](C)CC1 ZINC000589348093 1036759622 /nfs/dbraw/zinc/75/96/22/1036759622.db2.gz QNGZZNSJIIDBBD-RBUKOAKNSA-N 2 0 332.557 4.288 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000421846941 1036823979 /nfs/dbraw/zinc/82/39/79/1036823979.db2.gz VIKJAMZUYPUENM-CYBMUJFWSA-N 2 0 326.887 4.263 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]C2CCC([NH+](C)C)CC2)cc1F ZINC000421887430 1036835152 /nfs/dbraw/zinc/83/51/52/1036835152.db2.gz VWQJYOPAKIMJNQ-BZWMRVRASA-N 2 0 348.506 4.323 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1CC12CCSCC2 ZINC000421869869 1036839732 /nfs/dbraw/zinc/83/97/32/1036839732.db2.gz DYFYOEIPJOPGHU-RLLQIKCJSA-N 2 0 344.568 4.020 20 0 EIADRP C(=C\c1ccncc1)\C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000486958891 1036919694 /nfs/dbraw/zinc/91/96/94/1036919694.db2.gz QBILYLQSXAZBSF-WAYWQWQTSA-N 2 0 335.495 4.261 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)nc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272265918 1037148432 /nfs/dbraw/zinc/14/84/32/1037148432.db2.gz AKVPTBQQKHUFBX-FCEWJHQRSA-N 2 0 343.902 4.296 20 0 EIADRP COc1cccc([C@H](C)[NH+]2CCN(c3cc[nH+]c4ccccc43)CC2)c1 ZINC000599881933 1037222471 /nfs/dbraw/zinc/22/24/71/1037222471.db2.gz GVYCYRFIQIRRRS-KRWDZBQOSA-N 2 0 347.462 4.127 20 0 EIADRP Cc1ccc(C[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)s1 ZINC000573018198 1037226799 /nfs/dbraw/zinc/22/67/99/1037226799.db2.gz DJVINNMBEMOSKJ-HXUWFJFHSA-N 2 0 326.509 4.155 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+]CCCc2ccc(Cl)cc2)cc1 ZINC000591717895 1037544871 /nfs/dbraw/zinc/54/48/71/1037544871.db2.gz ZPZOASPFEJYVFU-UHFFFAOYSA-N 2 0 346.902 4.003 20 0 EIADRP C[N@H+](CC1CC1)C[C@H]1CCN(CCc2cc(Cl)ccc2Cl)C1 ZINC000488469424 1037615685 /nfs/dbraw/zinc/61/56/85/1037615685.db2.gz ZJDCQLKPMPRJKZ-OAHLLOKOSA-N 2 0 341.326 4.200 20 0 EIADRP C[C@@H]1C[C@H]1c1ccc(CNC[C@H]2CC[N@H+](CCc3ccccc3)C2)o1 ZINC000488513688 1037641400 /nfs/dbraw/zinc/64/14/00/1037641400.db2.gz LMQRTQDPUWGUKD-YFVAEKQCSA-N 2 0 338.495 4.057 20 0 EIADRP C[C@@H]([NH3+])[C@H]1CC[N@H+](Cc2cccc(OCc3ccccc3Cl)c2)C1 ZINC000414663839 1037722048 /nfs/dbraw/zinc/72/20/48/1037722048.db2.gz RWETVPMXQOHTNH-WBVHZDCISA-N 2 0 344.886 4.088 20 0 EIADRP C[N@H+](CCCOc1ccc(C(C)(C)C)cc1)C[C@H]1CCC[NH+](C)C1 ZINC000605421260 1037776517 /nfs/dbraw/zinc/77/65/17/1037776517.db2.gz WVTBJLWGTAWXJN-SFHVURJKSA-N 2 0 332.532 4.027 20 0 EIADRP FC(F)(F)c1cccc(CCC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)c1 ZINC000422710658 1037804203 /nfs/dbraw/zinc/80/42/03/1037804203.db2.gz FHJRTOOHKFSMHI-RCCFBDPRSA-N 2 0 340.433 4.148 20 0 EIADRP c1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422710968 1037804401 /nfs/dbraw/zinc/80/44/01/1037804401.db2.gz MBUKKSSYJFDNPG-DXKRWKNPSA-N 2 0 348.490 4.168 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1Cl ZINC000422689323 1037806664 /nfs/dbraw/zinc/80/66/64/1037806664.db2.gz FENXJWULJPDBFY-BOUXLOLZSA-N 2 0 342.870 4.247 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000422733085 1037808959 /nfs/dbraw/zinc/80/89/59/1037808959.db2.gz QNSGJKIIMZSKIE-RYUDHWBXSA-N 2 0 337.389 4.279 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c(C)c1 ZINC000422713323 1037810485 /nfs/dbraw/zinc/81/04/85/1037810485.db2.gz PNLPDRHYECLCMQ-UCNVEGJOSA-N 2 0 336.479 4.210 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000422715163 1037811213 /nfs/dbraw/zinc/81/12/13/1037811213.db2.gz RQVKDPAKMBOTOH-OXJNMPFZSA-N 2 0 342.458 4.197 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)CC(C)(C)c1ccccc1 ZINC000422716079 1037812700 /nfs/dbraw/zinc/81/27/00/1037812700.db2.gz MWNOALAHMZTHCX-HZPDHXFCSA-N 2 0 325.500 4.256 20 0 EIADRP COc1cc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])ccc1OCc1ccccc1 ZINC000422723124 1037815222 /nfs/dbraw/zinc/81/52/22/1037815222.db2.gz QJBJPJWUIKPLMS-DLBZAZTESA-N 2 0 342.483 4.052 20 0 EIADRP COc1cc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])ccc1OCc1ccccc1 ZINC000422723125 1037815895 /nfs/dbraw/zinc/81/58/95/1037815895.db2.gz QJBJPJWUIKPLMS-IAGOWNOFSA-N 2 0 342.483 4.052 20 0 EIADRP c1ccc([C@H]([NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C2CCC2)cc1 ZINC000422720702 1037816107 /nfs/dbraw/zinc/81/61/07/1037816107.db2.gz SYWFMSDALGPUJK-PMVMPFDFSA-N 2 0 348.490 4.373 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC1 ZINC000422769760 1037828609 /nfs/dbraw/zinc/82/86/09/1037828609.db2.gz PLKNDKZRBYQGJS-TVPLGVNVSA-N 2 0 346.421 4.237 20 0 EIADRP [NH3+][C@H]1C[C@H]([NH2+]CCc2csc(-c3ccccc3)n2)c2ccccc21 ZINC000422776629 1037829816 /nfs/dbraw/zinc/82/98/16/1037829816.db2.gz AQSXDIDIHNCRAT-OALUTQOASA-N 2 0 335.476 4.087 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)cc1 ZINC000422791598 1037840379 /nfs/dbraw/zinc/84/03/79/1037840379.db2.gz YQYCBSLFYNDEPE-QKLQHJQFSA-N 2 0 338.495 4.401 20 0 EIADRP CC[C@@H](C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C)Oc1ccccc1Cl ZINC000422838307 1037842889 /nfs/dbraw/zinc/84/28/89/1037842889.db2.gz ODKPFABYASNVQU-CJNGLKHVSA-N 2 0 347.890 4.010 20 0 EIADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1cccc(COCc2ccccc2)c1 ZINC000422866502 1037848782 /nfs/dbraw/zinc/84/87/82/1037848782.db2.gz QKRXCABNMVTHJB-VXKWHMMOSA-N 2 0 338.495 4.011 20 0 EIADRP CCOc1ccccc1[C@@H](CC)[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422880293 1037852632 /nfs/dbraw/zinc/85/26/32/1037852632.db2.gz NWHCAIDOLLPORS-HNAYVOBHSA-N 2 0 327.472 4.049 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1ccc(OC(C)C)cc1 ZINC000422888634 1037856010 /nfs/dbraw/zinc/85/60/10/1037856010.db2.gz DIJYGPWKMWAEBA-CABCVRRESA-N 2 0 327.472 4.048 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCCOc2c(Cl)c(Cl)ccc21 ZINC000422905957 1037864416 /nfs/dbraw/zinc/86/44/16/1037864416.db2.gz SYFAWINIUWXXBZ-RISCZKNCSA-N 2 0 331.287 4.314 20 0 EIADRP c1ccc(OC2CCC2)c(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000422910828 1037865748 /nfs/dbraw/zinc/86/57/48/1037865748.db2.gz JMFIHXQXMFEYBW-XUVXKRRUSA-N 2 0 328.500 4.018 20 0 EIADRP COc1cccc(C[C@H]([NH2+][C@@H](C)CCCC[NH3+])c2ccccc2)c1 ZINC000422941956 1037875380 /nfs/dbraw/zinc/87/53/80/1037875380.db2.gz OZWMWSOMPMQKST-UWJYYQICSA-N 2 0 326.484 4.086 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](COc1ccccc1F)c1ccccc1 ZINC000422940951 1037875588 /nfs/dbraw/zinc/87/55/88/1037875588.db2.gz UJZXBAXFFUNKJA-LPHOPBHVSA-N 2 0 330.447 4.053 20 0 EIADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C(C)(C)C ZINC000422920653 1037880440 /nfs/dbraw/zinc/88/04/40/1037880440.db2.gz MMJBESLTFXPCRR-HOTGVXAUSA-N 2 0 346.437 4.136 20 0 EIADRP c1ccc([C@@H]2CCC[C@H]2[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422965832 1037881206 /nfs/dbraw/zinc/88/12/06/1037881206.db2.gz MBUKKSSYJFDNPG-DEXHYYOUSA-N 2 0 348.490 4.168 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1ccc(Br)cc1 ZINC000422943512 1037882557 /nfs/dbraw/zinc/88/25/57/1037882557.db2.gz KOJJMGYTDFNCMK-KBXCAEBGSA-N 2 0 347.300 4.256 20 0 EIADRP CCOc1ccc([C@H]([NH2+][C@@H](C)CCCC[NH3+])c2ccccc2)cc1 ZINC000422946744 1037885456 /nfs/dbraw/zinc/88/54/56/1037885456.db2.gz PDUOQSAQRWITOD-LAUBAEHRSA-N 2 0 326.484 4.282 20 0 EIADRP Clc1cccc(CC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)c1Cl ZINC000422948271 1037885777 /nfs/dbraw/zinc/88/57/77/1037885777.db2.gz QZZAVQPQRLXNAH-FVQBIDKESA-N 2 0 327.299 4.046 20 0 EIADRP [NH3+]CC1CCC([NH2+][C@H]2CCOc3c(-c4ccccc4)cccc32)CC1 ZINC000422958697 1037889205 /nfs/dbraw/zinc/88/92/05/1037889205.db2.gz YSJFHBGVYVXBDV-IAYYMHMVSA-N 2 0 336.479 4.284 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c2ccccc21 ZINC000422993378 1037890884 /nfs/dbraw/zinc/89/08/84/1037890884.db2.gz SRTPNRIENPSQBF-JTAQYXEDSA-N 2 0 348.490 4.255 20 0 EIADRP Fc1ccc(C2=CC[C@H]([NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)CC2)cc1 ZINC000423049435 1037906503 /nfs/dbraw/zinc/90/65/03/1037906503.db2.gz XNVQRKFGLPWYTQ-UWHLTILDSA-N 2 0 328.475 4.272 20 0 EIADRP FC(F)(F)c1ccccc1[C@H]1CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423023321 1037906767 /nfs/dbraw/zinc/90/67/67/1037906767.db2.gz JMLQYNVXSFFPOS-WRQHKEJMSA-N 2 0 338.417 4.214 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC1(Cc2ccccc2)CCCC1 ZINC000423041299 1037921685 /nfs/dbraw/zinc/92/16/85/1037921685.db2.gz IQKMGNLQVHBJLD-KRWDZBQOSA-N 2 0 337.511 4.302 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCCCCc1ccc(F)cc1 ZINC000423066535 1037929963 /nfs/dbraw/zinc/92/99/63/1037929963.db2.gz WZCBIQNETQFHGR-OAHLLOKOSA-N 2 0 329.463 4.051 20 0 EIADRP Fc1ccc(C2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)CCCC2)c(Cl)c1 ZINC000423063933 1037930774 /nfs/dbraw/zinc/93/07/74/1037930774.db2.gz QANSRRBTWKATAJ-XYPWUTKMSA-N 2 0 336.882 4.164 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]C1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000423070561 1037933973 /nfs/dbraw/zinc/93/39/73/1037933973.db2.gz GEJILYZOGLLUEC-NSHDSACASA-N 2 0 334.813 4.455 20 0 EIADRP Cc1ccc(C2(C[NH2+][C@@H](C)c3ccc(C[NH3+])nc3C)CCC2)cc1C ZINC000423085425 1037947253 /nfs/dbraw/zinc/94/72/53/1037947253.db2.gz JXFDQQBILMASTD-KRWDZBQOSA-N 2 0 337.511 4.238 20 0 EIADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000423092031 1037953635 /nfs/dbraw/zinc/95/36/35/1037953635.db2.gz AGAWQGSOEJUFCY-MWQQHZPXSA-N 2 0 326.406 4.201 20 0 EIADRP [NH3+][C@@H]1C[C@H]([NH2+]C2CC(F)(c3cccc(Cl)c3)C2)c2ccccc21 ZINC000423095220 1037954365 /nfs/dbraw/zinc/95/43/65/1037954365.db2.gz LQOVSEIZJIOQAA-UGAWAQNWSA-N 2 0 330.834 4.402 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCCCc1ccc(Cl)s1 ZINC000423100190 1037958809 /nfs/dbraw/zinc/95/88/09/1037958809.db2.gz GPGVPIKTWOBHQS-GFCCVEGCSA-N 2 0 337.920 4.237 20 0 EIADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]C1CC(F)(c2cccc(Cl)c2)C1 ZINC000423099382 1037959858 /nfs/dbraw/zinc/95/98/58/1037959858.db2.gz TZUQDFUIORGXTB-GZUKPKISSA-N 2 0 346.877 4.215 20 0 EIADRP COCC[C@@H]([NH2+][C@H](C)CCCC[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000423108910 1037987138 /nfs/dbraw/zinc/98/71/38/1037987138.db2.gz RSJILAGEIAZZGV-MLGOLLRUSA-N 2 0 333.303 4.178 20 0 EIADRP Cc1sc(C2([NH2+][C@@H](C)CCC[NH3+])CCC2)nc1-c1ccccc1F ZINC000423145078 1037995208 /nfs/dbraw/zinc/99/52/08/1037995208.db2.gz IZVKFLUUIFOWOB-ZDUSSCGKSA-N 2 0 347.503 4.354 20 0 EIADRP [NH3+][C@H]1C[C@@H]([NH+]2CCC(Cc3cccc(F)c3F)CC2)c2ccccc21 ZINC000423153206 1038006740 /nfs/dbraw/zinc/00/67/40/1038006740.db2.gz GXSWJBUFXHHVMU-VQTJNVASSA-N 2 0 342.433 4.364 20 0 EIADRP Cc1ccc(C[N@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)s1 ZINC000414721886 1038026171 /nfs/dbraw/zinc/02/61/71/1038026171.db2.gz JMUHRKYHQMZKDT-QGZVFWFLSA-N 2 0 332.538 4.262 20 0 EIADRP C[C@H]([NH2+]CCC[NH3+])c1ccc(-c2ccccc2Br)s1 ZINC000423178941 1038035740 /nfs/dbraw/zinc/03/57/40/1038035740.db2.gz LJTVGUZISVBOHA-NSHDSACASA-N 2 0 339.302 4.177 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CC1([NH3+])CCCCCC1 ZINC000423200050 1038049512 /nfs/dbraw/zinc/04/95/12/1038049512.db2.gz LNUVJOQKRRCOJX-CABCVRRESA-N 2 0 331.529 4.430 20 0 EIADRP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[NH2+]C1)c1ccc2cc(OC)ccc2c1 ZINC000423219271 1038060331 /nfs/dbraw/zinc/06/03/31/1038060331.db2.gz SZKPNLYKUGMAFF-JJXUHFIVSA-N 2 0 326.484 4.277 20 0 EIADRP CSC[C@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1 ZINC000593321272 1038063695 /nfs/dbraw/zinc/06/36/95/1038063695.db2.gz HIUQUQNPYIHRGR-INIZCTEOSA-N 2 0 346.462 4.089 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1)[C@H]1CCC[NH2+]C1 ZINC000423221724 1038065350 /nfs/dbraw/zinc/06/53/50/1038065350.db2.gz XULZJJLFIXHKMM-OWIUFQIYSA-N 2 0 340.433 4.319 20 0 EIADRP Fc1ccc([C@@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2cnc3ccccc3c2)cc1 ZINC000423245459 1038075114 /nfs/dbraw/zinc/07/51/14/1038075114.db2.gz IYGYTGWBKMKOGE-KSFYIVLOSA-N 2 0 349.453 4.053 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]CC[C@@H]3CCC[NH2+]C3)cs2)cs1 ZINC000423260767 1038088450 /nfs/dbraw/zinc/08/84/50/1038088450.db2.gz QQVIPDSBCBXFJY-JSGCOSHPSA-N 2 0 335.542 4.220 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2cccc3c2OC(C)(C)C3)CC1 ZINC000606469309 1038092710 /nfs/dbraw/zinc/09/27/10/1038092710.db2.gz KWZBKIBHFGSGKI-UHFFFAOYSA-N 2 0 330.516 4.002 20 0 EIADRP CCOc1ccc([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1OCC ZINC000423291940 1038095050 /nfs/dbraw/zinc/09/50/50/1038095050.db2.gz KQCPOTCHIVOTSD-JKSUJKDBSA-N 2 0 342.483 4.355 20 0 EIADRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000423293569 1038096000 /nfs/dbraw/zinc/09/60/00/1038096000.db2.gz RTAQIMVERCVJSK-KBPBESRZSA-N 2 0 334.410 4.467 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2ccc(Br)cc2)cc1 ZINC000423291671 1038096835 /nfs/dbraw/zinc/09/68/35/1038096835.db2.gz JIVDCMMZFGBHIA-CHWSQXEVSA-N 2 0 333.273 4.320 20 0 EIADRP CCOC(=O)C(C)(C)CCC[C@@H](C)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000593611657 1038101643 /nfs/dbraw/zinc/10/16/43/1038101643.db2.gz DMIFDQJBZBOGCT-OAHLLOKOSA-N 2 0 340.552 4.033 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCc3cc(Br)ccc32)cc1 ZINC000423293060 1038102300 /nfs/dbraw/zinc/10/23/00/1038102300.db2.gz POWLLTRYMFXMNI-KPZWWZAWSA-N 2 0 345.284 4.246 20 0 EIADRP C[C@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc(SCC(F)F)cc1 ZINC000423319201 1038110755 /nfs/dbraw/zinc/11/07/55/1038110755.db2.gz DDDQROOXXRIYOK-GUYCJALGSA-N 2 0 328.472 4.084 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCCOc3c(Cl)cccc32)cc1 ZINC000423293958 1038117915 /nfs/dbraw/zinc/11/79/15/1038117915.db2.gz SPKNJKCPDDHNKB-FZKQIMNGSA-N 2 0 330.859 4.363 20 0 EIADRP COCCC[C@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)c1ccc(F)cc1 ZINC000423294314 1038118243 /nfs/dbraw/zinc/11/82/43/1038118243.db2.gz TZTMYEMHKIJTTG-QRWLVFNGSA-N 2 0 330.447 4.103 20 0 EIADRP COCCC[C@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc(F)cc1 ZINC000423294315 1038123207 /nfs/dbraw/zinc/12/32/07/1038123207.db2.gz TZTMYEMHKIJTTG-YWZLYKJASA-N 2 0 330.447 4.103 20 0 EIADRP Cc1cc(Cl)c2c(c1)[C@H](NC1CC[NH+](CC3CC3)CC1)CCCO2 ZINC000489589476 1038134270 /nfs/dbraw/zinc/13/42/70/1038134270.db2.gz VJKMIZADTAKGTG-LJQANCHMSA-N 2 0 348.918 4.326 20 0 EIADRP Cc1ccccc1COc1ccc([C@@H](C)[NH2+]CC2=CC[NH2+]CC2)cc1 ZINC000423346723 1038134216 /nfs/dbraw/zinc/13/42/16/1038134216.db2.gz PNCFSGFMFMAJHL-GOSISDBHSA-N 2 0 336.479 4.144 20 0 EIADRP CC1(C[NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC[NH2+]CC1 ZINC000423325381 1038139933 /nfs/dbraw/zinc/13/99/33/1038139933.db2.gz JOAINQIHQNTFRI-NVXWUHKLSA-N 2 0 340.433 4.321 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423327559 1038144982 /nfs/dbraw/zinc/14/49/82/1038144982.db2.gz LKHAEOBCMTYFJT-ORAYPTAESA-N 2 0 347.503 4.298 20 0 EIADRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423336474 1038148139 /nfs/dbraw/zinc/14/81/39/1038148139.db2.gz HAABKCMEUQCHOI-HNNXBMFYSA-N 2 0 326.415 4.188 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC000423368237 1038184784 /nfs/dbraw/zinc/18/47/84/1038184784.db2.gz DYOHCUVTYQIWKP-GRDNDAEWSA-N 2 0 329.513 4.218 20 0 EIADRP CC[C@H]([NH2+]CC1(COC)CC[NH2+]CC1)c1ccc(Cl)c(Cl)c1 ZINC000423388703 1038198715 /nfs/dbraw/zinc/19/87/15/1038198715.db2.gz KXCIGUWNOIIDMA-INIZCTEOSA-N 2 0 345.314 4.050 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccccc1OC(F)F ZINC000423396816 1038201633 /nfs/dbraw/zinc/20/16/33/1038201633.db2.gz SRMLAFKKTDTAQF-KRWDZBQOSA-N 2 0 332.394 4.132 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000423376833 1038206848 /nfs/dbraw/zinc/20/68/48/1038206848.db2.gz LHVAFRSKKRPQJL-MBNYWOFBSA-N 2 0 333.476 4.049 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(Br)cc1F ZINC000423402172 1038214809 /nfs/dbraw/zinc/21/48/09/1038214809.db2.gz WJLHOUDZSRPWOX-LLVKDONJSA-N 2 0 349.247 4.042 20 0 EIADRP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423405140 1038215401 /nfs/dbraw/zinc/21/54/01/1038215401.db2.gz ZNXLZCIWLYXKHF-BZPMIXESSA-N 2 0 332.435 4.132 20 0 EIADRP CC(C)Oc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)cc1Cl ZINC000423435001 1038235345 /nfs/dbraw/zinc/23/53/45/1038235345.db2.gz LCNOAQUNARAJMR-QANKJYHBSA-N 2 0 336.907 4.166 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)CCC[NH3+])c1ccc(Br)cc1Cl ZINC000423456849 1038237901 /nfs/dbraw/zinc/23/79/01/1038237901.db2.gz OHYYSHOECMKUNP-HZMBPMFUSA-N 2 0 333.701 4.271 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1ccccc1Br ZINC000423461584 1038239916 /nfs/dbraw/zinc/23/99/16/1038239916.db2.gz SYDZGXLSRIDLPS-RDTXWAMCSA-N 2 0 347.300 4.256 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423462745 1038240048 /nfs/dbraw/zinc/24/00/48/1038240048.db2.gz FAHORMJWIMWGMX-NWANDNLSSA-N 2 0 347.503 4.426 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000423459229 1038240157 /nfs/dbraw/zinc/24/01/57/1038240157.db2.gz LAVJOJSKAIMMGH-RVSPLBMKSA-N 2 0 347.503 4.426 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+]C1CCC(c2cccc(C(F)(F)F)c2)CC1 ZINC000423457384 1038240243 /nfs/dbraw/zinc/24/02/43/1038240243.db2.gz OXNNDAWILSRBHV-CBCUQQMYSA-N 2 0 328.422 4.449 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)s1 ZINC000423477282 1038248509 /nfs/dbraw/zinc/24/85/09/1038248509.db2.gz SEXKOYUEVSGIFG-QILLFSRXSA-N 2 0 332.488 4.240 20 0 EIADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cc(Cl)ccc1OC(F)F ZINC000423477591 1038250113 /nfs/dbraw/zinc/25/01/13/1038250113.db2.gz KCUWRRWMSVSQCY-AAEUAGOBSA-N 2 0 332.822 4.124 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)CCS2 ZINC000423503169 1038258256 /nfs/dbraw/zinc/25/82/56/1038258256.db2.gz FLWHCTGYZJUSLW-RTBURBONSA-N 2 0 342.508 4.302 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423487721 1038260464 /nfs/dbraw/zinc/26/04/64/1038260464.db2.gz UPKJNFGWKKPDTA-PBHICJAKSA-N 2 0 328.422 4.148 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000423491975 1038263945 /nfs/dbraw/zinc/26/39/45/1038263945.db2.gz LAUNYBNRFZGMPV-IACUBPJLSA-N 2 0 333.476 4.036 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+]CCC2=CC[NH2+]CC2)cc1 ZINC000423534830 1038267418 /nfs/dbraw/zinc/26/74/18/1038267418.db2.gz AZHSNOYFEQRFOC-SFTDATJTSA-N 2 0 328.500 4.009 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CCC[NH2+]C1CC1 ZINC000423528479 1038268162 /nfs/dbraw/zinc/26/81/62/1038268162.db2.gz OIZFOMIRELLGOY-LBPRGKRZSA-N 2 0 333.476 4.050 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H](c2cccc(F)c2)c2cccc(Cl)c2)C1 ZINC000423517980 1038273573 /nfs/dbraw/zinc/27/35/73/1038273573.db2.gz UVBVTYVXQAMWRD-ZNOIYHFQSA-N 2 0 332.850 4.286 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H](Cc2ccccc2Cl)c2ccsc2)C1 ZINC000423522165 1038277102 /nfs/dbraw/zinc/27/71/02/1038277102.db2.gz XOQQEHVAMGHYKM-MZMPZRCHSA-N 2 0 334.916 4.402 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(SCC(F)F)cc1 ZINC000423557448 1038281390 /nfs/dbraw/zinc/28/13/90/1038281390.db2.gz ZRNJQWNIOHXFBH-LCGIIJARSA-N 2 0 340.483 4.083 20 0 EIADRP c1ccc2c(c1)sc1c2CCC[C@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423557512 1038282739 /nfs/dbraw/zinc/28/27/39/1038282739.db2.gz ZWNWCCJRRFSLTH-OIPACUDHSA-N 2 0 326.509 4.256 20 0 EIADRP CC(C)Oc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1Cl ZINC000423540232 1038285950 /nfs/dbraw/zinc/28/59/50/1038285950.db2.gz DCWTVFWWYRVUQN-RKTXRCNFSA-N 2 0 336.907 4.166 20 0 EIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@H]3C[NH2+]C[C@H]3C1)CCCO2 ZINC000423542157 1038288334 /nfs/dbraw/zinc/28/83/34/1038288334.db2.gz LUUKQGMZALNVLE-JRBPQWBISA-N 2 0 328.500 4.001 20 0 EIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC2=CC[NH2+]CC2)CCC3)cc1 ZINC000423544172 1038288658 /nfs/dbraw/zinc/28/86/58/1038288658.db2.gz VYMZPHSDHZHEIC-QGZVFWFLSA-N 2 0 339.508 4.087 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)C(c1ccccc1)c1ccccc1 ZINC000423548012 1038292478 /nfs/dbraw/zinc/29/24/78/1038292478.db2.gz QSUDZLBSHGEFSZ-ZHNGQKSSSA-N 2 0 334.507 4.185 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000423547984 1038292557 /nfs/dbraw/zinc/29/25/57/1038292557.db2.gz QRKSUKSPDWOVEH-NGVUMRSOSA-N 2 0 342.527 4.088 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@@H]1CCCC[NH2+]C1 ZINC000423556823 1038294149 /nfs/dbraw/zinc/29/41/49/1038294149.db2.gz MTILJOCXGVBWKI-BLLLJJGKSA-N 2 0 333.476 4.050 20 0 EIADRP Cc1cc(N2CCC[C@@H]([NH2+]C(C)C)C2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000607144396 1038389708 /nfs/dbraw/zinc/38/97/08/1038389708.db2.gz ABSOHUOCWAFDKV-CQSZACIVSA-N 2 0 349.425 4.111 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)s2)C1 ZINC000594786052 1038400723 /nfs/dbraw/zinc/40/07/23/1038400723.db2.gz ISDGXNRSXYNHSL-CQSZACIVSA-N 2 0 334.916 4.500 20 0 EIADRP C[C@H](C[NH2+][C@H](Cc1ccncc1)c1cccs1)C[NH+]1CCCCC1 ZINC000424274428 1038783083 /nfs/dbraw/zinc/78/30/83/1038783083.db2.gz YWRZGXKYYUYJQQ-IEBWSBKVSA-N 2 0 343.540 4.139 20 0 EIADRP CCCCc1ccc([C@H](C)[NH2+]CCc2cn3c(n2)CCCC3)cc1 ZINC000480746198 1038785967 /nfs/dbraw/zinc/78/59/67/1038785967.db2.gz FVTNINBMMJWUJP-KRWDZBQOSA-N 2 0 325.500 4.455 20 0 EIADRP CCCCCOc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000480769817 1038797547 /nfs/dbraw/zinc/79/75/47/1038797547.db2.gz MQSLKWJNMVCVTM-QZTJIDSGSA-N 2 0 330.516 4.391 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cccc(OC(F)F)c2)C1 ZINC000539050699 1038799125 /nfs/dbraw/zinc/79/91/25/1038799125.db2.gz QBZXBNXLVIXRNG-CVEARBPZSA-N 2 0 340.458 4.307 20 0 EIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@H](CC2CC2)c2ccccc2)C[C@@H](C)O1 ZINC000539071174 1038820418 /nfs/dbraw/zinc/82/04/18/1038820418.db2.gz FRCBNMYLFVGSSE-DBXWQHBBSA-N 2 0 330.516 4.007 20 0 EIADRP CSC1(C[NH2+][C@@H](c2ccc(F)c(F)c2)C(C)C)CC[NH+](C)CC1 ZINC000554999714 1038822850 /nfs/dbraw/zinc/82/28/50/1038822850.db2.gz GJOQOKNHRHANKS-QGZVFWFLSA-N 2 0 342.499 4.079 20 0 EIADRP COc1cc([C@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)ccc1F ZINC000504917180 1038850811 /nfs/dbraw/zinc/85/08/11/1038850811.db2.gz BDWMAOBPTQRPOQ-INIZCTEOSA-N 2 0 336.495 4.243 20 0 EIADRP FC(F)(F)c1cccc([C@H]([NH2+]CCC[NH+]2CCCC2)C2CC2)c1 ZINC000539162542 1038865593 /nfs/dbraw/zinc/86/55/93/1038865593.db2.gz BPAVSYPJIUOKND-QGZVFWFLSA-N 2 0 326.406 4.232 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](CC)c2cccc(Br)c2)C1 ZINC000481024776 1038962403 /nfs/dbraw/zinc/96/24/03/1038962403.db2.gz NJPQJONRZQKKHC-WMLDXEAASA-N 2 0 339.321 4.222 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(OCC(F)(F)F)cc2)C1 ZINC000481024738 1038964439 /nfs/dbraw/zinc/96/44/39/1038964439.db2.gz OQTDSOJOKCVWHG-CABCVRRESA-N 2 0 344.421 4.010 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000481044559 1038976417 /nfs/dbraw/zinc/97/64/17/1038976417.db2.gz WDKGSIHUBXYCAM-IAGOWNOFSA-N 2 0 344.474 4.048 20 0 EIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCC1=CCCCC1)c1ccccc1O2 ZINC000539370216 1039014116 /nfs/dbraw/zinc/01/41/16/1039014116.db2.gz XRGHEFNQZFNSBO-HXUWFJFHSA-N 2 0 340.511 4.455 20 0 EIADRP CCCCOc1cc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)ccc1OC ZINC000414809642 1039030707 /nfs/dbraw/zinc/03/07/07/1039030707.db2.gz MMWJJUWWILMLFL-INIZCTEOSA-N 2 0 342.483 4.184 20 0 EIADRP Clc1ccc(C2CCC([NH2+]CC34CC[NH+](CC3)CC4)CC2)cc1 ZINC001168335523 1039074977 /nfs/dbraw/zinc/07/49/77/1039074977.db2.gz LXAPPFDMBPBFDQ-UHFFFAOYSA-N 2 0 332.919 4.442 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)c(C)c1OC ZINC000552062770 1039083574 /nfs/dbraw/zinc/08/35/74/1039083574.db2.gz GJYXPSKPJAIPNQ-MSOLQXFVSA-N 2 0 348.531 4.031 20 0 EIADRP Cc1ccc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1Br ZINC000414815875 1039096306 /nfs/dbraw/zinc/09/63/06/1039096306.db2.gz YQFZQYJVIJEGPA-ZDUSSCGKSA-N 2 0 333.273 4.067 20 0 EIADRP CCOc1c(Cl)cc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1OC ZINC000414816035 1039098821 /nfs/dbraw/zinc/09/88/21/1039098821.db2.gz YXOTVILUBCFHBI-CYBMUJFWSA-N 2 0 348.874 4.057 20 0 EIADRP C[C@@H]([NH2+]CCCCc1cccc(C(F)(F)F)c1)[C@@H]1CCC[NH2+]C1 ZINC000414819308 1039155633 /nfs/dbraw/zinc/15/56/33/1039155633.db2.gz HEVOINRIHIJWBF-GDBMZVCRSA-N 2 0 328.422 4.006 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cccc(OC)c2)cc1 ZINC000120580286 1039181598 /nfs/dbraw/zinc/18/15/98/1039181598.db2.gz PRXFHMRHLZAGKD-KRWDZBQOSA-N 2 0 326.484 4.388 20 0 EIADRP Cc1ncc([C@H](C)NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)s1 ZINC000090409169 1039221007 /nfs/dbraw/zinc/22/10/07/1039221007.db2.gz NIZBCNXFITUOFB-AQXGTKIOSA-N 2 0 341.524 4.298 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CCC[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000414829709 1039223758 /nfs/dbraw/zinc/22/37/58/1039223758.db2.gz NZMDDXRWOHFIGE-VQTPCSAVSA-N 2 0 338.417 4.214 20 0 EIADRP CCC[N@H+](C)C[C@@H]1CC[NH+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000478000690 1039295804 /nfs/dbraw/zinc/29/58/04/1039295804.db2.gz IQXGHXSNVQBBMJ-GJZGRUSLSA-N 2 0 328.422 4.430 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1c(C)noc1C ZINC000090886759 1039317247 /nfs/dbraw/zinc/31/72/47/1039317247.db2.gz GPHUMWFGSRCGHX-LIRRHRJNSA-N 2 0 345.487 4.034 20 0 EIADRP CO[C@@H]1C[C@@H](c2ccccc2)CC[C@@H]1[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000552322732 1039379097 /nfs/dbraw/zinc/37/90/97/1039379097.db2.gz XJKASLZCPSSSOV-SESVDKBCSA-N 2 0 344.543 4.190 20 0 EIADRP c1csc([C@@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)C2CCCC2)c1 ZINC000091726562 1039389123 /nfs/dbraw/zinc/38/91/23/1039389123.db2.gz STOUOHJOIGLDEG-UZLBHIALSA-N 2 0 348.556 4.070 20 0 EIADRP c1csc([C@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)C2CCCC2)c1 ZINC000091726559 1039389965 /nfs/dbraw/zinc/38/99/65/1039389965.db2.gz STOUOHJOIGLDEG-OXJNMPFZSA-N 2 0 348.556 4.070 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(-c2ccncc2)cc1 ZINC000481429148 1039413447 /nfs/dbraw/zinc/41/34/47/1039413447.db2.gz BZJXBDHTWFXJAH-KRWDZBQOSA-N 2 0 335.495 4.416 20 0 EIADRP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000555598409 1039421131 /nfs/dbraw/zinc/42/11/31/1039421131.db2.gz ZACGXEKXCIHKNQ-RHSMWYFYSA-N 2 0 342.405 4.064 20 0 EIADRP C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000555598413 1039423625 /nfs/dbraw/zinc/42/36/25/1039423625.db2.gz ZACGXEKXCIHKNQ-YOEHRIQHSA-N 2 0 342.405 4.064 20 0 EIADRP CC[NH+]1C[C@@H]2C[NH+](C3CCC(c4ccc(Cl)cc4)CC3)C[C@H]2C1 ZINC001168347478 1039497729 /nfs/dbraw/zinc/49/77/29/1039497729.db2.gz LUFBJFFMPNMSJH-SFANZJOMSA-N 2 0 332.919 4.250 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](CCOC)c2ccccc2)CC1 ZINC000534543248 1039534335 /nfs/dbraw/zinc/53/43/35/1039534335.db2.gz NZLCBUBJJYPDOB-OAQYLSRUSA-N 2 0 332.532 4.208 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H](c2cccnc2)C2CCC2)CC1 ZINC000481637198 1039667930 /nfs/dbraw/zinc/66/79/30/1039667930.db2.gz CUENAVGSUBJGBS-OAQYLSRUSA-N 2 0 329.532 4.271 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000643534630 1039715645 /nfs/dbraw/zinc/71/56/45/1039715645.db2.gz ZEFNQKRRGHEGDC-MLGOLLRUSA-N 2 0 345.487 4.050 20 0 EIADRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1cccc(OCc2ccccc2)c1 ZINC000643534126 1039716846 /nfs/dbraw/zinc/71/68/46/1039716846.db2.gz MFXDNLNTCTXTHI-UTKZUKDTSA-N 2 0 336.479 4.058 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCOc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000429781287 1039735912 /nfs/dbraw/zinc/73/59/12/1039735912.db2.gz SLHKRVDIHLAAPB-BBRMVZONSA-N 2 0 345.314 4.034 20 0 EIADRP COc1ccc(F)cc1[C@H](C)[NH2+][C@H](C)c1cccc(C[NH+](C)C)c1 ZINC000924706954 1039776704 /nfs/dbraw/zinc/77/67/04/1039776704.db2.gz RXHKRAQBIQZVDW-CABCVRRESA-N 2 0 330.447 4.308 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(SC)c(OC)c2)CC1 ZINC000122767478 1039791979 /nfs/dbraw/zinc/79/19/79/1039791979.db2.gz IDXGVWMRWCCBHL-HNNXBMFYSA-N 2 0 336.545 4.190 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(C)cc1 ZINC000481732055 1039794429 /nfs/dbraw/zinc/79/44/29/1039794429.db2.gz WSRQUERHCZPNNP-HXUWFJFHSA-N 2 0 326.484 4.176 20 0 EIADRP c1ccc(CSCCC[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000534869030 1039821099 /nfs/dbraw/zinc/82/10/99/1039821099.db2.gz QJCYXANTBLRFNH-HXUWFJFHSA-N 2 0 332.557 4.260 20 0 EIADRP C[C@H](COc1cccc(F)c1)[NH2+][C@@H]1CCN(C)[C@H](c2ccccc2)C1 ZINC000551008618 1039861547 /nfs/dbraw/zinc/86/15/47/1039861547.db2.gz YLIHBXHXVGQXAU-BSIFCXSSSA-N 2 0 342.458 4.018 20 0 EIADRP CN1CC[C@H]([NH2+]CCc2ccc3ccccc3n2)C[C@H]1c1ccccc1 ZINC000551029284 1039887100 /nfs/dbraw/zinc/88/71/00/1039887100.db2.gz CBIANMYTINVFEZ-GMAHTHKFSA-N 2 0 345.490 4.202 20 0 EIADRP c1c2ccccc2sc1C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000537692195 1039907403 /nfs/dbraw/zinc/90/74/03/1039907403.db2.gz GKCMHQRFDBPXSI-LPHOPBHVSA-N 2 0 326.509 4.350 20 0 EIADRP C[C@@H](CC[NH+](C)C)[NH2+][C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000481955120 1039912144 /nfs/dbraw/zinc/91/21/44/1039912144.db2.gz SULWTDFXNQHYQV-BBRMVZONSA-N 2 0 347.503 4.256 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccc2ccccc2c1OC(F)F ZINC000481954308 1039912616 /nfs/dbraw/zinc/91/26/16/1039912616.db2.gz ZZEXXFSZSIDQBK-CQSZACIVSA-N 2 0 336.426 4.434 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+](C)C)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000481975023 1039923649 /nfs/dbraw/zinc/92/36/49/1039923649.db2.gz QGWIVHRRTXPUQS-STQMWFEESA-N 2 0 333.303 4.081 20 0 EIADRP Fc1ccccc1[C@@H]1CC[C@H]([NH2+]C2CCN(c3ccccn3)CC2)C1 ZINC000482074512 1039982476 /nfs/dbraw/zinc/98/24/76/1039982476.db2.gz WHXVLYNKSMJYNE-AEFFLSMTSA-N 2 0 339.458 4.115 20 0 EIADRP COC1CCC(C)(C[NH2+][C@@H]2CCN(C)[C@@H](c3ccccc3)C2)CC1 ZINC000551175564 1040018130 /nfs/dbraw/zinc/01/81/30/1040018130.db2.gz MTYKFPLPLPEVBW-NFYVFUGESA-N 2 0 330.516 4.007 20 0 EIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cc(F)cc(F)c1 ZINC000482132481 1040024925 /nfs/dbraw/zinc/02/49/25/1040024925.db2.gz YHANFRQDDNUZKB-IERDGZPVSA-N 2 0 344.449 4.008 20 0 EIADRP CC(C)CC[C@](C)(O)C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000551266770 1040130948 /nfs/dbraw/zinc/13/09/48/1040130948.db2.gz DUCTULVQMKIMSR-HRTMPFAESA-N 2 0 346.559 4.206 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2c3cc(F)ccc3C[C@@H]2C)c1 ZINC000482323923 1040164827 /nfs/dbraw/zinc/16/48/27/1040164827.db2.gz UJJGFRKNQMULGQ-YCRPNKLZSA-N 2 0 326.459 4.301 20 0 EIADRP Cc1ccc([C@H]([NH2+]CCCN2CCC(O)CC2)C2CCCCC2)cc1 ZINC000479277107 1040234413 /nfs/dbraw/zinc/23/44/13/1040234413.db2.gz IXNKTARTAXXCKN-JOCHJYFZSA-N 2 0 344.543 4.053 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@H+](CCc3ccccc3)C1)CC2 ZINC000482436764 1040246301 /nfs/dbraw/zinc/24/63/01/1040246301.db2.gz JKFZVVXQHNJRHN-NFBKMPQASA-N 2 0 334.507 4.137 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000666993720 1040364352 /nfs/dbraw/zinc/36/43/52/1040364352.db2.gz GIUWQYBUYCFZFX-CZUORRHYSA-N 2 0 326.406 4.073 20 0 EIADRP CC[C@@H](C[N@@H+](Cc1scnc1C)C[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000435447646 1040393621 /nfs/dbraw/zinc/39/36/21/1040393621.db2.gz HVSMZVGYXGXIGI-MSOLQXFVSA-N 2 0 343.540 4.057 20 0 EIADRP CCCCOc1ccc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1OCC ZINC000666996982 1040416773 /nfs/dbraw/zinc/41/67/73/1040416773.db2.gz OWFIKPKZZOVKGE-GOSISDBHSA-N 2 0 346.515 4.029 20 0 EIADRP CCC1(Cc2ccccc2)CC[NH+]([C@@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000479540564 1040445566 /nfs/dbraw/zinc/44/55/66/1040445566.db2.gz GHACOGIEPKFVBY-NHCUHLMSSA-N 2 0 326.528 4.348 20 0 EIADRP c1cc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)n(-c2cc[nH+]cc2)n1 ZINC000668110550 1040449111 /nfs/dbraw/zinc/44/91/11/1040449111.db2.gz IZYMAEGAYBQXDC-NUZGMZIFSA-N 2 0 344.462 4.178 20 0 EIADRP C[C@H]([NH2+]CCCc1ccccc1F)c1cccc(OCC[NH+](C)C)c1 ZINC000479550417 1040456173 /nfs/dbraw/zinc/45/61/73/1040456173.db2.gz BUXWIQOKLMWUGW-KRWDZBQOSA-N 2 0 344.474 4.050 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000551788674 1040601570 /nfs/dbraw/zinc/60/15/70/1040601570.db2.gz DYZLQAPHTAIMRQ-IAGOWNOFSA-N 2 0 328.422 4.273 20 0 EIADRP C[C@H](c1cccc2ccccc21)[NH+]1CCC([C@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000515342939 1040678356 /nfs/dbraw/zinc/67/83/56/1040678356.db2.gz MWOKYXVAGWWNTI-ZWDAVXSWSA-N 2 0 338.495 4.119 20 0 EIADRP Cc1ccccc1[C@@H](CC(C)C)[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000483199006 1040756144 /nfs/dbraw/zinc/75/61/44/1040756144.db2.gz NGWMSJMHMOTFDK-DENIHFKCSA-N 2 0 344.543 4.173 20 0 EIADRP C[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1cccc(OC(F)F)c1 ZINC000483201211 1040760572 /nfs/dbraw/zinc/76/05/72/1040760572.db2.gz PKQSOPNNXDTTFM-BBRMVZONSA-N 2 0 328.447 4.305 20 0 EIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)CCCC3CCCC3)CC2)CC1 ZINC000483220390 1040776876 /nfs/dbraw/zinc/77/68/76/1040776876.db2.gz WNOSGXPAZUVPPB-UHFFFAOYSA-N 2 0 349.607 4.085 20 0 EIADRP Cc1ccc(C[C@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)s1 ZINC000483309713 1040814808 /nfs/dbraw/zinc/81/48/08/1040814808.db2.gz UONVPHHMTDPIKQ-RDJZCZTQSA-N 2 0 346.540 4.279 20 0 EIADRP COc1ccc(C[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)cc1Cl ZINC000462671755 1040819165 /nfs/dbraw/zinc/81/91/65/1040819165.db2.gz DEUYEWFVOZVPKV-HOTGVXAUSA-N 2 0 338.923 4.196 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000483483450 1040872991 /nfs/dbraw/zinc/87/29/91/1040872991.db2.gz NNFKUGPRECHSNE-FRFSOERESA-N 2 0 326.406 4.183 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(OC)c3ccccc32)CC1 ZINC000480139540 1040987282 /nfs/dbraw/zinc/98/72/82/1040987282.db2.gz LWSVCKJSDQECBQ-MRXNPFEDSA-N 2 0 326.484 4.373 20 0 EIADRP CCN(CC)[C@H](C[NH2+][C@H](c1cccnc1)C(C)C)c1ccccc1 ZINC000538060566 1041031388 /nfs/dbraw/zinc/03/13/88/1041031388.db2.gz NNKYZICGTMYVAD-RTWAWAEBSA-N 2 0 325.500 4.451 20 0 EIADRP F[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000554374163 1041057553 /nfs/dbraw/zinc/05/75/53/1041057553.db2.gz PKOFMVVZQXZXPM-HGJUEJDCSA-N 2 0 330.491 4.157 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)[C@H](C)C1 ZINC000436293352 1041059666 /nfs/dbraw/zinc/05/96/66/1041059666.db2.gz CWRYXMKBPIFSNM-MOIQIXESSA-N 2 0 340.433 4.271 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@H](c2ccccc2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000436292875 1041061186 /nfs/dbraw/zinc/06/11/86/1041061186.db2.gz MCCJWVHHHLRDQQ-YYWHXJBOSA-N 2 0 338.495 4.224 20 0 EIADRP CCOc1ccc(C[NH2+][C@@H](C)c2cccc(C[NH+](C)C)c2)cc1OC ZINC000924654650 1041087812 /nfs/dbraw/zinc/08/78/12/1041087812.db2.gz DVUBSUDTUKFKQT-INIZCTEOSA-N 2 0 342.483 4.006 20 0 EIADRP CC(C)C[C@@H]([NH3+])c1nc2ccccc2n1C1CC[NH+](CC2CC2)CC1 ZINC001168362695 1041109804 /nfs/dbraw/zinc/10/98/04/1041109804.db2.gz CEBHTCIYWXDXCZ-GOSISDBHSA-N 2 0 340.515 4.129 20 0 EIADRP C[C@H](CCCC(F)(F)F)[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000480253194 1041133943 /nfs/dbraw/zinc/13/39/43/1041133943.db2.gz WOSGGUXKBRVXJV-AEFFLSMTSA-N 2 0 342.449 4.262 20 0 EIADRP Cc1ccccc1O[C@H]1CCCC[C@H]1[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000538193726 1041160035 /nfs/dbraw/zinc/16/00/35/1041160035.db2.gz CDXDNKAIVPTZQF-IRLDBZIGSA-N 2 0 342.527 4.149 20 0 EIADRP CCCC[C@H](CCC)C[NH2+][C@H]1CCN(Cc2ccccn2)C[C@@H]1C ZINC000484306408 1041193524 /nfs/dbraw/zinc/19/35/24/1041193524.db2.gz WPXAPDOBMHOKAL-ZJOUEHCJSA-N 2 0 331.548 4.488 20 0 EIADRP Cc1nccn1C[C@@H](C)C[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000540170104 1041211464 /nfs/dbraw/zinc/21/14/64/1041211464.db2.gz YSABVYQJEXRRNP-RYUDHWBXSA-N 2 0 326.271 4.485 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCC1 ZINC000540163764 1041226534 /nfs/dbraw/zinc/22/65/34/1041226534.db2.gz JQNRLHHFLQVDPH-SUMWQHHRSA-N 2 0 341.326 4.345 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)CC1 ZINC000436410596 1041230210 /nfs/dbraw/zinc/23/02/10/1041230210.db2.gz KPJYFERODCISGG-UHFFFAOYSA-N 2 0 334.813 4.180 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC(C)(C)c1c(F)cccc1Cl ZINC000540188949 1041231974 /nfs/dbraw/zinc/23/19/74/1041231974.db2.gz MXWPAJHLSJZFEN-DVOMOZLQSA-N 2 0 326.887 4.075 20 0 EIADRP C[NH+](C)CCCOc1ccc(C[NH2+]Cc2ccsc2Cl)cc1 ZINC000480364211 1041246890 /nfs/dbraw/zinc/24/68/90/1041246890.db2.gz MBJCNNPPXSYQDA-UHFFFAOYSA-N 2 0 338.904 4.022 20 0 EIADRP COc1ccc2cc([C@H](C)[NH2+][C@@H]3CCC[C@@H]([NH+](C)C)C3)ccc2c1 ZINC000484471719 1041248385 /nfs/dbraw/zinc/24/83/85/1041248385.db2.gz ILZUVRGOJICWPD-CWFSZBLJSA-N 2 0 326.484 4.372 20 0 EIADRP CSc1ccccc1[C@H](C)[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000194873916 1041249592 /nfs/dbraw/zinc/24/95/92/1041249592.db2.gz QSFZRNKOSZWJJE-INIZCTEOSA-N 2 0 344.524 4.200 20 0 EIADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)C1 ZINC000484472562 1041250222 /nfs/dbraw/zinc/25/02/22/1041250222.db2.gz KVMMPHJPXGJDCA-VBQJREDUSA-N 2 0 342.405 4.035 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000554586094 1041261517 /nfs/dbraw/zinc/26/15/17/1041261517.db2.gz QRJVEHBCPXBRTP-SFHVURJKSA-N 2 0 340.433 4.478 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2cc3cccc(OC)c3o2)CC1 ZINC000538395358 1041312808 /nfs/dbraw/zinc/31/28/08/1041312808.db2.gz LQMINTDAXAHCPZ-OAHLLOKOSA-N 2 0 330.472 4.214 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)C[NH2+]C2CCN(c3ccccc3)CC2)C1 ZINC000463076624 1041322939 /nfs/dbraw/zinc/32/29/39/1041322939.db2.gz KLDJBHSPMMNVJY-RTBURBONSA-N 2 0 343.559 4.002 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(OCC3CCCCC3)c2)CC[N@@H+]1C ZINC000538411213 1041330007 /nfs/dbraw/zinc/33/00/07/1041330007.db2.gz XUYZHNNVBKUPNU-XLIONFOSSA-N 2 0 330.516 4.218 20 0 EIADRP COC[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)C(C)C ZINC000480540862 1041374307 /nfs/dbraw/zinc/37/43/07/1041374307.db2.gz YIDJVPKPZJFOKS-JOCHJYFZSA-N 2 0 340.511 4.176 20 0 EIADRP c1ccc(C[N@@H+]2CC[C@]3(CC[NH+]([C@H]4C[C@@H]4c4ccccc4)C3)C2)cc1 ZINC000463195390 1041410023 /nfs/dbraw/zinc/41/00/23/1041410023.db2.gz WXQLQIMQIKDFFF-VJBWXMMDSA-N 2 0 332.491 4.141 20 0 EIADRP c1ccc(C[N@@H+]2CC[C@]3(CC[NH+]([C@@H]4C[C@H]4c4ccccc4)C3)C2)cc1 ZINC000463195392 1041410892 /nfs/dbraw/zinc/41/08/92/1041410892.db2.gz WXQLQIMQIKDFFF-ZRBLBEILSA-N 2 0 332.491 4.141 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH+]2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)cc1 ZINC000667706285 1041422473 /nfs/dbraw/zinc/42/24/73/1041422473.db2.gz WBQTYGYDSJMMNF-RBUKOAKNSA-N 2 0 341.524 4.035 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CCSCc2ccc(Cl)cc2Cl)CC[N@@H+]1C ZINC000540396774 1041439923 /nfs/dbraw/zinc/43/99/23/1041439923.db2.gz DLILSPOWAWAWBZ-SWLSCSKDSA-N 2 0 347.355 4.299 20 0 EIADRP CC(C)CCn1cccc1C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000538613377 1041442611 /nfs/dbraw/zinc/44/26/11/1041442611.db2.gz PPWKNFRJQGBMPZ-UHFFFAOYSA-N 2 0 339.527 4.420 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(F)cc1N(C)C ZINC000480638493 1041450174 /nfs/dbraw/zinc/45/01/74/1041450174.db2.gz IXZQRFUQUVQIIR-IAGOWNOFSA-N 2 0 335.511 4.197 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc(OCC2CC2)cc1 ZINC000480659344 1041458239 /nfs/dbraw/zinc/45/82/39/1041458239.db2.gz FLWYDUWMAUDAFJ-GOSISDBHSA-N 2 0 330.516 4.220 20 0 EIADRP COc1ccc([C@H](CCC(C)C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000480692418 1041475798 /nfs/dbraw/zinc/47/57/98/1041475798.db2.gz IGUSJXWGIZQOAW-SBHAEUEKSA-N 2 0 330.516 4.389 20 0 EIADRP COc1ccc([C@H](CCC(C)C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000480749106 1041505148 /nfs/dbraw/zinc/50/51/48/1041505148.db2.gz ZWJARYOOIGBSRA-UTKZUKDTSA-N 2 0 330.516 4.246 20 0 EIADRP c1cc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc(-c2ccncc2)c1 ZINC000538799317 1041539011 /nfs/dbraw/zinc/53/90/11/1041539011.db2.gz YOXZFEVMKODDEY-GMAHTHKFSA-N 2 0 347.506 4.197 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](c1cc2ccccc2o1)C(C)C ZINC000540657013 1041590478 /nfs/dbraw/zinc/59/04/78/1041590478.db2.gz UNBGNBZZDLCVDO-YLJYHZDGSA-N 2 0 332.488 4.076 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]C1CCC([NH+]3CCC(C)CC3)CC1)CC2 ZINC000539040841 1041617070 /nfs/dbraw/zinc/61/70/70/1041617070.db2.gz SXOGWDXVDAAOBL-AJTFCVKESA-N 2 0 342.527 4.315 20 0 EIADRP C[NH+]1CCC2(C[NH+](Cc3ccc(-c4ccccc4Cl)o3)C2)CC1 ZINC001204739813 1041698423 /nfs/dbraw/zinc/69/84/23/1041698423.db2.gz YCSPXCZDXFWWKY-UHFFFAOYSA-N 2 0 330.859 4.128 20 0 EIADRP COc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(C)c1 ZINC000540962863 1041753241 /nfs/dbraw/zinc/75/32/41/1041753241.db2.gz XRCHRDRUYPJUDB-GHTZIAJQSA-N 2 0 338.495 4.004 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc3nc(C)ccc3c2)CC1 ZINC000437579758 1041845792 /nfs/dbraw/zinc/84/57/92/1041845792.db2.gz MCQZTKYHHPWFOP-UHFFFAOYSA-N 2 0 339.527 4.487 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](C)CC(F)(F)F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000402757738 1042005210 /nfs/dbraw/zinc/00/52/10/1042005210.db2.gz GDVVHUYJVJMJAI-ZMSDIMECSA-N 2 0 328.422 4.075 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C[C@H](C)C[NH+](C)C ZINC000425945132 1042033247 /nfs/dbraw/zinc/03/32/47/1042033247.db2.gz JOLZMWAQPTXENL-QWHCGFSZSA-N 2 0 335.492 4.106 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12)CC(F)(F)F ZINC000402796800 1042041334 /nfs/dbraw/zinc/04/13/34/1042041334.db2.gz VYJVFJGJJHIOAA-XOYOTBSWSA-N 2 0 340.433 4.075 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@H](C)C[NH+](C)C ZINC000425951437 1042067122 /nfs/dbraw/zinc/06/71/22/1042067122.db2.gz MQKMNCBRCRUQQP-GJZGRUSLSA-N 2 0 331.529 4.275 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)CC1 ZINC000438178540 1042072686 /nfs/dbraw/zinc/07/26/86/1042072686.db2.gz OSJDILNUWKQMNW-DLBZAZTESA-N 2 0 334.470 4.455 20 0 EIADRP C[C@@H](C[NH2+][C@@H]1CCCc2nc(-c3ccccc3F)sc21)C[NH+](C)C ZINC000425955491 1042079384 /nfs/dbraw/zinc/07/93/84/1042079384.db2.gz ZYPGDKRCFKQRHJ-XJKSGUPXSA-N 2 0 347.503 4.114 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](CSC)c2ccc(C(F)(F)F)cc2)C1 ZINC000541916179 1042178699 /nfs/dbraw/zinc/17/86/99/1042178699.db2.gz DTIGOMLQKZAYKM-CJNGLKHVSA-N 2 0 346.462 4.041 20 0 EIADRP Fc1ccc2c(c1)CC[C@H]([NH2+]CC1CC[NH+](C3CCCCC3)CC1)C2 ZINC001168406993 1042257706 /nfs/dbraw/zinc/25/77/06/1042257706.db2.gz KYRLYAMDNMGHKO-NRFANRHFSA-N 2 0 344.518 4.317 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]C1CC[NH+](CC(C)C)CC1)CC3 ZINC000491342141 1042407421 /nfs/dbraw/zinc/40/74/21/1042407421.db2.gz HVTQLOQXCANIJL-GOSISDBHSA-N 2 0 339.527 4.044 20 0 EIADRP CC(C)CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)C(C)(C)C ZINC000518249774 1042439084 /nfs/dbraw/zinc/43/90/84/1042439084.db2.gz BLYZNYMJCPNXQS-UFYCRDLUSA-N 2 0 338.580 4.195 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCCOc2ccccc2)C1 ZINC000303657674 1042492183 /nfs/dbraw/zinc/49/21/83/1042492183.db2.gz VEFNWMSIQKHOGN-UXHICEINSA-N 2 0 330.516 4.042 20 0 EIADRP Clc1ccc(CCC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167964364 1042594886 /nfs/dbraw/zinc/59/48/86/1042594886.db2.gz POAKFWTXIFKWAI-IHWFROFDSA-N 2 0 332.919 4.268 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(OC(C)C)c(Cl)c2)[C@@H](C)C1 ZINC000492335648 1042611378 /nfs/dbraw/zinc/61/13/78/1042611378.db2.gz SQMUEZOROOSWCW-YJBOKZPZSA-N 2 0 338.923 4.289 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000415004119 1042737816 /nfs/dbraw/zinc/73/78/16/1042737816.db2.gz NUHCPKVLIWDWEP-LMQGHGSNSA-N 2 0 330.516 4.217 20 0 EIADRP C[C@@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415005626 1042794044 /nfs/dbraw/zinc/79/40/44/1042794044.db2.gz JGMMUVNYUZOSIO-DOPJRALCSA-N 2 0 340.433 4.004 20 0 EIADRP Cc1ccc2c(CC[NH3+])cn(C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)c2c1 ZINC001167965383 1042794127 /nfs/dbraw/zinc/79/41/27/1042794127.db2.gz DKMPPZLFHFATIY-YOFSQIOKSA-N 2 0 337.511 4.029 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](c1ccccc1)c1ccc(C)cc1 ZINC000493075096 1042811172 /nfs/dbraw/zinc/81/11/72/1042811172.db2.gz BIOFOMOEGYKOMV-YADHBBJMSA-N 2 0 340.511 4.031 20 0 EIADRP c1ccc(CSCCC[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000536382715 1042816726 /nfs/dbraw/zinc/81/67/26/1042816726.db2.gz NEUBRQROERRPBU-HXUWFJFHSA-N 2 0 332.557 4.118 20 0 EIADRP Fc1cc(Cl)cc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000309682204 1042818849 /nfs/dbraw/zinc/81/88/49/1042818849.db2.gz BESKXQBWUIXEOG-MRXNPFEDSA-N 2 0 332.850 4.091 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000309876394 1042823546 /nfs/dbraw/zinc/82/35/46/1042823546.db2.gz JCDHVRIXCGSZSY-MSOLQXFVSA-N 2 0 326.484 4.256 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(Cl)s1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309912991 1042824562 /nfs/dbraw/zinc/82/45/62/1042824562.db2.gz MWGOGHDMVJUKMZ-ZBFHGGJFSA-N 2 0 334.916 4.402 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(Cl)s1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309912988 1042824617 /nfs/dbraw/zinc/82/46/17/1042824617.db2.gz MWGOGHDMVJUKMZ-GDBMZVCRSA-N 2 0 334.916 4.402 20 0 EIADRP C[C@@H]([NH2+]CCSc1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310170867 1042829862 /nfs/dbraw/zinc/82/98/62/1042829862.db2.gz UAUPBAFOHWMDDW-QUCCMNQESA-N 2 0 340.536 4.279 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000310473094 1042838263 /nfs/dbraw/zinc/83/82/63/1042838263.db2.gz BXUBODHVCUMBPF-ABSDTBQOSA-N 2 0 326.459 4.387 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310537053 1042839564 /nfs/dbraw/zinc/83/95/64/1042839564.db2.gz RNGFZEDVUMOLHA-ABSDTBQOSA-N 2 0 326.459 4.387 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)[C@H](C)C2 ZINC000493206339 1042843570 /nfs/dbraw/zinc/84/35/70/1042843570.db2.gz QIQZHFIGICTPRM-QVKFZJNVSA-N 2 0 326.459 4.219 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000310998859 1042850172 /nfs/dbraw/zinc/85/01/72/1042850172.db2.gz UVEIKUHUHJNACO-WFXMLNOXSA-N 2 0 338.495 4.256 20 0 EIADRP C[C@H]([NH2+]Cc1cccc2cc[nH]c21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311064208 1042852232 /nfs/dbraw/zinc/85/22/32/1042852232.db2.gz JCQRFOBBWYZVPE-UWJYYQICSA-N 2 0 333.479 4.168 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)[C@@H](C)C2 ZINC000493235789 1042853755 /nfs/dbraw/zinc/85/37/55/1042853755.db2.gz YTENCBLNNYGOJV-JTSKRJEESA-N 2 0 335.495 4.130 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H](C)c1ccsc1 ZINC000178132253 1042859349 /nfs/dbraw/zinc/85/93/49/1042859349.db2.gz YENZUBPKCYZDOP-INIZCTEOSA-N 2 0 332.513 4.320 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C2CC(F)(F)C2)cc1C[NH+]1CCCCC1 ZINC000760040651 1042892848 /nfs/dbraw/zinc/89/28/48/1042892848.db2.gz UJLLRWYYEFDJGX-CQSZACIVSA-N 2 0 338.442 4.129 20 0 EIADRP COC[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(Cl)cc1 ZINC000493884681 1042970458 /nfs/dbraw/zinc/97/04/58/1042970458.db2.gz ZNNQGCITJNPICD-QFBILLFUSA-N 2 0 338.923 4.272 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)[C@@H](OC)c1ccccc1 ZINC000493915908 1042976812 /nfs/dbraw/zinc/97/68/12/1042976812.db2.gz GGEYUNGIIGEPJN-PGRDOPGGSA-N 2 0 340.511 4.394 20 0 EIADRP CCCc1csc(C[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)n1 ZINC000494174594 1043025098 /nfs/dbraw/zinc/02/50/98/1043025098.db2.gz AOJYHIXSIDYSBZ-UHFFFAOYSA-N 2 0 335.561 4.228 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccccc1N(C)C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183195435 1043040244 /nfs/dbraw/zinc/04/02/44/1043040244.db2.gz VVPWURMSYYSBGE-FGTMMUONSA-N 2 0 329.532 4.056 20 0 EIADRP Cc1cc(F)ccc1C[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000310070959 1043099519 /nfs/dbraw/zinc/09/95/19/1043099519.db2.gz ACFSARWIWJXXAN-LJQANCHMSA-N 2 0 326.459 4.136 20 0 EIADRP FC(F)(F)c1ccc2c(NC[C@H]3CC[N@@H+](C4CC4)C3)cc[nH+]c2c1 ZINC000516143218 1043122145 /nfs/dbraw/zinc/12/21/45/1043122145.db2.gz KOVYWBYFLJSGOA-GFCCVEGCSA-N 2 0 335.373 4.150 20 0 EIADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CCCC1 ZINC000665246946 1043222915 /nfs/dbraw/zinc/22/29/15/1043222915.db2.gz RTWIRAJQVYAVTO-HZPDHXFCSA-N 2 0 326.406 4.203 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CC2(c3ccc(F)cc3Cl)CCCC2)CC[N@@H+]1C ZINC000427882718 1043247273 /nfs/dbraw/zinc/24/72/73/1043247273.db2.gz ANQQNIRAJHNZNV-HOCLYGCPSA-N 2 0 338.898 4.363 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2c(C)cc(C)c(C(C)=O)c2C)CC1 ZINC000520790621 1043254874 /nfs/dbraw/zinc/25/48/74/1043254874.db2.gz WPSVYYPXUBWCHV-UHFFFAOYSA-N 2 0 344.543 4.368 20 0 EIADRP CSCCCCC[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000186772630 1043308396 /nfs/dbraw/zinc/30/83/96/1043308396.db2.gz SZBDANACFHFKGN-SLFFLAALSA-N 2 0 332.557 4.020 20 0 EIADRP Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000665272161 1043477431 /nfs/dbraw/zinc/47/74/31/1043477431.db2.gz ZPMPOKKSJQOYJG-KGSLCBSSSA-N 2 0 347.506 4.041 20 0 EIADRP Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000665272162 1043477825 /nfs/dbraw/zinc/47/78/25/1043477825.db2.gz ZPMPOKKSJQOYJG-QXUYBEEESA-N 2 0 347.506 4.041 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)C1 ZINC000065932243 1043508234 /nfs/dbraw/zinc/50/82/34/1043508234.db2.gz SOFXTINHXNEHQK-MRXNPFEDSA-N 2 0 346.421 4.189 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccnn1-c1ccccc1 ZINC000467364159 1043580698 /nfs/dbraw/zinc/58/06/98/1043580698.db2.gz JIHAYROLHMUBSG-RBUKOAKNSA-N 2 0 340.515 4.178 20 0 EIADRP C[C@@H](CC[NH2+][C@@H](C)c1cccc(OC(F)F)c1)[NH+]1CCCCC1 ZINC000542487810 1043772998 /nfs/dbraw/zinc/77/29/98/1043772998.db2.gz APFSYCUZGDLQKI-GJZGRUSLSA-N 2 0 326.431 4.203 20 0 EIADRP C[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1cccc(OC(F)F)c1 ZINC000542487814 1043798985 /nfs/dbraw/zinc/79/89/85/1043798985.db2.gz APFSYCUZGDLQKI-LSDHHAIUSA-N 2 0 326.431 4.203 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)C1 ZINC000731678394 1043815123 /nfs/dbraw/zinc/81/51/23/1043815123.db2.gz LQXILVUBFUAGCK-SFHVURJKSA-N 2 0 330.516 4.000 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)C1 ZINC000731678393 1043815149 /nfs/dbraw/zinc/81/51/49/1043815149.db2.gz LQXILVUBFUAGCK-GOSISDBHSA-N 2 0 330.516 4.000 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2Cc3[nH]c4ccccc4c3C2)c1 ZINC000442710304 1043815183 /nfs/dbraw/zinc/81/51/83/1043815183.db2.gz PSHGICDGVSMXAO-IBGZPJMESA-N 2 0 347.506 4.267 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CC(C)(C)c2ccc(C(F)(F)F)cc2)CC[N@@H+]1C ZINC000191548943 1043825079 /nfs/dbraw/zinc/82/50/79/1043825079.db2.gz MDHZUEBSKVIIJX-CJNGLKHVSA-N 2 0 328.422 4.055 20 0 EIADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000494592881 1043835198 /nfs/dbraw/zinc/83/51/98/1043835198.db2.gz VGOIGLAGBKSVCT-DZVQBONVSA-N 2 0 344.543 4.395 20 0 EIADRP C[NH+](C)CCOc1ccc(CC[NH2+]Cc2cccc3ccccc32)cc1 ZINC000521829640 1043996536 /nfs/dbraw/zinc/99/65/36/1043996536.db2.gz PWBRMVMKBUFTSU-UHFFFAOYSA-N 2 0 348.490 4.113 20 0 EIADRP Cc1nccn1C[C@H](C)C[NH2+]Cc1ccc(-c2ccc(F)cc2)s1 ZINC000521856325 1044031245 /nfs/dbraw/zinc/03/12/45/1044031245.db2.gz SMRFJGGXQWEIMN-CQSZACIVSA-N 2 0 343.471 4.485 20 0 EIADRP C[C@H]([NH2+]CCc1ccc(F)cc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000428271201 1044065038 /nfs/dbraw/zinc/06/50/38/1044065038.db2.gz YHMKTQBJKAQMKQ-HOCLYGCPSA-N 2 0 338.898 4.264 20 0 EIADRP C[C@@H]1CC(n2cc3cc(C[NH3+])ccc3n2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168015201 1044075183 /nfs/dbraw/zinc/07/51/83/1044075183.db2.gz PMGFFALJBGJOBK-IAGOWNOFSA-N 2 0 348.494 4.109 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCC[C@H]1[C@H]1CCOC1 ZINC000474043036 1044165827 /nfs/dbraw/zinc/16/58/27/1044165827.db2.gz YUZAUSYSQXRLHW-FDFHNCONSA-N 2 0 344.543 4.212 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCC[C@@H]1[C@H]1CCOC1 ZINC000474043030 1044167841 /nfs/dbraw/zinc/16/78/41/1044167841.db2.gz YUZAUSYSQXRLHW-BHDDXSALSA-N 2 0 344.543 4.212 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@@H]2Cc3cccc(Cl)c3C2)CC1 ZINC001168714743 1044271862 /nfs/dbraw/zinc/27/18/62/1044271862.db2.gz KYLPZLLQLOQXJN-KBAYOESNSA-N 2 0 332.919 4.322 20 0 EIADRP C[C@@H](Cc1ccoc1)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658317270 1044301099 /nfs/dbraw/zinc/30/10/99/1044301099.db2.gz KBPMAQSBOBACFD-RXVVDRJESA-N 2 0 338.495 4.103 20 0 EIADRP C[C@@H]1C[C@@H](NCc2cccc(Cl)n2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168018150 1044321489 /nfs/dbraw/zinc/32/14/89/1044321489.db2.gz YUBJRCBIKSYUSO-HGKCTWBKSA-N 2 0 343.902 4.266 20 0 EIADRP CCCOc1ccc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)c(C)c1 ZINC000474086978 1044435859 /nfs/dbraw/zinc/43/58/59/1044435859.db2.gz CUWZXROVBRJZKO-UHFFFAOYSA-N 2 0 330.516 4.280 20 0 EIADRP Clc1ccc2c(c1Cl)CC[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000675752481 1044465698 /nfs/dbraw/zinc/46/56/98/1044465698.db2.gz XJMPTKVKZHEKCW-MKBNYLNASA-N 2 0 325.283 4.197 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H]2CCCC[C@@H]2c2ccc(OC)c(F)c2)CC1 ZINC000675818723 1044513708 /nfs/dbraw/zinc/51/37/08/1044513708.db2.gz IPAUVTJYKUKGNT-UYAOXDASSA-N 2 0 348.506 4.182 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000675819358 1044517495 /nfs/dbraw/zinc/51/74/95/1044517495.db2.gz ZOPQRUIOGQSYLH-MRXNPFEDSA-N 2 0 327.299 4.302 20 0 EIADRP C[C@H](C[NH2+][C@@H](C[C@H]1CCOC1)c1ccc(F)cc1)C[NH+]1CCCCC1 ZINC000494926701 1044523409 /nfs/dbraw/zinc/52/34/09/1044523409.db2.gz YSMOKHMCHGJFCK-OPYAIIAOSA-N 2 0 348.506 4.005 20 0 EIADRP C[NH+](C)CC(C)(C)CNc1ccc2c(c1)C[N@@H+](Cc1ccccc1)C2 ZINC001168769153 1044534119 /nfs/dbraw/zinc/53/41/19/1044534119.db2.gz NLGHRMVMYSIIPD-UHFFFAOYSA-N 2 0 337.511 4.202 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[NH+]1CCC([NH3+])(c2ccc(Cl)cc2)CC1 ZINC001168475300 1044587967 /nfs/dbraw/zinc/58/79/67/1044587967.db2.gz XJIPEGSBZHVSNB-OAHLLOKOSA-N 2 0 346.877 4.360 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000495092744 1044665675 /nfs/dbraw/zinc/66/56/75/1044665675.db2.gz IPGZZMDQKMKWKW-GHTZIAJQSA-N 2 0 348.506 4.005 20 0 EIADRP CS[C@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCCCC2)C1 ZINC000735324615 1044794977 /nfs/dbraw/zinc/79/49/77/1044794977.db2.gz VXTOYVODHJRUCC-UXHICEINSA-N 2 0 332.557 4.436 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)[C@H]1CCCO1 ZINC000544362328 1044823006 /nfs/dbraw/zinc/82/30/06/1044823006.db2.gz CSIPBKRVDJOBMW-HTAPYJJXSA-N 2 0 338.495 4.072 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+]C/C(C)=C/c2cccc(C(F)(F)F)c2)C1 ZINC000673600439 1044854472 /nfs/dbraw/zinc/85/44/72/1044854472.db2.gz XCQRJQGARZZKLI-IDJPSDCMSA-N 2 0 326.406 4.040 20 0 EIADRP COc1ccc2nc(C[NH2+]CCCC[N@@H+]3CCCC[C@@H]3C)sc2c1 ZINC000474346089 1044871307 /nfs/dbraw/zinc/87/13/07/1044871307.db2.gz CLGDAFMYVCVCMB-HNNXBMFYSA-N 2 0 347.528 4.049 20 0 EIADRP Clc1ccc(CCCC[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1Cl ZINC000474458783 1045007563 /nfs/dbraw/zinc/00/75/63/1045007563.db2.gz JBKKYJGSBCWODQ-OAHLLOKOSA-N 2 0 341.326 4.390 20 0 EIADRP CCOc1ccc(C[NH2+]C2CCC([NH+]3CCCCC3)CC2)cc1F ZINC000785483072 1045033122 /nfs/dbraw/zinc/03/31/22/1045033122.db2.gz SCFRCWTXQDOJHX-UHFFFAOYSA-N 2 0 334.479 4.111 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cn2cnc3cc(C)c(C)cc32)CC1 ZINC000738068272 1045033963 /nfs/dbraw/zinc/03/39/63/1045033963.db2.gz ZQFQYJPFGIGGKT-UHFFFAOYSA-N 2 0 342.531 4.055 20 0 EIADRP CC(C)Oc1ccc2ccccc2c1C[NH2+]CC1CC[NH+](C)CC1 ZINC000738430756 1045059628 /nfs/dbraw/zinc/05/96/28/1045059628.db2.gz PEYARIQUZVLAIA-UHFFFAOYSA-N 2 0 326.484 4.058 20 0 EIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)[C@H](C)c1nc(C(C)(C)C)no1 ZINC000626062538 1045165382 /nfs/dbraw/zinc/16/53/82/1045165382.db2.gz WESXYHBEGPJFHD-OAHLLOKOSA-N 2 0 344.503 4.012 20 0 EIADRP CC(C)(C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)c1cccs1 ZINC000236728214 1045364377 /nfs/dbraw/zinc/36/43/77/1045364377.db2.gz XGPQYDDTDHQQEG-UHFFFAOYSA-N 2 0 342.552 4.322 20 0 EIADRP CCn1c2ccccc2c2cc(C[NH2+]CC3CC[NH+](C)CC3)ccc21 ZINC000237005129 1045373069 /nfs/dbraw/zinc/37/30/69/1045373069.db2.gz JVOJUKJZDGMPKY-UHFFFAOYSA-N 2 0 335.495 4.246 20 0 EIADRP CN(Cc1ccc(C(F)F)nc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000638032336 1045483256 /nfs/dbraw/zinc/48/32/56/1045483256.db2.gz YSQZQQYIMTXEQM-UHFFFAOYSA-N 2 0 345.437 4.116 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCc3cc(F)ccc32)cc1 ZINC000325990631 1045522347 /nfs/dbraw/zinc/52/23/47/1045522347.db2.gz CSTKKZPKOZHRTM-NRFANRHFSA-N 2 0 326.459 4.445 20 0 EIADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(c2nc(C(C)(C)C)cs2)CC1 ZINC000767384197 1045524999 /nfs/dbraw/zinc/52/49/99/1045524999.db2.gz TYTIKTLSAGVVKA-MRXNPFEDSA-N 2 0 335.561 4.104 20 0 EIADRP Cc1cc(F)ccc1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000397552309 1045640374 /nfs/dbraw/zinc/64/03/74/1045640374.db2.gz YAZGTCUTPTWOSW-UHFFFAOYSA-N 2 0 326.459 4.136 20 0 EIADRP CCc1nc(CN2CCC(C[NH2+]C[C@@H](C)C(C)(C)C)CC2)cs1 ZINC000670267610 1045760331 /nfs/dbraw/zinc/76/03/31/1045760331.db2.gz LYRISBUEXCMNMW-OAHLLOKOSA-N 2 0 337.577 4.189 20 0 EIADRP C[C@@H](Cc1ccccc1Cl)[NH2+]CC1CC[NH+](CC2CCC2)CC1 ZINC001170261275 1045959671 /nfs/dbraw/zinc/95/96/71/1045959671.db2.gz PHXXRTZSACJRIP-INIZCTEOSA-N 2 0 334.935 4.373 20 0 EIADRP CCc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000769867258 1046085841 /nfs/dbraw/zinc/08/58/41/1046085841.db2.gz JFBIELGINBPJJC-MRXNPFEDSA-N 2 0 341.499 4.382 20 0 EIADRP CCc1noc(C)c1[C@H](C)[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000769875462 1046102987 /nfs/dbraw/zinc/10/29/87/1046102987.db2.gz USFYGXJBNJVEAU-HNNXBMFYSA-N 2 0 329.488 4.236 20 0 EIADRP CCCOc1ccc([C@@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459390205 1046146487 /nfs/dbraw/zinc/14/64/87/1046146487.db2.gz PDWQAYLZMLQUEM-QGZVFWFLSA-N 2 0 339.483 4.190 20 0 EIADRP Cc1ccc(C[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)c(C)c1 ZINC000164494658 1046318549 /nfs/dbraw/zinc/31/85/49/1046318549.db2.gz ZZYIWQLTDNRIQN-SFHVURJKSA-N 2 0 326.484 4.095 20 0 EIADRP Cc1ccc(C)c([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c1 ZINC000162549924 1046327554 /nfs/dbraw/zinc/32/75/54/1046327554.db2.gz HKDJZROYLLCRJT-SFHVURJKSA-N 2 0 326.484 4.095 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000126171309 1046450885 /nfs/dbraw/zinc/45/08/85/1046450885.db2.gz AHRAXOAROSRROI-OAHLLOKOSA-N 2 0 343.540 4.419 20 0 EIADRP Cc1cc(N2CCC[C@H]([NH+](C)C)CC2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000428673142 1046516045 /nfs/dbraw/zinc/51/60/45/1046516045.db2.gz SQWWQSAYCYEKMC-AWEZNQCLSA-N 2 0 349.425 4.065 20 0 EIADRP C[C@@H]([N@H+](C)Cc1ccccc1N(C)C1CC[NH+](C)CC1)C(C)(C)C ZINC000536655870 1046602686 /nfs/dbraw/zinc/60/26/86/1046602686.db2.gz BTHLHEPXCHMRDA-QGZVFWFLSA-N 2 0 331.548 4.083 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(C)c(OC(F)F)c(C)c2)[C@@H](C)C1 ZINC000536660002 1046626704 /nfs/dbraw/zinc/62/67/04/1046626704.db2.gz SASDIZZBPCSPCK-RDJZCZTQSA-N 2 0 340.458 4.067 20 0 EIADRP COc1ccc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c2ccccc12 ZINC000536662397 1046633062 /nfs/dbraw/zinc/63/30/62/1046633062.db2.gz TUYOTWUFMNFILT-LJQANCHMSA-N 2 0 338.495 4.299 20 0 EIADRP C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459434974 1046645378 /nfs/dbraw/zinc/64/53/78/1046645378.db2.gz VXFDHGLSCOKENP-YCRPNKLZSA-N 2 0 339.458 4.103 20 0 EIADRP CC[C@@H](CSc1ccccc1)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459456714 1046690287 /nfs/dbraw/zinc/69/02/87/1046690287.db2.gz WZJAJUMVROZSAC-KRWDZBQOSA-N 2 0 341.524 4.211 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+][C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000379625307 1046715155 /nfs/dbraw/zinc/71/51/55/1046715155.db2.gz KPWJNFOUVJPFLV-LQWHRVPQSA-N 2 0 340.486 4.399 20 0 EIADRP c1ccc([C@H]2CCC[C@@H]([NH2+]C3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000459498282 1046726923 /nfs/dbraw/zinc/72/69/23/1046726923.db2.gz AGTPLUJFHKMYDP-PZJWPPBQSA-N 2 0 335.495 4.366 20 0 EIADRP COc1ccc(-c2ccccc2C)cc1C[NH2+][C@H]1CCc2nc[nH]c2C1 ZINC000459565616 1046785928 /nfs/dbraw/zinc/78/59/28/1046785928.db2.gz RHVOOLMCAMXZIF-SFHVURJKSA-N 2 0 347.462 4.041 20 0 EIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cc2c(s1)CCC2 ZINC000536829294 1046800466 /nfs/dbraw/zinc/80/04/66/1046800466.db2.gz ZKDXRVBFNVXLKT-HNNXBMFYSA-N 2 0 341.524 4.199 20 0 EIADRP c1ccc(C[NH2+]C2CC[NH+](CC[C@@H]3CCc4ccccc43)CC2)cc1 ZINC001170470051 1046826670 /nfs/dbraw/zinc/82/66/70/1046826670.db2.gz UKWRITUMELONBZ-NRFANRHFSA-N 2 0 334.507 4.361 20 0 EIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2CCC(C(F)F)CC2)CC1 ZINC000459703902 1046855087 /nfs/dbraw/zinc/85/50/87/1046855087.db2.gz FSEIWWGBPGOKEB-MMIPBJDJSA-N 2 0 328.491 4.443 20 0 EIADRP COc1cccc2c1C[C@@H]([NH2+][C@H](C)c1ccc(-n3ccnc3C)cc1)C2 ZINC000459722636 1046864261 /nfs/dbraw/zinc/86/42/61/1046864261.db2.gz IDSVSYGRCBUHQY-BEFAXECRSA-N 2 0 347.462 4.007 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H](c2ccc(F)cc2)C2CC2)c1 ZINC000536946985 1046877714 /nfs/dbraw/zinc/87/77/14/1046877714.db2.gz DCSQDYKZCHEGGN-OAQYLSRUSA-N 2 0 342.458 4.007 20 0 EIADRP Cc1c([C@@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)cnn1C(C)(C)C ZINC000786914890 1046880888 /nfs/dbraw/zinc/88/08/88/1046880888.db2.gz HYLUUYVUNPUSCN-IPJUCJBFSA-N 2 0 346.563 4.394 20 0 EIADRP CC(C)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000536998060 1046890130 /nfs/dbraw/zinc/89/01/30/1046890130.db2.gz CYABIDFZTKQNEC-WMLDXEAASA-N 2 0 328.422 4.334 20 0 EIADRP CCc1ccc([C@@H]([NH2+]C2CC[NH+](CCCOC)CC2)C(C)C)cc1 ZINC000536999216 1046891021 /nfs/dbraw/zinc/89/10/21/1046891021.db2.gz DERBUBRKHVZXJM-NRFANRHFSA-N 2 0 332.532 4.037 20 0 EIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000537302985 1047085677 /nfs/dbraw/zinc/08/56/77/1047085677.db2.gz AMRQRMIVZFBCGM-LJQANCHMSA-N 2 0 326.509 4.192 20 0 EIADRP CC1CC[NH+](CCCC[NH2+][C@@H]2COCc3cccc(Cl)c32)CC1 ZINC000788529819 1047226959 /nfs/dbraw/zinc/22/69/59/1047226959.db2.gz ULADMHBUDZCZPR-GOSISDBHSA-N 2 0 336.907 4.013 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3ccc(Cl)nc32)c1 ZINC000788643684 1047246626 /nfs/dbraw/zinc/24/66/26/1047246626.db2.gz KVJUNDPGPRUFDZ-SFHVURJKSA-N 2 0 343.902 4.352 20 0 EIADRP FC(F)(F)[C@H]1CCC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000129195473 1047332066 /nfs/dbraw/zinc/33/20/66/1047332066.db2.gz RGRLXTBPPGWPAH-ROUUACIJSA-N 2 0 340.433 4.493 20 0 EIADRP C[C@H]1CC[C@H]([NH+]2CCC([NH3+])(c3ccc(C(F)(F)F)cc3)CC2)C1 ZINC001170119545 1047471466 /nfs/dbraw/zinc/47/14/66/1047471466.db2.gz YIKOLXUIUIBEGW-BBRMVZONSA-N 2 0 326.406 4.144 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1ccncc1F ZINC000556119574 1047473219 /nfs/dbraw/zinc/47/32/19/1047473219.db2.gz AMKZVECWNUIPEJ-AOIWGVFYSA-N 2 0 341.474 4.172 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1ccnc(Cl)c1 ZINC000154866033 1047720698 /nfs/dbraw/zinc/72/06/98/1047720698.db2.gz KQSBAGITBSRBSH-OAHLLOKOSA-N 2 0 331.891 4.426 20 0 EIADRP CN1CC[C@@H]([NH2+]CCCOc2ccc(F)cc2)C[C@@H]1c1ccccc1 ZINC000550644328 1047799549 /nfs/dbraw/zinc/79/95/49/1047799549.db2.gz QXWFJWPGUVQKII-TZIWHRDSSA-N 2 0 342.458 4.020 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](C[C@@H]2CC2(Cl)Cl)CC1 ZINC000763435102 1047804995 /nfs/dbraw/zinc/80/49/95/1047804995.db2.gz YZZGPKOSEOTUKB-HOCLYGCPSA-N 2 0 333.347 4.157 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1 ZINC000556589270 1047830316 /nfs/dbraw/zinc/83/03/16/1047830316.db2.gz RJBPYXRDYQOIQS-NPFVIJTESA-N 2 0 338.495 4.039 20 0 EIADRP C[NH+]1CCC(CC[NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171060378 1047890591 /nfs/dbraw/zinc/89/05/91/1047890591.db2.gz RNUDNWHNWPCHEK-MRXNPFEDSA-N 2 0 341.326 4.172 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H](c2ccc(F)cn2)C(C)C)CC1 ZINC000498923423 1047962964 /nfs/dbraw/zinc/96/29/64/1047962964.db2.gz JRVIPNILGXSKSW-FQEVSTJZSA-N 2 0 335.511 4.266 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1c[nH]c2cccc(F)c12 ZINC001136985419 1048028562 /nfs/dbraw/zinc/02/85/62/1048028562.db2.gz GMUUNSGNENQQRO-DLBZAZTESA-N 2 0 329.463 4.146 20 0 EIADRP CC[NH+]1CCC(CC2CC[NH+](Cc3ccc4c(c3)COC4)CC2)CC1 ZINC001137028759 1048083676 /nfs/dbraw/zinc/08/36/76/1048083676.db2.gz CYOJFAZWVFWAHN-UHFFFAOYSA-N 2 0 342.527 4.051 20 0 EIADRP CC(C)(C)C[NH+]1CCC([NH2+][C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171112254 1048237831 /nfs/dbraw/zinc/23/78/31/1048237831.db2.gz UMRUMTUWCPCEQZ-LJQANCHMSA-N 2 0 334.935 4.297 20 0 EIADRP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)s1 ZINC000499140407 1048336390 /nfs/dbraw/zinc/33/63/90/1048336390.db2.gz VVMJPZVXHNBMIK-LDLYASANSA-N 2 0 326.509 4.342 20 0 EIADRP FC1(F)C[C@@]12CCC[NH+](CCCC[N@H+]1CCC[C@]3(CC3(F)F)C1)C2 ZINC000844437051 1048337385 /nfs/dbraw/zinc/33/73/85/1048337385.db2.gz KUQCXMLMZFCPOB-IYBDPMFKSA-N 2 0 348.428 4.009 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H]2CCc4ccccc4C2)C3)cc1 ZINC000499164507 1048371598 /nfs/dbraw/zinc/37/15/98/1048371598.db2.gz OFZVSRHICCXJAA-JLLPCOHGSA-N 2 0 346.518 4.329 20 0 EIADRP CCCC[NH+]1CCC([N@H+](C)[C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171133532 1048394876 /nfs/dbraw/zinc/39/48/76/1048394876.db2.gz MMMLHPBAUVPUOV-HXUWFJFHSA-N 2 0 334.935 4.394 20 0 EIADRP c1ccc(C[C@@H]2C[C@H]2[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499215472 1048424481 /nfs/dbraw/zinc/42/44/81/1048424481.db2.gz QDIBNRAWADIYQP-ZSXJVMONSA-N 2 0 346.518 4.403 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1CCc3cc(Cl)c(Cl)cc3C1)C2 ZINC001171139836 1048429513 /nfs/dbraw/zinc/42/95/13/1048429513.db2.gz RKSQTAGEMBVRMN-LVQVYYBASA-N 2 0 339.310 4.066 20 0 EIADRP COc1cccc2cc(C[N@H+](C)Cc3ccc(C[NH+](C)C)cc3)oc21 ZINC000809738384 1048510298 /nfs/dbraw/zinc/51/02/98/1048510298.db2.gz WWJJYKKCLMROLX-UHFFFAOYSA-N 2 0 338.451 4.135 20 0 EIADRP Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1ccc(-n2ccnc2)c(F)c1 ZINC000815565115 1048511750 /nfs/dbraw/zinc/51/17/50/1048511750.db2.gz CVCRRTHJIFBCOJ-CQSZACIVSA-N 2 0 327.378 4.310 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(F)nc2C)CC1)CC(C)C ZINC000809756009 1048522541 /nfs/dbraw/zinc/52/25/41/1048522541.db2.gz NTXGDEQZDSJDSW-UHFFFAOYSA-N 2 0 335.511 4.109 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(SC(F)F)cc1 ZINC000844922293 1048550064 /nfs/dbraw/zinc/55/00/64/1048550064.db2.gz ANZIYSYACBSDSU-NSHDSACASA-N 2 0 340.414 4.450 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1c[nH]c2nc(Cl)ccc12 ZINC001144415865 1048650798 /nfs/dbraw/zinc/65/07/98/1048650798.db2.gz OQBDGSFXXMHGPJ-HOTGVXAUSA-N 2 0 346.906 4.055 20 0 EIADRP CCCCCC[C@H](CC)[N@H+]1CCc2ncc(C[NH+]3CCCC3)n2CC1 ZINC001170598323 1048660023 /nfs/dbraw/zinc/66/00/23/1048660023.db2.gz GYHLANQZVWOCSW-IBGZPJMESA-N 2 0 346.563 4.086 20 0 EIADRP Clc1ccc(CNC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)cn1 ZINC000810178461 1048668609 /nfs/dbraw/zinc/66/86/09/1048668609.db2.gz UDBWPLGFQUOWDK-IBGZPJMESA-N 2 0 343.902 4.127 20 0 EIADRP C[C@H]([NH2+]CC[C@]1(C)C[C@@]1(F)Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000846036809 1048801351 /nfs/dbraw/zinc/80/13/51/1048801351.db2.gz MKEGJTXCXXRTEE-AITUJVMLSA-N 2 0 338.898 4.191 20 0 EIADRP CC(C)n1c2ccccc2nc1[C@@H]1CCC[N@@H+]1CCCCCC[NH3+] ZINC000846220263 1048843907 /nfs/dbraw/zinc/84/39/07/1048843907.db2.gz MSXKFOANRCXOLI-IBGZPJMESA-N 2 0 328.504 4.273 20 0 EIADRP Cc1c(F)cccc1-c1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)o1 ZINC000237098370 1048885142 /nfs/dbraw/zinc/88/51/42/1048885142.db2.gz AXMCGYCRJNLXRG-ALOPSCKCSA-N 2 0 342.458 4.499 20 0 EIADRP COc1ccc(C(C)C)cc1C[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000846892356 1048941373 /nfs/dbraw/zinc/94/13/73/1048941373.db2.gz USHSGGNBVXRTTC-UHFFFAOYSA-N 2 0 330.516 4.126 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cccc(Br)c1 ZINC000817946901 1049060540 /nfs/dbraw/zinc/06/05/40/1049060540.db2.gz HMUWJBKGNFNQNQ-GOSISDBHSA-N 2 0 347.300 4.191 20 0 EIADRP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000817947289 1049064651 /nfs/dbraw/zinc/06/46/51/1049064651.db2.gz BJBGXBPUNNCFNG-CYBMUJFWSA-N 2 0 331.529 4.101 20 0 EIADRP CC(C)Oc1ccc([C@H](C)[NH2+]Cc2ccc(CC[NH3+])cc2)cc1Cl ZINC000817949139 1049064753 /nfs/dbraw/zinc/06/47/53/1049064753.db2.gz OJIKWJMJRQHTKZ-HNNXBMFYSA-N 2 0 346.902 4.479 20 0 EIADRP CC(C)c1ccc(C2(O)CCC([NH2+][C@@H]3CCCC[C@H]3C[NH3+])CC2)cc1 ZINC000817961135 1049068607 /nfs/dbraw/zinc/06/86/07/1049068607.db2.gz UTADKXXEELJCAZ-PMJAUZGISA-N 2 0 344.543 4.047 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cc(Cl)c(N)c(Cl)c2)cc1 ZINC000817963153 1049070802 /nfs/dbraw/zinc/07/08/02/1049070802.db2.gz ORRGITQTQWGEDJ-QWRGUYRKSA-N 2 0 338.282 4.446 20 0 EIADRP COc1cc([C@@H](C)[NH2+]C[C@]2(C)CCC[NH2+]C2)ccc1SC(F)F ZINC000817965861 1049070949 /nfs/dbraw/zinc/07/09/49/1049070949.db2.gz DNZHSFSSORFSCE-SJKOYZFVSA-N 2 0 344.471 4.050 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)CC[NH2+]1 ZINC000817972080 1049073029 /nfs/dbraw/zinc/07/30/29/1049073029.db2.gz SWLOVHIQHSDQIQ-FFSVYQOJSA-N 2 0 326.456 4.109 20 0 EIADRP Clc1cc(C[N@H+]2C[C@@H]3CC[NH2+]CC[C@@H]3C2)cc(Cl)c1Cl ZINC001236320555 1049094232 /nfs/dbraw/zinc/09/42/32/1049094232.db2.gz IRWBYYNUJLFSEK-TXEJJXNPSA-N 2 0 333.690 4.078 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@H]2CCc3cccc(Cl)c3C2)C[C@](C)(C[NH3+])C1 ZINC001170901554 1049149515 /nfs/dbraw/zinc/14/95/15/1049149515.db2.gz FCERWBKLJRSPNM-FTRWYGJKSA-N 2 0 334.935 4.331 20 0 EIADRP CCC(CC)[NH+]1CCC([NH2+][C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170910715 1049185159 /nfs/dbraw/zinc/18/51/59/1049185159.db2.gz NRERSHJGMIKKPW-QGZVFWFLSA-N 2 0 334.935 4.440 20 0 EIADRP C[NH+]1CCC(C2CC[NH+]([C@@H]3CCc4cccc(Cl)c4C3)CC2)CC1 ZINC001170933611 1049353282 /nfs/dbraw/zinc/35/32/82/1049353282.db2.gz IJYXSTRKEWLNLM-LJQANCHMSA-N 2 0 346.946 4.251 20 0 EIADRP CC(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2c(F)cc(F)cc2C1 ZINC001171357026 1049511221 /nfs/dbraw/zinc/51/12/21/1049511221.db2.gz GEMIGECWVKKYID-BZSNNMDCSA-N 2 0 336.470 4.050 20 0 EIADRP COc1ccc(Cl)cc1C[NH2+][C@H](C)c1cccc(C[NH+](C)C)c1 ZINC000820809302 1049555914 /nfs/dbraw/zinc/55/59/14/1049555914.db2.gz YUDZFPORKIXVIP-CQSZACIVSA-N 2 0 332.875 4.261 20 0 EIADRP C[C@@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1cccc(C[NH+](C)C)c1 ZINC000820840691 1049565957 /nfs/dbraw/zinc/56/59/57/1049565957.db2.gz ATPLEVUKKPRDEW-KUHUBIRLSA-N 2 0 328.431 4.062 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)c1ccc2c(c1)CCO2 ZINC000773079746 1049570621 /nfs/dbraw/zinc/57/06/21/1049570621.db2.gz YVNXBFMWAAPUND-FXAWDEMLSA-N 2 0 330.516 4.030 20 0 EIADRP FC1(F)CCC[C@H]1C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716704539 1049702960 /nfs/dbraw/zinc/70/29/60/1049702960.db2.gz GIHUGJXMZINIDQ-OKYOBFRVSA-N 2 0 334.454 4.065 20 0 EIADRP CCC(CC)[NH+]1CCC([NH2+][C@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171465938 1049707617 /nfs/dbraw/zinc/70/76/17/1049707617.db2.gz KQIWUIXCMOPHLJ-KRWDZBQOSA-N 2 0 336.470 4.065 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H](c2c(Cl)cccc2Cl)C2CC2)CC1 ZINC000813325615 1049744890 /nfs/dbraw/zinc/74/48/90/1049744890.db2.gz HRCHXBQKMLNIJD-QGZVFWFLSA-N 2 0 327.299 4.376 20 0 EIADRP Cc1cccc2c1CC[C@@H]([N@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171557461 1049755657 /nfs/dbraw/zinc/75/56/57/1049755657.db2.gz CEYCYRIHGYAKQL-YPAWHYETSA-N 2 0 349.522 4.019 20 0 EIADRP Cc1ccc2c(c1)c(CC[NH3+])cn2C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171618762 1049767155 /nfs/dbraw/zinc/76/71/55/1049767155.db2.gz BODATPFBUPCGEM-UHFFFAOYSA-N 2 0 327.516 4.275 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171622953 1049768205 /nfs/dbraw/zinc/76/82/05/1049768205.db2.gz DUNUOBWKOVKTNE-GOSISDBHSA-N 2 0 329.532 4.246 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171622954 1049768335 /nfs/dbraw/zinc/76/83/35/1049768335.db2.gz DUNUOBWKOVKTNE-SFHVURJKSA-N 2 0 329.532 4.246 20 0 EIADRP COCC1(C[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)CCC(F)(F)CC1 ZINC001171626995 1049769708 /nfs/dbraw/zinc/76/97/08/1049769708.db2.gz IJEGBHBAZZBNIQ-UHFFFAOYSA-N 2 0 346.506 4.070 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC001171658628 1049771875 /nfs/dbraw/zinc/77/18/75/1049771875.db2.gz TXNNNIOJXHZJKC-REWPJTCUSA-N 2 0 336.523 4.428 20 0 EIADRP COc1cccc([C@@H]2CCC[N@@H+]2C2CC(C)(C)[NH+](C)C(C)(C)C2)c1 ZINC001171639566 1049778224 /nfs/dbraw/zinc/77/82/24/1049778224.db2.gz PGPRDRHHXAUKLQ-IBGZPJMESA-N 2 0 330.516 4.484 20 0 EIADRP C[NH+]1C(C)(C)CC([N@@H+]2CCC[C@H](OCc3ccccc3)C2)CC1(C)C ZINC001171639455 1049779145 /nfs/dbraw/zinc/77/91/45/1049779145.db2.gz KMIZEHLMSCAQPA-FQEVSTJZSA-N 2 0 344.543 4.319 20 0 EIADRP Cc1ccc(CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)cn1 ZINC000813789000 1049816584 /nfs/dbraw/zinc/81/65/84/1049816584.db2.gz GAZHKSJMZBEVGU-FRIKZZABSA-N 2 0 335.495 4.065 20 0 EIADRP Cc1ccncc1CNC1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000813789842 1049817280 /nfs/dbraw/zinc/81/72/80/1049817280.db2.gz FNIOUNMDWPGFEB-FRIKZZABSA-N 2 0 335.495 4.065 20 0 EIADRP CC[NH+](CC)CCCC[NH2+][C@H](C)Cc1ccc(C(F)(F)F)cc1 ZINC001171958969 1049822264 /nfs/dbraw/zinc/82/22/64/1049822264.db2.gz MMUHFNYBDCKYAC-OAHLLOKOSA-N 2 0 330.438 4.348 20 0 EIADRP CC1(C)C[C@@H](Nc2ccc(CC[NH3+])cc2)CC[N@@H+]1Cc1ccccc1 ZINC001171961722 1049824295 /nfs/dbraw/zinc/82/42/95/1049824295.db2.gz AMTPLZIVIPHRGY-NRFANRHFSA-N 2 0 337.511 4.043 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CCc2ccc(F)cc2)CC[N@@H+]1Cc1ccccc1 ZINC001171963644 1049825357 /nfs/dbraw/zinc/82/53/57/1049825357.db2.gz IJYCXRWNFDAMGM-NRFANRHFSA-N 2 0 340.486 4.401 20 0 EIADRP CC[NH+](CC)CCCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171967448 1049827996 /nfs/dbraw/zinc/82/79/96/1049827996.db2.gz MCUFNQAKVLLGFX-NRFANRHFSA-N 3 0 345.575 4.141 20 0 EIADRP CC1(C)C[C@@H](n2cc3cc(C[NH3+])ccc3n2)CC[N@@H+]1Cc1ccccc1 ZINC001171971780 1049834274 /nfs/dbraw/zinc/83/42/74/1049834274.db2.gz JYVYLLZIVCVZDH-FQEVSTJZSA-N 2 0 348.494 4.111 20 0 EIADRP CC(C)(C)OCCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171974802 1049835472 /nfs/dbraw/zinc/83/54/72/1049835472.db2.gz AMPDCYBKZQYDQB-IBGZPJMESA-N 2 0 332.532 4.224 20 0 EIADRP CC(C)([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1ccncc1 ZINC001171974433 1049836222 /nfs/dbraw/zinc/83/62/22/1049836222.db2.gz FVURXICCLFARJN-FQEVSTJZSA-N 2 0 337.511 4.350 20 0 EIADRP CC1(C)C[C@H](NC2(c3cccnc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171977199 1049837641 /nfs/dbraw/zinc/83/76/41/1049837641.db2.gz YHKRTBBEMLWOFN-HXUWFJFHSA-N 2 0 335.495 4.104 20 0 EIADRP C[N@H+](CC1CC(F)(F)C1)[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171987771 1049840614 /nfs/dbraw/zinc/84/06/14/1049840614.db2.gz JFVCWVYGWHUOAL-GOSISDBHSA-N 2 0 336.470 4.407 20 0 EIADRP Oc1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC001172060687 1049841858 /nfs/dbraw/zinc/84/18/58/1049841858.db2.gz BJISDRZABXJWFJ-MZADTFQBSA-N 2 0 336.479 4.068 20 0 EIADRP CO[C@H]1CCC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001172076426 1049844109 /nfs/dbraw/zinc/84/41/09/1049844109.db2.gz YMXXYPSAOGUMMB-CBPXPLCBSA-N 2 0 342.527 4.073 20 0 EIADRP [NH3+]CCCCCCC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172077010 1049845169 /nfs/dbraw/zinc/84/51/69/1049845169.db2.gz NVHIFOWZYMTRDJ-DKUWSORSSA-N 3 0 343.559 4.071 20 0 EIADRP Oc1cccc(CN[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172063325 1049849434 /nfs/dbraw/zinc/84/94/34/1049849434.db2.gz YAQXKGLSUKHFPH-MZADTFQBSA-N 2 0 336.479 4.068 20 0 EIADRP Cc1ccccc1[C@@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccncc1 ZINC001172099942 1049850274 /nfs/dbraw/zinc/85/02/74/1049850274.db2.gz NVKSIITYDMAWCP-KEZQHZCBSA-N 2 0 335.495 4.084 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]C2Cc4ccccc4C2)C3)cc1 ZINC001172066673 1049851173 /nfs/dbraw/zinc/85/11/73/1049851173.db2.gz JRHBTYWCRLVJAT-BKFWDETESA-N 2 0 346.518 4.329 20 0 EIADRP F[C@@H]1CC[C@@H](C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172067400 1049851194 /nfs/dbraw/zinc/85/11/94/1049851194.db2.gz NKDYNZFSJXWLSB-SSSFQFABSA-N 2 0 330.491 4.300 20 0 EIADRP C[N@H+](Cc1cc(Cl)cc(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172134764 1049854220 /nfs/dbraw/zinc/85/42/20/1049854220.db2.gz ZHYKRJWUDAJQBJ-FVQHAEBGSA-N 2 0 327.299 4.441 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2C)c1cccc(Br)c1 ZINC001172107398 1049856301 /nfs/dbraw/zinc/85/63/01/1049856301.db2.gz WUCHTIVLEJNIAG-VDNDLQMASA-N 2 0 337.305 4.115 20 0 EIADRP Cc1ccc2c(c1)C1(CC2)CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)CC1 ZINC001172115494 1049858230 /nfs/dbraw/zinc/85/82/30/1049858230.db2.gz GZTOBWOSJCYMRN-WKCHPHFGSA-N 2 0 338.539 4.290 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C[C@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001172114354 1049858340 /nfs/dbraw/zinc/85/83/40/1049858340.db2.gz QVDJJZHRLFMOAD-YRPNKDGESA-N 2 0 332.919 4.439 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@@H]2CCc3c(Cl)cccc3C2)CC1(C)C ZINC001171021345 1049861425 /nfs/dbraw/zinc/86/14/25/1049861425.db2.gz BGYRGBYOJJKIQK-OAHLLOKOSA-N 2 0 334.935 4.438 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@@H]2CCc3c(Cl)cccc3C2)C[C@](C)(C[NH3+])C1 ZINC001171027813 1049872604 /nfs/dbraw/zinc/87/26/04/1049872604.db2.gz TUDJIGJUGNRZHS-GUXCAODWSA-N 2 0 334.935 4.331 20 0 EIADRP CC[C@H](C)OCC[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172315733 1049876458 /nfs/dbraw/zinc/87/64/58/1049876458.db2.gz DCVBEVZVAASJQQ-MOPGFXCFSA-N 2 0 332.532 4.082 20 0 EIADRP CC[C@@H](C)OCC[C@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172315735 1049876822 /nfs/dbraw/zinc/87/68/22/1049876822.db2.gz DCVBEVZVAASJQQ-RBUKOAKNSA-N 2 0 332.532 4.082 20 0 EIADRP CC[C@H](C)OCC[C@@H](C)[NH2+]CCC1CC[NH+](Cc2ccccc2)CC1 ZINC001172317866 1049876831 /nfs/dbraw/zinc/87/68/31/1049876831.db2.gz VRWCRZSNOPQFKV-UXHICEINSA-N 2 0 346.559 4.472 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171033895 1049882335 /nfs/dbraw/zinc/88/23/35/1049882335.db2.gz QHVQDLHSGPDJCW-BZSNNMDCSA-N 2 0 334.935 4.440 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000245949285 1049882721 /nfs/dbraw/zinc/88/27/21/1049882721.db2.gz KXGOAXRTLBQMLJ-SIKLNZKXSA-N 2 0 337.511 4.415 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000245949282 1049882847 /nfs/dbraw/zinc/88/28/47/1049882847.db2.gz KXGOAXRTLBQMLJ-DENIHFKCSA-N 2 0 337.511 4.415 20 0 EIADRP CCOCC[C@H](C)[N@H+](Cc1ccc(Cl)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172420250 1049900780 /nfs/dbraw/zinc/90/07/80/1049900780.db2.gz LIPGYAVJXIBKLB-SNRMKQJTSA-N 2 0 338.923 4.227 20 0 EIADRP CCCCCC[C@H](CCC)[NH2+][C@@H](CCC[NH3+])NC(=O)OC(C)(C)C ZINC001172391972 1049905837 /nfs/dbraw/zinc/90/58/37/1049905837.db2.gz UTBMGFHUXHYFHE-DLBZAZTESA-N 2 0 343.556 4.305 20 0 EIADRP CC(C)COCC[C@H](C)[NH+]1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC001172471173 1049908710 /nfs/dbraw/zinc/90/87/10/1049908710.db2.gz QTCZLVHHCSFROQ-IBGZPJMESA-N 2 0 332.532 4.034 20 0 EIADRP CC(C)OCC[C@@H](C)[N@H+](Cc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172437376 1049912786 /nfs/dbraw/zinc/91/27/86/1049912786.db2.gz OSIRDDOPENJREX-NSISKUIASA-N 2 0 336.495 4.101 20 0 EIADRP CC(C)OCC[C@H](C)[N@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172457143 1049915856 /nfs/dbraw/zinc/91/58/56/1049915856.db2.gz RUOOBXBXJNKAKP-IBGZPJMESA-N 2 0 332.532 4.034 20 0 EIADRP CC(C)COCC[C@@H](C)[NH2+]CCC1CC[NH+](Cc2ccccc2)CC1 ZINC001172459676 1049917428 /nfs/dbraw/zinc/91/74/28/1049917428.db2.gz KQAFKZBOCWYDMP-HXUWFJFHSA-N 2 0 346.559 4.330 20 0 EIADRP CCCCCC[C@@H](CCCC)[NH+]1CCN(CC[NH+]2CCCC2)CC1 ZINC001172512815 1049926557 /nfs/dbraw/zinc/92/65/57/1049926557.db2.gz UXALXRPQTIOEOI-OAQYLSRUSA-N 2 0 337.596 4.229 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[N@H+](C)CC1CC[NH+](C)CC1 ZINC001172573303 1049940952 /nfs/dbraw/zinc/94/09/52/1049940952.db2.gz GYBDOEWPTITXJT-ZDUSSCGKSA-N 2 0 344.877 4.213 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001172578988 1049951934 /nfs/dbraw/zinc/95/19/34/1049951934.db2.gz TYZPFXSKYOZBLH-SNPRPXQTSA-N 2 0 344.877 4.402 20 0 EIADRP CC1(C)CC([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)CC(C)(C)O1 ZINC001172641455 1049954032 /nfs/dbraw/zinc/95/40/32/1049954032.db2.gz XPTHESUDYLRLDH-UHFFFAOYSA-N 2 0 330.516 4.108 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)c1cccnc1 ZINC000246643178 1049993395 /nfs/dbraw/zinc/99/33/95/1049993395.db2.gz XLAUUHRRRAYEAO-GUDVDZBRSA-N 2 0 337.511 4.410 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)[C@H](C)c1nc2ccccc2s1 ZINC000246936215 1050006517 /nfs/dbraw/zinc/00/65/17/1050006517.db2.gz GSXYETNNPACWMO-CAOSSQGBSA-N 2 0 331.529 4.251 20 0 EIADRP C[C@H](N[C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(Br)s1 ZINC000246945085 1050006692 /nfs/dbraw/zinc/00/66/92/1050006692.db2.gz HCUDNDCJLJLKLP-QJPTWQEYSA-N 2 0 331.323 4.034 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cccc(OC(F)F)c2)C1 ZINC000247119600 1050014205 /nfs/dbraw/zinc/01/42/05/1050014205.db2.gz UOBHUIYPOZZHSX-HUUCEWRRSA-N 2 0 326.431 4.059 20 0 EIADRP CN1CCC[C@H](C[NH2+][C@H]2CC(C)(C)OC2(C)C)[C@@H]1c1cccs1 ZINC000248132771 1050043926 /nfs/dbraw/zinc/04/39/26/1050043926.db2.gz ORQUBEGJEJNYEE-HYVNUMGLSA-N 2 0 336.545 4.067 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)ccc1F ZINC000248410781 1050055509 /nfs/dbraw/zinc/05/55/09/1050055509.db2.gz YGYSTDJZWHMUBS-UXLLHSPISA-N 2 0 334.479 4.138 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1cccc(O)c1 ZINC000249588562 1050102226 /nfs/dbraw/zinc/10/22/26/1050102226.db2.gz OSRRLZCQGGDWCB-QZTJIDSGSA-N 2 0 338.495 4.475 20 0 EIADRP CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(Br)cc1 ZINC000251109886 1050154083 /nfs/dbraw/zinc/15/40/83/1050154083.db2.gz TXOITUSPGAUTNC-ULQDDVLXSA-N 2 0 337.305 4.117 20 0 EIADRP CC(C)[NH+]1CCC(C[NH2+]C2CCC(Cc3ccccc3)CC2)CC1 ZINC001172818103 1050162038 /nfs/dbraw/zinc/16/20/38/1050162038.db2.gz FGHHHGQTWISYAF-UHFFFAOYSA-N 2 0 328.544 4.498 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC001172839016 1050178213 /nfs/dbraw/zinc/17/82/13/1050178213.db2.gz AFMHQWGGVJMHFV-CQSZACIVSA-N 2 0 334.866 4.262 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([N@H+](C)C[C@H]1CC[NH+](Cc3ccccc3)C1)CC2 ZINC001172844393 1050181192 /nfs/dbraw/zinc/18/11/92/1050181192.db2.gz SQCFVCBOKKWGHM-QPPBQGQZSA-N 2 0 348.534 4.306 20 0 EIADRP Cc1cc(C)c([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cc1C ZINC000090524027 1050181396 /nfs/dbraw/zinc/18/13/96/1050181396.db2.gz TZKVRCFXXPVOHI-NYVOZVTQSA-N 2 0 344.543 4.030 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)Cc1c(F)cccc1Cl)CC(C)(C)CC[NH3+] ZINC001172852851 1050190992 /nfs/dbraw/zinc/19/09/92/1050190992.db2.gz VRSSJZAIHYVBHR-KBPBESRZSA-N 2 0 328.903 4.401 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH2+]CCC1CC[NH+](C)CC1 ZINC001172869667 1050206788 /nfs/dbraw/zinc/20/67/88/1050206788.db2.gz DYAQOBCQPXBRPF-CQSZACIVSA-N 2 0 326.937 4.142 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC001172876079 1050218026 /nfs/dbraw/zinc/21/80/26/1050218026.db2.gz VZSSATJYUCOIDV-CABCVRRESA-N 2 0 326.937 4.142 20 0 EIADRP C[C@@H](CSc1ccc(Cl)cc1)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC001172876083 1050218328 /nfs/dbraw/zinc/21/83/28/1050218328.db2.gz VZSSATJYUCOIDV-LSDHHAIUSA-N 2 0 326.937 4.142 20 0 EIADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2cc(Br)ccc2Cl)CC1 ZINC001206305091 1050235725 /nfs/dbraw/zinc/23/57/25/1050235725.db2.gz SSTSTDAMJHHQMX-HNNXBMFYSA-N 2 0 345.712 4.053 20 0 EIADRP CO[C@@H]1CCC[C@@H]([N@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001172922264 1050236275 /nfs/dbraw/zinc/23/62/75/1050236275.db2.gz GMXLSBDRIXULET-XJSHKYLYSA-N 2 0 342.527 4.072 20 0 EIADRP CO[C@H]1CCC[C@@H]([N@H+]2C[C@H]3c4ccccc4[C@H]([NH+](C)C(C)C)[C@H]3C2)C1 ZINC001172943938 1050243951 /nfs/dbraw/zinc/24/39/51/1050243951.db2.gz VGVRMMORFWDIIV-VDWMVFLBSA-N 2 0 342.527 4.055 20 0 EIADRP Cc1ccc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c(F)c1 ZINC001177561850 1050253410 /nfs/dbraw/zinc/25/34/10/1050253410.db2.gz CWZCEEANBLGGAO-UHFFFAOYSA-N 2 0 332.488 4.197 20 0 EIADRP Fc1ccc(/C=C\C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)cc1 ZINC001177582285 1050257460 /nfs/dbraw/zinc/25/74/60/1050257460.db2.gz WLLRACBUWHPWLR-DAXSKMNVSA-N 2 0 330.491 4.473 20 0 EIADRP C([NH2+]C1CCC2(CCOCC2)CC1)C1CC[NH+](CC2CCCC2)CC1 ZINC001173045381 1050271251 /nfs/dbraw/zinc/27/12/51/1050271251.db2.gz VNHPWAORONFRIY-UHFFFAOYSA-N 2 0 348.575 4.218 20 0 EIADRP C[C@H](Cc1ccc(OC(F)(F)F)cc1)[NH2+]CCCCCCC[NH3+] ZINC001173079732 1050294933 /nfs/dbraw/zinc/29/49/33/1050294933.db2.gz QQPUTSPGPAZDAS-CQSZACIVSA-N 2 0 332.410 4.015 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C[C@@H](c2ccccc2)N2CCCC2)CC1 ZINC001173101624 1050303673 /nfs/dbraw/zinc/30/36/73/1050303673.db2.gz LQNUCJQHDZSTOJ-HRTMPFAESA-N 2 0 343.559 4.066 20 0 EIADRP CCCOC1CCC([N@H+](C)C2CC[NH+](C3CCCCC3)CC2)CC1 ZINC001173103063 1050305320 /nfs/dbraw/zinc/30/53/20/1050305320.db2.gz WYAWLOLONLURRX-UHFFFAOYSA-N 2 0 336.564 4.453 20 0 EIADRP CC[NH+](CC)C1CCC(N2CCC[C@H]([NH3+])c3cc(C)ccc32)CC1 ZINC001173104244 1050306110 /nfs/dbraw/zinc/30/61/10/1050306110.db2.gz LPDJOYNECIYRBT-QLOJAFMTSA-N 2 0 329.532 4.248 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCN(c3ccc(C)c(C)c3)CC2)CC1 ZINC001173109122 1050308480 /nfs/dbraw/zinc/30/84/80/1050308480.db2.gz XJXKOFZTDZFLQN-UHFFFAOYSA-N 2 0 343.559 4.078 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC3(Cc4ccccc4O3)CC2)CC1 ZINC001173112463 1050309391 /nfs/dbraw/zinc/30/93/91/1050309391.db2.gz BMQQLYBNWMPTET-UHFFFAOYSA-N 2 0 342.527 4.109 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@H](OCc3ccccc3)C2)CC1 ZINC001173112951 1050310266 /nfs/dbraw/zinc/31/02/66/1050310266.db2.gz FLCRDDSRQNRHOI-HRTMPFAESA-N 2 0 344.543 4.321 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCN(c3c(C)cccc3C)CC2)CC1 ZINC001173112616 1050310551 /nfs/dbraw/zinc/31/05/51/1050310551.db2.gz AQBUFDAVYBZUJL-UHFFFAOYSA-N 2 0 343.559 4.078 20 0 EIADRP [NH3+]C1(Cc2ccccn2)CC[NH+](C2CCC3(CCCCC3)CC2)CC1 ZINC001173118909 1050315561 /nfs/dbraw/zinc/31/55/61/1050315561.db2.gz UEPVCFHYNABMAW-UHFFFAOYSA-N 2 0 341.543 4.311 20 0 EIADRP CC1(C)CC([NH3+])CC(C)(C)[NH+]1C1CCC(Oc2ccccc2)CC1 ZINC001173197118 1050340869 /nfs/dbraw/zinc/34/08/69/1050340869.db2.gz BUPTZNYEDFYQHZ-UHFFFAOYSA-N 2 0 330.516 4.357 20 0 EIADRP CC(C)[N@@H+](C1CCC(Oc2ccccc2)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173198179 1050342202 /nfs/dbraw/zinc/34/22/02/1050342202.db2.gz SUOWNEQGGIBRMC-SBHPSCBMSA-N 2 0 330.516 4.357 20 0 EIADRP C[NH+](C)CC1CCC([NH2+]C2CCC(Oc3ccccc3)CC2)CC1 ZINC001173202005 1050345453 /nfs/dbraw/zinc/34/54/53/1050345453.db2.gz LETVFJQPAAWFAA-UHFFFAOYSA-N 2 0 330.516 4.087 20 0 EIADRP CCCC[C@@H](CC(C)C)n1nc(C[N@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001173262099 1050386219 /nfs/dbraw/zinc/38/62/19/1050386219.db2.gz SEYPIRMKHQGRSG-KRWDZBQOSA-N 2 0 334.552 4.146 20 0 EIADRP CCSC[C@@H](C)[N@H+]([C@@H]1C[C@H]1c1ccccc1)C1CCC([NH3+])CC1 ZINC001173297781 1050399664 /nfs/dbraw/zinc/39/96/64/1050399664.db2.gz WMNSJVVJMPLDEL-RTNLJHFFSA-N 2 0 332.557 4.256 20 0 EIADRP CCSC[C@H](C)[NH+]1CCC([NH3+])(c2cccc(C(F)(F)F)c2)CC1 ZINC001173299183 1050401307 /nfs/dbraw/zinc/40/13/07/1050401307.db2.gz SDSXBNZIQIGPNP-ZDUSSCGKSA-N 2 0 346.462 4.097 20 0 EIADRP CC[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CCC[C@H](N(C)Cc4ccccn4)[C@@H]3C2)C1 ZINC001173276628 1050406738 /nfs/dbraw/zinc/40/67/38/1050406738.db2.gz CLORNAMJBCZDRP-DKBNTXJOSA-N 2 0 341.543 4.193 20 0 EIADRP COc1ccc2cc(C[NH2+]C[C@@H]3CCC[N@H+](CC(C)C)C3)ccc2c1 ZINC001178249565 1050410325 /nfs/dbraw/zinc/41/03/25/1050410325.db2.gz QWDKCJWMNUFDDF-IBGZPJMESA-N 2 0 340.511 4.306 20 0 EIADRP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC001173539959 1050475953 /nfs/dbraw/zinc/47/59/53/1050475953.db2.gz VDHGRYNDANWJNF-DZGCQCFKSA-N 2 0 329.315 4.246 20 0 EIADRP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC001173540380 1050476046 /nfs/dbraw/zinc/47/60/46/1050476046.db2.gz WMLPRIWYNPAOML-ZFWWWQNUSA-N 2 0 329.315 4.388 20 0 EIADRP c1ccc2c(c1)CCC21CCC([NH+]2CCC([NH+]3CCCC3)CC2)CC1 ZINC001173685586 1050538278 /nfs/dbraw/zinc/53/82/78/1050538278.db2.gz DGABIJLEMWZCFY-UHFFFAOYSA-N 2 0 338.539 4.373 20 0 EIADRP CC(C)[C@@H]1C[C@@H]([NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC001179277991 1050668793 /nfs/dbraw/zinc/66/87/93/1050668793.db2.gz PZDFFLNSSHDBDE-VXKWHMMOSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@]1(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)CCCS1 ZINC001179918981 1050833664 /nfs/dbraw/zinc/83/36/64/1050833664.db2.gz GEQHTJJWHJCDFZ-PWRODBHTSA-N 2 0 344.568 4.259 20 0 EIADRP c1c(CC[NH2+][C@@H](Cc2ccccc2)c2ccccc2)nc2n1CCCC2 ZINC000152752420 1050843710 /nfs/dbraw/zinc/84/37/10/1050843710.db2.gz XNDQEAQJGCHYII-QFIPXVFZSA-N 2 0 345.490 4.336 20 0 EIADRP CC[N@H+](CC1CC[NH+](CC)CC1)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC001180064421 1050871371 /nfs/dbraw/zinc/87/13/71/1050871371.db2.gz IMPGRCSWYQLWCJ-NRFANRHFSA-N 2 0 334.523 4.447 20 0 EIADRP c1cc2c(cc1C[NH+]1CCC(CCC[NH+]3CCCC3)CC1)CCCO2 ZINC001180077191 1050874441 /nfs/dbraw/zinc/87/44/41/1050874441.db2.gz MUKGAIYJKIVPJL-UHFFFAOYSA-N 2 0 342.527 4.100 20 0 EIADRP OC[C@@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+]CCC1CCCCCC1 ZINC001180310490 1050946221 /nfs/dbraw/zinc/94/62/21/1050946221.db2.gz JAZLAGYAPWUDQQ-QFIPXVFZSA-N 2 0 344.543 4.093 20 0 EIADRP Cc1ccc(-c2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)s2)cc1 ZINC000620109488 1051026302 /nfs/dbraw/zinc/02/63/02/1051026302.db2.gz JLZQDFKRUGVFEU-ROUUACIJSA-N 2 0 326.509 4.440 20 0 EIADRP C[C@H](CCc1cncc2ccccc21)[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC001180809154 1051086779 /nfs/dbraw/zinc/08/67/79/1051086779.db2.gz BDMZYUYXTYLOER-RTBURBONSA-N 2 0 339.527 4.410 20 0 EIADRP Cc1cscc1C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716629533 1051100611 /nfs/dbraw/zinc/10/06/11/1051100611.db2.gz ZQGXIMUYBOPXAN-SXLOBPIMSA-N 2 0 326.509 4.199 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@H](C)Cc2ccco2)ccc1OC ZINC000775365983 1051135475 /nfs/dbraw/zinc/13/54/75/1051135475.db2.gz RTAJJTMJTSOFIH-IAGOWNOFSA-N 2 0 344.499 4.412 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccccc2OC(C)C)CC1 ZINC000620535899 1051152393 /nfs/dbraw/zinc/15/23/93/1051152393.db2.gz UFTBLMVACFHXGP-UHFFFAOYSA-N 2 0 332.532 4.418 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000544573858 1051187198 /nfs/dbraw/zinc/18/71/98/1051187198.db2.gz ZKSAYQHFDGPYIQ-ROUUACIJSA-N 2 0 326.484 4.081 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CC(C)(C)SC)ccc1OC ZINC000775398218 1051230979 /nfs/dbraw/zinc/23/09/79/1051230979.db2.gz XZXAXSMOOXQRTD-OAHLLOKOSA-N 2 0 338.561 4.329 20 0 EIADRP Cc1cccc(CCC[N@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC001190651645 1051245697 /nfs/dbraw/zinc/24/56/97/1051245697.db2.gz OVXCPYRRULLHRW-JOCHJYFZSA-N 2 0 328.544 4.372 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@H]2CCCC(C)(C)O2)CC1 ZINC001190790910 1051280096 /nfs/dbraw/zinc/28/00/96/1051280096.db2.gz GASYBQCUTZOJIJ-OAQYLSRUSA-N 2 0 344.543 4.178 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C(C)C)CC2 ZINC000154854376 1051344201 /nfs/dbraw/zinc/34/42/01/1051344201.db2.gz YZIPBRPUWSOBNF-QFIPXVFZSA-N 2 0 338.495 4.313 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3OC)cc2)C1 ZINC000163240119 1051357823 /nfs/dbraw/zinc/35/78/23/1051357823.db2.gz FWKAEEXJTUXSQM-ROUUACIJSA-N 2 0 338.495 4.355 20 0 EIADRP C=Cc1ccc(CC[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC001181945460 1051359785 /nfs/dbraw/zinc/35/97/85/1051359785.db2.gz MFCASKALIGYAED-CVDCTZTESA-N 2 0 334.507 4.372 20 0 EIADRP CCO[C@H]1C[C@@H]([N@H+](C)Cc2ccc(C[NH+]3CCCCC3)cc2)C1(C)C ZINC001191164594 1051370899 /nfs/dbraw/zinc/37/08/99/1051370899.db2.gz GXDZCEVPIBNRIG-RTWAWAEBSA-N 2 0 344.543 4.308 20 0 EIADRP CC(C)[C@@H]1CCC[N@@H+]1CCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC001191204639 1051384582 /nfs/dbraw/zinc/38/45/82/1051384582.db2.gz UGOVLDFYEGCWGA-QFIPXVFZSA-N 2 0 328.544 4.452 20 0 EIADRP c1ccc([C@@H]2C[C@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)CCO2)cc1 ZINC000155269166 1051400215 /nfs/dbraw/zinc/40/02/15/1051400215.db2.gz RHVSVJWHKBVIDY-IRLDBZIGSA-N 2 0 342.527 4.293 20 0 EIADRP CO[C@@H](CC(C)C)C[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001191358530 1051428833 /nfs/dbraw/zinc/42/88/33/1051428833.db2.gz MMZBVIWRHYQDJR-FCHUYYIVSA-N 2 0 344.543 4.036 20 0 EIADRP C[C@H](CC[NH2+][C@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000155862986 1051470554 /nfs/dbraw/zinc/47/05/54/1051470554.db2.gz NEGOSMYXOVFGLO-CPUCHLNUSA-N 2 0 328.422 4.271 20 0 EIADRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2ccc(C(F)(F)F)cc2Cl)CC1 ZINC001205571453 1051553959 /nfs/dbraw/zinc/55/39/59/1051553959.db2.gz URGBZBWBMSRQIE-CQSZACIVSA-N 2 0 338.776 4.012 20 0 EIADRP CC(C)(C)[C@]1(C[NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC[N@H+](Cc2ccccc2)C1 ZINC001182453360 1051580447 /nfs/dbraw/zinc/58/04/47/1051580447.db2.gz SIVZKAWBVNRCBL-IIZPIQPGSA-N 2 0 326.528 4.313 20 0 EIADRP c1cncc(C2CC[NH+](Cc3ccc(C[NH+]4CCCCC4)cc3)CC2)c1 ZINC001192282387 1051682326 /nfs/dbraw/zinc/68/23/26/1051682326.db2.gz ISZVDKWWCRIMEL-UHFFFAOYSA-N 2 0 349.522 4.447 20 0 EIADRP CC[C@H](c1ccccc1)[NH+]1CCC(CCC[N@H+](C)CCOC)CC1 ZINC001192325453 1051692559 /nfs/dbraw/zinc/69/25/59/1051692559.db2.gz NOBGPIDVPQEETD-OAQYLSRUSA-N 2 0 332.532 4.208 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)C1 ZINC000158559518 1051757503 /nfs/dbraw/zinc/75/75/03/1051757503.db2.gz JRJVZSFWPOBSIO-BGYRXZFFSA-N 3 0 349.607 4.131 20 0 EIADRP C[C@@H]([NH2+]CC1CCC2(CC2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001183122667 1051784205 /nfs/dbraw/zinc/78/42/05/1051784205.db2.gz MAUSWJWGQOHIHZ-WIYYLYMNSA-N 2 0 326.528 4.457 20 0 EIADRP C[C@H]([NH2+]CC1CCC2(CC2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001183122660 1051784465 /nfs/dbraw/zinc/78/44/65/1051784465.db2.gz MAUSWJWGQOHIHZ-RXVVDRJESA-N 2 0 326.528 4.457 20 0 EIADRP C[C@@H](CC(C)(C)c1ccccc1)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC001183093924 1051785719 /nfs/dbraw/zinc/78/57/19/1051785719.db2.gz HAORXWSGVHPCMQ-ICSRJNTNSA-N 2 0 328.544 4.454 20 0 EIADRP C[C@H]([NH2+]CCC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1C[C@H]1C1CC1 ZINC001183145608 1051794086 /nfs/dbraw/zinc/79/40/86/1051794086.db2.gz KIBIUYYGCXLDIV-HSQYWUDLSA-N 2 0 326.528 4.313 20 0 EIADRP C[C@@H](CCc1c[nH]c2ccccc12)[NH2+]C[C@H]1CCN1C1CCCC1 ZINC001183238853 1051809481 /nfs/dbraw/zinc/80/94/81/1051809481.db2.gz QKKYXJHQKFFCQI-QFBILLFUSA-N 2 0 325.500 4.096 20 0 EIADRP CCC1([NH+]2CCCC2)CCN(Cc2ccc3c(c2)CCCC3)CC1 ZINC001183239219 1051809788 /nfs/dbraw/zinc/80/97/88/1051809788.db2.gz UFRFDUGEEQMMQA-UHFFFAOYSA-N 2 0 326.528 4.406 20 0 EIADRP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1cccc(OC(F)(F)F)c1 ZINC000775549664 1051816185 /nfs/dbraw/zinc/81/61/85/1051816185.db2.gz ZGZFYQFQQKMWJZ-HIFRSBDPSA-N 2 0 330.394 4.110 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H]2CCC[C@H](C3CC3)C2)(c2ccccc2)CC1 ZINC001183355475 1051826186 /nfs/dbraw/zinc/82/61/86/1051826186.db2.gz QQMYHONBMKCULH-FPOVZHCZSA-N 2 0 326.528 4.208 20 0 EIADRP C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]CC1(c2ccccc2)CC[NH+](C)CC1 ZINC001183354474 1051826661 /nfs/dbraw/zinc/82/66/61/1051826661.db2.gz CQZLDHRJJWBQRZ-QUCCMNQESA-N 2 0 328.544 4.454 20 0 EIADRP C[C@@H]1C[N@H+](Cc2cccc(CC3CCC3)c2)CCN1c1cc[nH+]cc1 ZINC001183534604 1051863929 /nfs/dbraw/zinc/86/39/29/1051863929.db2.gz RMQNXRVBSNRTKZ-GOSISDBHSA-N 2 0 335.495 4.135 20 0 EIADRP c1cc(C[NH+]2CCCCC2)cc(C[NH+]2CCC(c3ccncc3)CC2)c1 ZINC001193384196 1051914935 /nfs/dbraw/zinc/91/49/35/1051914935.db2.gz FKOPQRJMXYXNMA-UHFFFAOYSA-N 2 0 349.522 4.447 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCOC23CCCCC3)CC1 ZINC001184067500 1051942857 /nfs/dbraw/zinc/94/28/57/1051942857.db2.gz RRXJRILXVFAMII-MISYRCLQSA-N 2 0 334.548 4.111 20 0 EIADRP CC[C@H]([NH2+]C1CCN(c2ccc(C)cn2)CC1)c1ccc(F)cc1F ZINC000163499720 1051991758 /nfs/dbraw/zinc/99/17/58/1051991758.db2.gz KWVORGMIVPFZJS-IBGZPJMESA-N 2 0 345.437 4.378 20 0 EIADRP CC(C)C[C@H](C)C[C@H](C)[NH2+]CCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001184417524 1052009850 /nfs/dbraw/zinc/00/98/50/1052009850.db2.gz FJAXIIRAMSJWNT-PMACEKPBSA-N 2 0 345.575 4.031 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000165888346 1052079488 /nfs/dbraw/zinc/07/94/88/1052079488.db2.gz JRFKXJJDDMJNPE-MSOLQXFVSA-N 2 0 326.484 4.347 20 0 EIADRP CC(C)(C)[C@H]1CC[N@H+](Cc2cccc(C[NH+]3CCCCC3)c2)CCO1 ZINC001176995896 1052215856 /nfs/dbraw/zinc/21/58/56/1052215856.db2.gz OZRZIDWLPAFGCJ-OAQYLSRUSA-N 2 0 344.543 4.310 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]C[C@@H]1CCOc2ccccc21 ZINC001177127467 1052226585 /nfs/dbraw/zinc/22/65/85/1052226585.db2.gz ASUSROIHEXJTGU-IBGZPJMESA-N 2 0 338.495 4.184 20 0 EIADRP COc1cccc2cc([C@@H](C)[NH2+]Cc3ccc(C[NH+](C)C)cc3)oc21 ZINC000171128281 1052396679 /nfs/dbraw/zinc/39/66/79/1052396679.db2.gz UHWRZGMMOJXOPT-OAHLLOKOSA-N 2 0 338.451 4.354 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000671298592 1052591158 /nfs/dbraw/zinc/59/11/58/1052591158.db2.gz RNQHKZKSIOUJQD-QZTJIDSGSA-N 2 0 338.417 4.193 20 0 EIADRP COc1cc([C@H](C)N[C@H]2CC[N@H+](C)C(C)(C)C2)ccc1OCC(C)C ZINC000623348638 1052628653 /nfs/dbraw/zinc/62/86/53/1052628653.db2.gz FIHOIIMJFARUEN-WMZOPIPTSA-N 2 0 348.531 4.253 20 0 EIADRP COc1cc([C@@H](C)N[C@H]2CC[N@H+](C)C(C)(C)C2)ccc1OCC(C)C ZINC000623348635 1052628768 /nfs/dbraw/zinc/62/87/68/1052628768.db2.gz FIHOIIMJFARUEN-AEFFLSMTSA-N 2 0 348.531 4.253 20 0 EIADRP C[C@@H]([NH2+][C@@H](c1ccccc1)C1CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000178493849 1052707036 /nfs/dbraw/zinc/70/70/36/1052707036.db2.gz MBQUIRYGOZXBLS-VGSWGCGISA-N 2 0 338.495 4.429 20 0 EIADRP C[C@@H]([NH2+][C@H](c1ccccc1)C1CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000178494161 1052707256 /nfs/dbraw/zinc/70/72/56/1052707256.db2.gz OKIJETOCNYEWEQ-VGOFRKELSA-N 2 0 338.495 4.429 20 0 EIADRP Fc1ccc(S[C@@H]2CCCC[C@@H]2[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000623866514 1052825231 /nfs/dbraw/zinc/82/52/31/1052825231.db2.gz YQOTVWTZTDGIBY-KVPLUYHFSA-N 2 0 348.531 4.445 20 0 EIADRP Cc1ccc(Br)cc1[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000623866017 1052825706 /nfs/dbraw/zinc/82/57/06/1052825706.db2.gz IJSORYRKXMLZGK-NUEKZKHPSA-N 2 0 337.305 4.035 20 0 EIADRP c1nc2c(s1)CCC[C@H]2[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000623873762 1052827616 /nfs/dbraw/zinc/82/76/16/1052827616.db2.gz QRLULYUQPNEKJR-GOSISDBHSA-N 2 0 341.524 4.022 20 0 EIADRP Cc1csc([C@H](C)NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)n1 ZINC000623898808 1052831397 /nfs/dbraw/zinc/83/13/97/1052831397.db2.gz RKQNOGNWMVQUOP-SQWLQELKSA-N 2 0 335.542 4.247 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3c4cc(Cl)ccc4[nH]c32)CC[N@@H+]1C ZINC000623898300 1052832407 /nfs/dbraw/zinc/83/24/07/1052832407.db2.gz FAOWKUYTOFTHMU-UVBSCNOISA-N 2 0 331.891 4.271 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccc(F)cc1C(F)(F)F ZINC000623999526 1052850038 /nfs/dbraw/zinc/85/00/38/1052850038.db2.gz SXFVBWIXIZANPC-QWHCGFSZSA-N 2 0 332.385 4.227 20 0 EIADRP C[C@H]([NH2+]Cc1cc(F)cc2cccnc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185722858 1053021403 /nfs/dbraw/zinc/02/14/03/1053021403.db2.gz FBDFHONQBNRCFN-DOTOQJQBSA-N 2 0 341.474 4.117 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)cc1 ZINC000850174448 1053082136 /nfs/dbraw/zinc/08/21/36/1053082136.db2.gz QVXXRKVQFDYKOY-ROUUACIJSA-N 2 0 329.513 4.081 20 0 EIADRP C[C@H](Nc1ccc(C[NH+](C)C)c(F)c1)c1cccc(C[NH+](C)C)c1 ZINC000864006148 1053126401 /nfs/dbraw/zinc/12/64/01/1053126401.db2.gz RALYIRJRTVVYPQ-HNNXBMFYSA-N 2 0 329.463 4.122 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)s1 ZINC000765305777 1053501361 /nfs/dbraw/zinc/50/13/61/1053501361.db2.gz QDVQWOMUCUCZMD-HOTGVXAUSA-N 2 0 332.513 4.409 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](CC2CCCCC2)CC1)c1ccc2c(c1)COC2 ZINC000765453992 1053557333 /nfs/dbraw/zinc/55/73/33/1053557333.db2.gz VUQSLZVTWRPBOP-QGZVFWFLSA-N 2 0 342.527 4.412 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+]Cc2cnc(-c3ccco3)s2)CC1 ZINC000865717290 1053579617 /nfs/dbraw/zinc/57/96/17/1053579617.db2.gz WHAGFFNRPJFIRD-UHFFFAOYSA-N 2 0 333.501 4.003 20 0 EIADRP FC(F)(F)CCSCC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000865786543 1053591170 /nfs/dbraw/zinc/59/11/70/1053591170.db2.gz DVNYBEOOVIOIOD-UHFFFAOYSA-N 2 0 338.483 4.059 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](c2ccccn2)C(C)C)c1 ZINC000866237031 1053658401 /nfs/dbraw/zinc/65/84/01/1053658401.db2.gz GUGNOZWRHUHACN-OAQYLSRUSA-N 2 0 325.500 4.410 20 0 EIADRP CCCC[N@H+](Cc1cncc(OC)c1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196545636 1053696574 /nfs/dbraw/zinc/69/65/74/1053696574.db2.gz RVUGHLZBOWOMQP-UHFFFAOYSA-N 2 0 333.520 4.002 20 0 EIADRP Cc1ccc(C2CC([NH2+]C[C@H]3CC[N@H+](Cc4ccccc4)C3)C2)cc1 ZINC000386481548 1053743660 /nfs/dbraw/zinc/74/36/60/1053743660.db2.gz WGKZQVYKOUKNDP-RDABAPPSSA-N 2 0 334.507 4.353 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@@H](C[C@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000866518422 1053764071 /nfs/dbraw/zinc/76/40/71/1053764071.db2.gz ZLERTOVTBGAHBK-ZEXAPNKDSA-N 2 0 348.506 4.146 20 0 EIADRP C[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1cccc(OC(F)F)c1 ZINC000866517122 1053764292 /nfs/dbraw/zinc/76/42/92/1053764292.db2.gz XBQABZQXRZGKSO-UQHVZDHRSA-N 2 0 326.431 4.202 20 0 EIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)cc1OC ZINC000866517291 1053765269 /nfs/dbraw/zinc/76/52/69/1053765269.db2.gz GEPYKRIHJRJWJK-WEWVYDFXSA-N 2 0 348.531 4.048 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@H](c2ccc(F)cc2)c2ccccn2)CC1 ZINC000866517376 1053765585 /nfs/dbraw/zinc/76/55/85/1053765585.db2.gz IBJUMCDNSJHPNA-VEDCXYSMSA-N 2 0 341.474 4.163 20 0 EIADRP CC[NH+](CC)Cc1cccc(N2C[C@H](CC[NH3+])c3ccccc32)c1F ZINC001168547555 1053781547 /nfs/dbraw/zinc/78/15/47/1053781547.db2.gz FNGABIHKXBCKQY-INIZCTEOSA-N 2 0 341.474 4.252 20 0 EIADRP CC(C)C[N@@H+](Cc1cccc(OC(C)(C)C)n1)CC1CC[NH+](C)CC1 ZINC001197194921 1053851697 /nfs/dbraw/zinc/85/16/97/1053851697.db2.gz YCFFIXFXUYWBDG-UHFFFAOYSA-N 2 0 347.547 4.059 20 0 EIADRP CC(C)Oc1ccc2ccccc2c1CN1[C@@H]2CC[C@H]1CC[N@@H+](C)C2 ZINC001197702482 1053976209 /nfs/dbraw/zinc/97/62/09/1053976209.db2.gz YOTJOVBMAOJGSS-RBUKOAKNSA-N 2 0 338.495 4.296 20 0 EIADRP COC1CCC(CC[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)CC1 ZINC000542665989 1054030816 /nfs/dbraw/zinc/03/08/16/1054030816.db2.gz TXPRUQQTVLPDKM-CZOVOBHWSA-N 2 0 336.564 4.214 20 0 EIADRP C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000429531724 1054050782 /nfs/dbraw/zinc/05/07/82/1054050782.db2.gz SFKZTMZPRWGJSX-DZGCQCFKSA-N 2 0 330.394 4.062 20 0 EIADRP CCC(C)(C)CC[N@@H+]1CC[C@H](Oc2ccnc(C[NH+](C)C(C)C)c2)C1 ZINC000856599654 1054090808 /nfs/dbraw/zinc/09/08/08/1054090808.db2.gz MPWIMWCBAVISCC-FQEVSTJZSA-N 2 0 347.547 4.201 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CC[C@H]3CC3(Cl)Cl)CC2)C1 ZINC000857065404 1054170117 /nfs/dbraw/zinc/17/01/17/1054170117.db2.gz NUACRKIZOJEBRT-IJEWVQPXSA-N 2 0 333.347 4.203 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCOC3(CCCC3)C2)cc1 ZINC000872018152 1054331020 /nfs/dbraw/zinc/33/10/20/1054331020.db2.gz JCBARSOWVLHNAX-HXUWFJFHSA-N 2 0 330.516 4.110 20 0 EIADRP CC[C@@H](CCC(F)(F)F)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000872046265 1054359466 /nfs/dbraw/zinc/35/94/66/1054359466.db2.gz GEXKVHOXGGCYMQ-HNNXBMFYSA-N 2 0 329.410 4.009 20 0 EIADRP C[C@H](C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)Cc1ccc(C(C)(C)C)cc1 ZINC001199197844 1054361228 /nfs/dbraw/zinc/36/12/28/1054361228.db2.gz KIQHFATWCUYHLE-HKUYNNGSSA-N 2 0 328.544 4.237 20 0 EIADRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)CCO1 ZINC001199275048 1054374624 /nfs/dbraw/zinc/37/46/24/1054374624.db2.gz CGUXRPGAJZDKRD-NYVOZVTQSA-N 2 0 344.543 4.354 20 0 EIADRP CC(C)n1c2ccccc2nc1C[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC001199336664 1054385619 /nfs/dbraw/zinc/38/56/19/1054385619.db2.gz UVYHEZNIHSKUAG-SFHVURJKSA-N 2 0 342.531 4.361 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cc(F)ccc1OC(F)F ZINC001199336844 1054388065 /nfs/dbraw/zinc/38/80/65/1054388065.db2.gz YJBHKSNGDUFIBC-AWEZNQCLSA-N 2 0 344.421 4.171 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(CC(F)(F)F)cc2)C1 ZINC001199346355 1054389167 /nfs/dbraw/zinc/38/91/67/1054389167.db2.gz ZDTOYXPKGINQLJ-INIZCTEOSA-N 2 0 342.449 4.393 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2nccc3ccccc32)C1 ZINC001199319395 1054391089 /nfs/dbraw/zinc/39/10/89/1054391089.db2.gz AUOGENWNZUVIEQ-HDICACEKSA-N 2 0 325.500 4.083 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+][C@@H]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC001199321083 1054392969 /nfs/dbraw/zinc/39/29/69/1054392969.db2.gz UYJZZTKBYDONBH-FHRFECMSSA-N 2 0 344.543 4.210 20 0 EIADRP C[C@@H](C[NH2+]C[C@@H](C)C[NH+]1CCCC1)Cc1ccc(C(C)(C)C)cc1 ZINC001199403023 1054406113 /nfs/dbraw/zinc/40/61/13/1054406113.db2.gz CPARZYLOOUFSPJ-RTBURBONSA-N 2 0 330.560 4.484 20 0 EIADRP C[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC001199963328 1054505357 /nfs/dbraw/zinc/50/53/57/1054505357.db2.gz WJORURSJCVQHEV-SWLSCSKDSA-N 2 0 329.315 4.387 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(-c2nc3ccccc3s2)o1)C1CC[NH2+]CC1 ZINC000873219966 1054510264 /nfs/dbraw/zinc/51/02/64/1054510264.db2.gz CVKSLTAKKLATBW-CYBMUJFWSA-N 2 0 341.480 4.034 20 0 EIADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000873249604 1054513998 /nfs/dbraw/zinc/51/39/98/1054513998.db2.gz BFYDZOASPCSQLG-VJUNAUMWSA-N 2 0 326.406 4.059 20 0 EIADRP Cc1cc([C@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)sc1Br ZINC000873261602 1054517485 /nfs/dbraw/zinc/51/74/85/1054517485.db2.gz PKITYJYXWJRODN-RVMXOQNASA-N 2 0 343.334 4.000 20 0 EIADRP C[C@@H](CC[NH2+][C@H](C)c1ccns1)CC[NH2+][C@@H](C)c1ccns1 ZINC000860058836 1054764160 /nfs/dbraw/zinc/76/41/60/1054764160.db2.gz JFRFOWVOXJXYRD-BTTYYORXSA-N 2 0 338.546 4.017 20 0 EIADRP C[N@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+](C[C@H]1CC=CCC1)CC2 ZINC001201408954 1054787290 /nfs/dbraw/zinc/78/72/90/1054787290.db2.gz MXIJBXUSFNRJPA-AZUAARDMSA-N 2 0 328.500 4.312 20 0 EIADRP COC[C@@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](C[C@H](C)CCC=C(C)C)C2 ZINC001201486255 1054815672 /nfs/dbraw/zinc/81/56/72/1054815672.db2.gz HWJDCUUUPYLZGV-HJNYFJLDSA-N 2 0 348.575 4.049 20 0 EIADRP C[C@H]1C[C@H](CC[NH2+]Cc2cc(F)ccc2F)C[N@@H+]1Cc1ccccc1 ZINC001201492027 1054818645 /nfs/dbraw/zinc/81/86/45/1054818645.db2.gz PANQHTNAIMUPLH-WMZOPIPTSA-N 2 0 344.449 4.355 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2nc3ccccc3o2)C[N@@H+]1Cc1ccccc1 ZINC001201492515 1054818920 /nfs/dbraw/zinc/81/89/20/1054818920.db2.gz QHDZOIDOAGCAKO-MJGOQNOKSA-N 2 0 349.478 4.218 20 0 EIADRP c1ccc(CCC[N@@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)cc1 ZINC001201672755 1054872374 /nfs/dbraw/zinc/87/23/74/1054872374.db2.gz XEWPHMPDEHYQPR-PKTZIBPZSA-N 2 0 334.507 4.073 20 0 EIADRP c1ccc(CCC[N@@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001201681702 1054874486 /nfs/dbraw/zinc/87/44/86/1054874486.db2.gz CIZQLBIMNVMSIZ-DNQXCXABSA-N 2 0 348.534 4.463 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2c(Cl)cccc2N2CC[NH+](C)CC2)C[C@@H]1C ZINC001201928865 1054943397 /nfs/dbraw/zinc/94/33/97/1054943397.db2.gz FLTDBBPJAANPTK-IXDOHACOSA-N 2 0 349.950 4.006 20 0 EIADRP CC(C)=CCC[C@H](C)CC[NH+]1CCC([N@H+](C)C2CCOCC2)CC1 ZINC001201983084 1054958854 /nfs/dbraw/zinc/95/88/54/1054958854.db2.gz XGZRTKXPADXZSJ-IBGZPJMESA-N 2 0 336.564 4.334 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(-c2cccnc2)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001201946725 1054962646 /nfs/dbraw/zinc/96/26/46/1054962646.db2.gz KTXXNFWZQKJBLR-XMSQKQJNSA-N 2 0 349.522 4.491 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccc(Cl)o2)CC1 ZINC000671755214 1055020901 /nfs/dbraw/zinc/02/09/01/1055020901.db2.gz CDXHTHSCEHCILN-UHFFFAOYSA-N 2 0 332.875 4.466 20 0 EIADRP C[C@H]1C[C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CS1 ZINC000877546916 1055075664 /nfs/dbraw/zinc/07/56/64/1055075664.db2.gz NPUPSUNBSGIMEB-VAKYOOAGSA-N 2 0 330.541 4.056 20 0 EIADRP COCC(C)(C)CC[NH2+][C@@H]1CCN(C2CC2)[C@H](c2ccccc2)C1 ZINC000877803739 1055122931 /nfs/dbraw/zinc/12/29/31/1055122931.db2.gz JDMAKYZATZYEAT-QUCCMNQESA-N 2 0 330.516 4.007 20 0 EIADRP FC(F)(F)CC[NH+]1CCC2(CC1)CC[NH+](Cc1cccs1)CC2 ZINC001202330059 1055142133 /nfs/dbraw/zinc/14/21/33/1055142133.db2.gz YTUAXEJFDVXUJT-UHFFFAOYSA-N 2 0 346.462 4.379 20 0 EIADRP FC(F)n1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)c2ccccc21 ZINC000863547738 1055227344 /nfs/dbraw/zinc/22/73/44/1055227344.db2.gz RTPONCALGPQUEE-KZNAEPCWSA-N 2 0 347.453 4.437 20 0 EIADRP c1cc2cc(C[NH2+]C3CC[NH+](CC4CCCCC4)CC3)ccc2cn1 ZINC000785441689 1055390986 /nfs/dbraw/zinc/39/09/86/1055390986.db2.gz LXNFCZIXXOOKKB-UHFFFAOYSA-N 2 0 337.511 4.369 20 0 EIADRP C[C@H](Cc1ccsc1)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000542776144 1055971486 /nfs/dbraw/zinc/97/14/86/1055971486.db2.gz VDNLQTFQORFZME-FUHIMQAGSA-N 2 0 328.525 4.179 20 0 EIADRP C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)C1CCC(C(F)(F)F)CC1 ZINC000475575214 1056499398 /nfs/dbraw/zinc/49/93/98/1056499398.db2.gz QMUVYPGREILRCJ-SIGVMEELSA-N 2 0 332.454 4.350 20 0 EIADRP Cc1n[nH]cc1[C@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000180187136 1058422370 /nfs/dbraw/zinc/42/23/70/1058422370.db2.gz ZOFQLQLXSOWFLR-INIZCTEOSA-N 2 0 340.515 4.333 20 0 EIADRP c1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCCNc4ccccc43)CC2)cc1 ZINC000192734443 1060210610 /nfs/dbraw/zinc/21/06/10/1060210610.db2.gz KGAKKPKJLKGMOU-HSZRJFAPSA-N 2 0 349.522 4.435 20 0 EIADRP Cc1nc(C)c([C@@H](C)[NH2+]C[C@@H]2CCCN(Cc3ccccc3)C2)s1 ZINC000383343404 1060246239 /nfs/dbraw/zinc/24/62/39/1060246239.db2.gz LNEFHQLOZUKONT-BEFAXECRSA-N 2 0 343.540 4.323 20 0 EIADRP CC[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc2c(c1)CCO2 ZINC000766409159 1060335641 /nfs/dbraw/zinc/33/56/41/1060335641.db2.gz MJLJDAHAKGFTMA-OAQYLSRUSA-N 2 0 342.527 4.459 20 0 EIADRP CC(C)[PH+](CC[NH2+][C@@H]1C[C@@H](C)N(C(=O)OC(C)(C)C)C1)C(C)C ZINC001168840870 1060451499 /nfs/dbraw/zinc/45/14/99/1060451499.db2.gz WGEDFIZHXMPYHB-HZPDHXFCSA-N 2 0 344.480 4.273 20 0 EIADRP COc1ccc(C)cc1[C@H](C)[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000766514833 1060473378 /nfs/dbraw/zinc/47/33/78/1060473378.db2.gz ZFXPRYPLAOWAOB-VIQWUECVSA-N 2 0 330.516 4.451 20 0 EIADRP CC(C)C[C@@H](Cc1ccccc1)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC001169062030 1060619375 /nfs/dbraw/zinc/61/93/75/1060619375.db2.gz QAKXBOWUAGQZRC-NRFANRHFSA-N 2 0 337.511 4.297 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CCc1ccc(Oc3ccccc3)cc1)C2 ZINC001169096479 1060633172 /nfs/dbraw/zinc/63/31/72/1060633172.db2.gz XIZHZOMUUOALER-ACDBMABISA-N 2 0 336.479 4.236 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C(C)(C)c1ccc(C(F)(F)F)cc1)C2 ZINC001169091875 1060646087 /nfs/dbraw/zinc/64/60/87/1060646087.db2.gz WPVKOLGDRFPIEQ-PHZGNYQRSA-N 2 0 326.406 4.155 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC(Cc3cccc(Cl)c3)CC1)C2 ZINC001169125580 1060651914 /nfs/dbraw/zinc/65/19/14/1060651914.db2.gz JILBOPVWCAUKEM-PMOLBWCYSA-N 2 0 332.919 4.220 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC(c3nc4ccccc4s3)CC1)C2 ZINC001169142405 1060662745 /nfs/dbraw/zinc/66/27/45/1060662745.db2.gz UDWPWWFHCNBERN-FVQHAEBGSA-N 2 0 341.524 4.101 20 0 EIADRP C[N@@H+]1CC[C@H](c2ccc(N[C@H]3CC(C)(C)C[C@@](C)(C[NH3+])C3)cc2)C1 ZINC001169148765 1060668985 /nfs/dbraw/zinc/66/89/85/1060668985.db2.gz ZYHNFNMFNAQZES-CUWPLCDZSA-N 2 0 329.532 4.061 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1)C2 ZINC001169154263 1060669755 /nfs/dbraw/zinc/66/97/55/1060669755.db2.gz PCDDHHYQTQGNMG-XMTFNYHQSA-N 2 0 338.417 4.468 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)c(C)o1 ZINC000767348056 1061204776 /nfs/dbraw/zinc/20/47/76/1061204776.db2.gz VOIFZVDETCRTQU-UHFFFAOYSA-N 2 0 326.484 4.418 20 0 EIADRP C[C@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]CCc1c[nH]c2ccccc12 ZINC000532188300 1032076384 /nfs/dbraw/zinc/07/63/84/1032076384.db2.gz CTDPQNUXXFUXKW-AVRDEDQJSA-N 2 0 347.506 4.211 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C1CCOCC1 ZINC000532228394 1032107885 /nfs/dbraw/zinc/10/78/85/1032107885.db2.gz QYNXWTAKCHUTRQ-JOCHJYFZSA-N 2 0 344.543 4.357 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@@H]3CCCOc4ccccc43)C2)cc1 ZINC000195137036 1032204131 /nfs/dbraw/zinc/20/41/31/1032204131.db2.gz XKYCQGHQBXWCFM-TZIWHRDSSA-N 2 0 336.479 4.012 20 0 EIADRP C[C@@H]([NH2+][C@H]1CCN(Cc2ccccc2)CC1(C)C)C1CC(F)(F)C1 ZINC000529556103 1032452371 /nfs/dbraw/zinc/45/23/71/1032452371.db2.gz JTQAXXBMAOOBNC-QAPCUYQASA-N 2 0 336.470 4.311 20 0 EIADRP C[N@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)C[C@H]1CCCCC1(F)F ZINC000450455631 1032511098 /nfs/dbraw/zinc/51/10/98/1032511098.db2.gz OFYUOHGZROAWRC-RBUKOAKNSA-N 2 0 336.470 4.266 20 0 EIADRP CC[N@H+](C)C[C@@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1 ZINC000450475824 1032520639 /nfs/dbraw/zinc/52/06/39/1032520639.db2.gz ZYOYMCQNFCPKTR-HOCLYGCPSA-N 2 0 328.422 4.126 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)c1ccccc1C(C)(C)C ZINC000533170059 1032529175 /nfs/dbraw/zinc/52/91/75/1032529175.db2.gz QQRGKZAJRKBGIA-ROUUACIJSA-N 2 0 344.543 4.136 20 0 EIADRP C[C@H](c1ccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C)C2)cc1)C(F)(F)F ZINC000450504320 1032533554 /nfs/dbraw/zinc/53/35/54/1032533554.db2.gz UMSHESASPLNLOZ-FHLIZLRMSA-N 2 0 340.433 4.269 20 0 EIADRP C[C@H](c1ccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C)C2)cc1)C(F)(F)F ZINC000450504321 1032534064 /nfs/dbraw/zinc/53/40/64/1032534064.db2.gz UMSHESASPLNLOZ-JLSDUUJJSA-N 2 0 340.433 4.269 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CCN(Cc2ccccn2)C[C@H]1C)c1ccccc1F ZINC000245983101 1032573582 /nfs/dbraw/zinc/57/35/82/1032573582.db2.gz PREZWHYMTNFBLK-TYCQWZJGSA-N 2 0 341.474 4.172 20 0 EIADRP CCCC[C@@H](CC)CC[NH+]1CCC(N2CC[NH+](C(C)C)CC2)CC1 ZINC000438100202 1032728458 /nfs/dbraw/zinc/72/84/58/1032728458.db2.gz BYRUVWBJORAZKX-HXUWFJFHSA-N 2 0 337.596 4.083 20 0 EIADRP C/C=C\COc1ccc(CC[C@H](C)[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000643546200 1018899338 /nfs/dbraw/zinc/89/93/38/1018899338.db2.gz KGDPICLPQGNFBP-KFONASLZSA-N 2 0 342.527 4.227 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)C(c1ccccc1)c1ccccc1 ZINC000643546636 1018899921 /nfs/dbraw/zinc/89/99/21/1018899921.db2.gz SEKKXNMQTCKDJQ-WIYYLYMNSA-N 2 0 334.507 4.471 20 0 EIADRP C[C@@H]([NH2+]CC1(c2cccc(F)c2F)CCCC1)C1CC[NH+](C)CC1 ZINC000683158781 1019012673 /nfs/dbraw/zinc/01/26/73/1019012673.db2.gz MXYNUBWSXATHKU-OAHLLOKOSA-N 2 0 336.470 4.097 20 0 EIADRP CCOc1cc(CN2CCC[C@@H]([NH+](C)C)CC2)ccc1OCC(C)C ZINC000432793222 1032812493 /nfs/dbraw/zinc/81/24/93/1032812493.db2.gz NQZLYHDOOJPNTF-LJQANCHMSA-N 2 0 348.531 4.036 20 0 EIADRP c1cc2cccc(C[NH2+]Cc3ccccc3C[NH+]3CCCCC3)c2[nH]1 ZINC000236658787 1032824496 /nfs/dbraw/zinc/82/44/96/1032824496.db2.gz KYZVWCGCSPGAEL-UHFFFAOYSA-N 2 0 333.479 4.444 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccc(Cl)cn2)c1 ZINC000274912114 1019853130 /nfs/dbraw/zinc/85/31/30/1019853130.db2.gz NHXYPABTEXVOKI-OAHLLOKOSA-N 2 0 331.891 4.428 20 0 EIADRP C[C@@H]1C[C@@H](C[N@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)C[C@H](C)O1 ZINC001209390759 1020244396 /nfs/dbraw/zinc/24/43/96/1020244396.db2.gz NBRQFKHBKRMXKK-HATOLVCRSA-N 2 0 344.543 4.034 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1cncs1 ZINC000155212541 1020357193 /nfs/dbraw/zinc/35/71/93/1020357193.db2.gz DYFRUYSJXFXXQE-AWEZNQCLSA-N 2 0 349.931 4.359 20 0 EIADRP CCC1(C[NH2+]Cc2ccc(C)cn2)CC[NH+](Cc2ccccc2)CC1 ZINC000533584309 1020415854 /nfs/dbraw/zinc/41/58/54/1020415854.db2.gz UODQHIKJGOUPMY-UHFFFAOYSA-N 2 0 337.511 4.172 20 0 EIADRP C[N@H+](CCC[NH+]1CCC(Cc2ccccc2)CC1)CC1CCCC1 ZINC001167206502 1020553096 /nfs/dbraw/zinc/55/30/96/1020553096.db2.gz QVOPBQFWRLQWRS-UHFFFAOYSA-N 2 0 328.544 4.453 20 0 EIADRP CC1CC[NH+](C[C@H]2CCCN(CC[C@H]3CC3(Cl)Cl)C2)CC1 ZINC001167255606 1020678694 /nfs/dbraw/zinc/67/86/94/1020678694.db2.gz JSZUAJWRNLHXIF-HOTGVXAUSA-N 2 0 333.347 4.014 20 0 EIADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547831563 1020779879 /nfs/dbraw/zinc/77/98/79/1020779879.db2.gz ACPRCCVYUZNZTO-YJMBLLCNSA-N 2 0 344.543 4.080 20 0 EIADRP CCC[C@H]([NH2+]C1CCN([C@H]2CCOC2)CC1)c1ccc(Cl)cc1 ZINC000655733391 1020924528 /nfs/dbraw/zinc/92/45/28/1020924528.db2.gz MUAOALSDJVDJFW-OALUTQOASA-N 2 0 336.907 4.024 20 0 EIADRP CCC[C@@H]([NH2+]C1CCN([C@@H]2CCOC2)CC1)c1ccc(Cl)cc1 ZINC000655733394 1020924799 /nfs/dbraw/zinc/92/47/99/1020924799.db2.gz MUAOALSDJVDJFW-RTBURBONSA-N 2 0 336.907 4.024 20 0 EIADRP CC(C)Oc1ccc([C@H]2CCC[C@H]2[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1 ZINC000655805182 1020972288 /nfs/dbraw/zinc/97/22/88/1020972288.db2.gz KBUAMTBNQHKRAW-XRULBBBTSA-N 2 0 330.516 4.040 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1 ZINC000655805180 1020972475 /nfs/dbraw/zinc/97/24/75/1020972475.db2.gz KBUAMTBNQHKRAW-OFCAXSSNSA-N 2 0 330.516 4.040 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000655804782 1020972811 /nfs/dbraw/zinc/97/28/11/1020972811.db2.gz BKJDXRAYDDKWFZ-COMQUAJESA-N 2 0 345.314 4.079 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc2ccccc2c1OC(F)F ZINC000655807547 1020975673 /nfs/dbraw/zinc/97/56/73/1020975673.db2.gz PINGGQCZBRACBT-FMKPAKJESA-N 2 0 348.437 4.432 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCCc3cc(Br)ccc32)cc1 ZINC000579960529 1021019715 /nfs/dbraw/zinc/01/97/15/1021019715.db2.gz YSXMGJDTUXKUMB-SFHVURJKSA-N 2 0 345.284 4.075 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]CCCCC[NH+]1CCCC1)CCS2 ZINC000340475276 1021094351 /nfs/dbraw/zinc/09/43/51/1021094351.db2.gz MNQVYOWWASIOBI-GOSISDBHSA-N 2 0 334.529 4.088 20 0 EIADRP c1ccc(C[N@H+]2CCC[C@H](C[NH2+][C@H]3CCCNc4ccccc43)C2)cc1 ZINC000683690503 1021098177 /nfs/dbraw/zinc/09/81/77/1021098177.db2.gz LXCNRXJQOCVLDR-OFNKIYASSA-N 2 0 349.522 4.435 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1nc(C(F)(F)F)cs1 ZINC000340476572 1021098469 /nfs/dbraw/zinc/09/84/69/1021098469.db2.gz SYMAWMGKWYZMLG-GFCCVEGCSA-N 2 0 335.439 4.079 20 0 EIADRP CC1CC[NH+](CCC[C@@H]([NH2+][C@@H]2CCCOC2)c2ccc(F)cc2)CC1 ZINC000340502100 1021156990 /nfs/dbraw/zinc/15/69/90/1021156990.db2.gz WRTYVDHZJVGGSB-NHCUHLMSSA-N 2 0 348.506 4.148 20 0 EIADRP c1cc2cc(C[NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)ccc2cn1 ZINC000683764143 1021375975 /nfs/dbraw/zinc/37/59/75/1021375975.db2.gz ZOYJQXHJZPDGPD-UHFFFAOYSA-N 2 0 331.463 4.120 20 0 EIADRP CCCN1CC[C@@H]([NH2+]C(CCC(F)(F)F)CCC(F)(F)F)C1 ZINC000926717055 1021604075 /nfs/dbraw/zinc/60/40/75/1021604075.db2.gz YOPYUUITMHFUJS-GFCCVEGCSA-N 2 0 334.348 4.114 20 0 EIADRP CCCN1CC[C@H]([NH2+]C(CCC(F)(F)F)CCC(F)(F)F)C1 ZINC000926717056 1021604620 /nfs/dbraw/zinc/60/46/20/1021604620.db2.gz YOPYUUITMHFUJS-LBPRGKRZSA-N 2 0 334.348 4.114 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1cccc(C[NH+](C)C)c1 ZINC000924566495 1021747698 /nfs/dbraw/zinc/74/76/98/1021747698.db2.gz DQYNFDKPJZUVGP-AWEZNQCLSA-N 2 0 334.410 4.200 20 0 EIADRP CN(c1ccccc1)c1ccc(C[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC000613266646 1021838995 /nfs/dbraw/zinc/83/89/95/1021838995.db2.gz PXVQSMNJHFMPJP-UHFFFAOYSA-N 2 0 349.522 4.419 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1 ZINC000414103512 1021858320 /nfs/dbraw/zinc/85/83/20/1021858320.db2.gz DUXDLFYWESCUCR-FGTMMUONSA-N 2 0 330.516 4.307 20 0 EIADRP CC[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc2c(c1)CCO2 ZINC000160470105 1021882267 /nfs/dbraw/zinc/88/22/67/1021882267.db2.gz ZYZKZJCDUKLPLC-FQEVSTJZSA-N 2 0 328.500 4.069 20 0 EIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]Cc1cc2ccccc2[nH]1 ZINC000683929143 1021997725 /nfs/dbraw/zinc/99/77/25/1021997725.db2.gz OVRPRCKFIYRXOS-ROUUACIJSA-N 2 0 347.506 4.414 20 0 EIADRP CCC[NH+]1CCC([NH2+]CCc2ccc(-c3csc(C)n3)s2)CC1 ZINC000135936804 1022009450 /nfs/dbraw/zinc/00/94/50/1022009450.db2.gz QZDUIAWHGILILN-UHFFFAOYSA-N 2 0 349.569 4.187 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc2c[nH+]cn2c1)c1cc(Cl)ccc1OC ZINC000414186784 1022073545 /nfs/dbraw/zinc/07/35/45/1022073545.db2.gz PKEKHXJWCHDTMZ-QGZVFWFLSA-N 2 0 329.831 4.237 20 0 EIADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000414202827 1022126358 /nfs/dbraw/zinc/12/63/58/1022126358.db2.gz ZGTPHSNWUGHIHE-HUUCEWRRSA-N 2 0 344.421 4.010 20 0 EIADRP CC[C@@H]([NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccccc1 ZINC000414219527 1022192157 /nfs/dbraw/zinc/19/21/57/1022192157.db2.gz HQBRQJILMDJNJI-LAUBAEHRSA-N 2 0 326.484 4.429 20 0 EIADRP COc1ccsc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000471602662 1022308892 /nfs/dbraw/zinc/30/88/92/1022308892.db2.gz CTHLLGUDIXOTHK-XYJFISCASA-N 2 0 344.524 4.318 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1cncc(Br)c1 ZINC000580659954 1022347819 /nfs/dbraw/zinc/34/78/19/1022347819.db2.gz MARLMWJFOQTYLG-KBPBESRZSA-N 2 0 342.325 4.005 20 0 EIADRP CCCCOc1ccc(C[N@H+](C)[C@@H]2CCN(C)C[C@@H]2C)cc1OCC ZINC000580801447 1022510637 /nfs/dbraw/zinc/51/06/37/1022510637.db2.gz JFPYGVJEIBKKAX-PKOBYXMFSA-N 2 0 348.531 4.036 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2ccc(-c3ccccc3F)o2)CC1 ZINC000511540564 1022714752 /nfs/dbraw/zinc/71/47/52/1022714752.db2.gz IIMPXTZKKMKRDA-UHFFFAOYSA-N 2 0 330.447 4.249 20 0 EIADRP C[C@@H]([NH2+]CCc1c(F)cccc1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000402101119 1022801392 /nfs/dbraw/zinc/80/13/92/1022801392.db2.gz VGCRZWLMUXDAJU-AEFFLSMTSA-N 2 0 344.449 4.008 20 0 EIADRP c1ccc(C[N@@H+]2C[C@@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[NH+]2Cc2ccccc2)cc1 ZINC000656404134 1022845361 /nfs/dbraw/zinc/84/53/61/1022845361.db2.gz WYQSTLLFJCLBJL-GPJHCHHRSA-N 2 0 332.491 4.029 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C)[C@@H]1c1ccccc1)c1ccc(Cl)nc1 ZINC000378513144 1022853646 /nfs/dbraw/zinc/85/36/46/1022853646.db2.gz AGOMEDHCRQTWOU-UCLAIMLFSA-N 2 0 329.875 4.079 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2cnn(C(C)C)c2)c1 ZINC000163569441 1022922673 /nfs/dbraw/zinc/92/26/73/1022922673.db2.gz UPAXIKJMSJHDAA-KRWDZBQOSA-N 2 0 328.504 4.157 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cnn(C3CCC3)c2)cc1 ZINC000924585747 1022965303 /nfs/dbraw/zinc/96/53/03/1022965303.db2.gz QUIROTRPSLSECX-QGZVFWFLSA-N 2 0 340.515 4.301 20 0 EIADRP C[C@@H]([NH2+][C@H](c1ccccc1)c1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC000396436948 1023015676 /nfs/dbraw/zinc/01/56/76/1023015676.db2.gz HBHBPEYWSNXXNA-IIBYNOLFSA-N 2 0 326.459 4.235 20 0 EIADRP C[C@@H](NC1CC([NH+]2CCCCC2)C1)c1cccc(-c2ccncc2)c1 ZINC000376595325 1023151776 /nfs/dbraw/zinc/15/17/76/1023151776.db2.gz MMNICNXREUKKAQ-PPNDLDFTSA-N 2 0 335.495 4.416 20 0 EIADRP COc1ccc2ccccc2c1C[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000589836699 1023222305 /nfs/dbraw/zinc/22/23/05/1023222305.db2.gz QYEQHBHPIRFFLB-SFHVURJKSA-N 2 0 340.511 4.450 20 0 EIADRP CCc1onc(C)c1C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000892743812 1023360165 /nfs/dbraw/zinc/36/01/65/1023360165.db2.gz ZJMSJXTWFWDCCL-UHFFFAOYSA-N 2 0 341.499 4.211 20 0 EIADRP CC[N@H+](CCC1CC[NH+](C[C@@H]2CCC3(CCCC3)O2)CC1)CC1CC1 ZINC000549136809 1023363524 /nfs/dbraw/zinc/36/35/24/1023363524.db2.gz YUDPKQXWGVKNRQ-NRFANRHFSA-N 2 0 348.575 4.312 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cccc(OCc2ccc(F)cc2)c1 ZINC000415016946 1023392071 /nfs/dbraw/zinc/39/20/71/1023392071.db2.gz QXGQWZGWZXKPDY-INIZCTEOSA-N 2 0 330.447 4.012 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc(Br)cc1)c1ccccc1 ZINC000415052351 1023409559 /nfs/dbraw/zinc/40/95/59/1023409559.db2.gz KSTOVPMHWRRFFQ-QGZVFWFLSA-N 2 0 333.273 4.019 20 0 EIADRP COc1ccc(CC[C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000415060632 1023413795 /nfs/dbraw/zinc/41/37/95/1023413795.db2.gz XCYZFLSCWBVMSK-LAUBAEHRSA-N 2 0 326.484 4.086 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@H](CCC[NH3+])c3ccccc3)CC2)C1 ZINC000415061584 1023416133 /nfs/dbraw/zinc/41/61/33/1023416133.db2.gz YRSAXICYQKMCBS-STZQEDGTSA-N 3 0 343.559 4.099 20 0 EIADRP Brc1ccc([C@@H]([NH2+][C@H]2CCC[NH2+]CC2)C2CCC2)cc1 ZINC000415090353 1023435430 /nfs/dbraw/zinc/43/54/30/1023435430.db2.gz ZBMXOSARXIWCHD-IRXDYDNUSA-N 2 0 337.305 4.022 20 0 EIADRP c1ccc(C[NH+]2CCC(C[NH2+]Cc3ccc4cnccc4c3)CC2)cc1 ZINC000397507693 1023449726 /nfs/dbraw/zinc/44/97/26/1023449726.db2.gz HTIUZQGOZMTHFS-UHFFFAOYSA-N 2 0 345.490 4.237 20 0 EIADRP CC(C)C[C@H](C[NH+]1CCC([C@@H]2C[C@H]([NH3+])CCO2)CC1)c1ccccc1 ZINC000415120020 1023452202 /nfs/dbraw/zinc/45/22/02/1023452202.db2.gz GDEUWXOCDOFTQG-VSKRKVRLSA-N 2 0 344.543 4.035 20 0 EIADRP C[C@@H]1CC([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C[C@@H](C)C1 ZINC000341273667 1023494572 /nfs/dbraw/zinc/49/45/72/1023494572.db2.gz QHADYNZPLAPNIH-IRXDYDNUSA-N 2 0 330.516 4.074 20 0 EIADRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCC[N@H+](Cc3cccc(C4CCCC4)c3)C2)C1 ZINC000656786437 1023532915 /nfs/dbraw/zinc/53/29/15/1023532915.db2.gz MNUMTVRDIVJSBK-YPAWHYETSA-N 2 0 342.527 4.063 20 0 EIADRP Cc1cc(F)ncc1C[NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000892944746 1023551633 /nfs/dbraw/zinc/55/16/33/1023551633.db2.gz VHRHYEHISKWJSY-UHFFFAOYSA-N 2 0 341.474 4.051 20 0 EIADRP COc1cccc(-c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C)cc2)c1 ZINC000192904924 1023657491 /nfs/dbraw/zinc/65/74/91/1023657491.db2.gz DLXWLPXHQCKNHP-SEJPIABJSA-N 2 0 336.479 4.077 20 0 EIADRP CCn1cc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)cn1 ZINC000164182529 1023788099 /nfs/dbraw/zinc/78/80/99/1023788099.db2.gz MBLOGYRJZMOGBX-GOSISDBHSA-N 2 0 340.515 4.130 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1cncc(F)c1 ZINC000164187232 1023800506 /nfs/dbraw/zinc/80/05/06/1023800506.db2.gz XTHAUQXYVHOVJU-QGZVFWFLSA-N 2 0 341.474 4.448 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccc3c(c2)CCO3)c1 ZINC000178203008 1023831117 /nfs/dbraw/zinc/83/11/17/1023831117.db2.gz NRLMBDJFGDQOQO-QGZVFWFLSA-N 2 0 338.495 4.314 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2cc3cnccc3o2)C[N@@H+]1Cc1ccccc1 ZINC000651743246 1023964325 /nfs/dbraw/zinc/96/43/25/1023964325.db2.gz NHJUMPSJZARPAI-MJGOQNOKSA-N 2 0 349.478 4.218 20 0 EIADRP FC1(F)CC[C@H](C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000430750926 1024009622 /nfs/dbraw/zinc/00/96/22/1024009622.db2.gz QOJRTGZZCGJBAI-ZGXWSNOMSA-N 2 0 348.481 4.312 20 0 EIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CCC[NH+]1CCCC1 ZINC000510667446 1024201628 /nfs/dbraw/zinc/20/16/28/1024201628.db2.gz HFUQJEBGPVDCOV-HNNXBMFYSA-N 2 0 328.422 4.102 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000301216791 1033193505 /nfs/dbraw/zinc/19/35/05/1033193505.db2.gz ZGYBRBIMGYDIHW-UYAOXDASSA-N 2 0 338.495 4.258 20 0 EIADRP CC1CC[NH+](Cc2cccc(C[NH2+]Cc3cc4cnccc4o3)c2)CC1 ZINC000651705661 1024234401 /nfs/dbraw/zinc/23/44/01/1024234401.db2.gz AEPNLXSMCGSGLH-UHFFFAOYSA-N 2 0 349.478 4.350 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000510735629 1024370589 /nfs/dbraw/zinc/37/05/89/1024370589.db2.gz ONUHUSMTAVQWHW-ZTFGCOKTSA-N 2 0 340.433 4.243 20 0 EIADRP C[C@H](CCc1c(F)cccc1F)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000510752337 1024386036 /nfs/dbraw/zinc/38/60/36/1024386036.db2.gz JZZXIHFRTLMVLW-OAHLLOKOSA-N 2 0 332.438 4.137 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)cc1 ZINC000341761284 1024628753 /nfs/dbraw/zinc/62/87/53/1024628753.db2.gz QAAQUVIPZMKFCJ-LJQANCHMSA-N 2 0 344.886 4.405 20 0 EIADRP CCc1cnccc1[C@H](C)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548481312 1024825532 /nfs/dbraw/zinc/82/55/32/1024825532.db2.gz MWFKQSDJOWAXQU-WFXMLNOXSA-N 2 0 337.511 4.205 20 0 EIADRP CS[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(C)(C)C ZINC000548486107 1024835772 /nfs/dbraw/zinc/83/57/72/1024835772.db2.gz NUSRTGGYACPLJY-QXAKKESOSA-N 2 0 334.573 4.264 20 0 EIADRP CC[C@H](C)[C@H](C)[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000341980430 1025019691 /nfs/dbraw/zinc/01/96/91/1025019691.db2.gz QGAYTACBDVALBY-OALUTQOASA-N 2 0 332.532 4.082 20 0 EIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3ccnc4ccccc34)C2)CC1 ZINC000535826697 1025075700 /nfs/dbraw/zinc/07/57/00/1025075700.db2.gz SCZQCVQVWPAHFG-LJQANCHMSA-N 2 0 337.511 4.179 20 0 EIADRP CSc1ccccc1C[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663467334 1025399171 /nfs/dbraw/zinc/39/91/71/1025399171.db2.gz DWCAFYHQDXYNPX-SJLPKXTDSA-N 2 0 332.557 4.051 20 0 EIADRP COc1cc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)ccc1SC ZINC000663466989 1025401394 /nfs/dbraw/zinc/40/13/94/1025401394.db2.gz CIPIPSTWEQQFFB-WBVHZDCISA-N 2 0 348.556 4.190 20 0 EIADRP CCCC[NH+](CCCC)CCCNC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167965865 1025541827 /nfs/dbraw/zinc/54/18/27/1025541827.db2.gz OFCLLJBPJOVBDM-FRIKZZABSA-N 2 0 349.607 4.274 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@@H]1c1ccc(OC)c(OC)c1 ZINC001167825461 1025602221 /nfs/dbraw/zinc/60/22/21/1025602221.db2.gz JHQOVICCIUBRFH-IEBWSBKVSA-N 2 0 348.531 4.351 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)Cc1ccc(Br)cc1 ZINC001167826187 1025620873 /nfs/dbraw/zinc/62/08/73/1025620873.db2.gz OLHITYHCIJGRBZ-HNNXBMFYSA-N 2 0 341.337 4.391 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@H+]1C[C@H]2[C@@H](C1)CCC[C@H]2OCC1CC1 ZINC001167827664 1025665544 /nfs/dbraw/zinc/66/55/44/1025665544.db2.gz UNZHZGIPXRADAH-FYZZASKESA-N 2 0 336.564 4.024 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CC2(CC(OCc3ccccc3)C2)C1 ZINC001167836766 1025847273 /nfs/dbraw/zinc/84/72/73/1025847273.db2.gz GWAQOAAFKFSLET-IBGZPJMESA-N 2 0 344.543 4.178 20 0 EIADRP C[C@H](Cc1ccsc1)[NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000690063472 1025854329 /nfs/dbraw/zinc/85/43/29/1025854329.db2.gz ZFVOCVKHCDQZRF-XLIONFOSSA-N 2 0 328.525 4.181 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCOc3cc4c(cc32)CCC4)C1 ZINC000431333174 1025920811 /nfs/dbraw/zinc/92/08/11/1025920811.db2.gz MWJLVVBLPPQEQJ-UTKZUKDTSA-N 2 0 342.527 4.099 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)c1ccc(Oc2cccnc2)cc1 ZINC000344090899 1025996615 /nfs/dbraw/zinc/99/66/15/1025996615.db2.gz JPIJOTDWBMGIDZ-FUHWJXTLSA-N 2 0 325.456 4.009 20 0 EIADRP Fc1ccc2c(c1)[C@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CCC2 ZINC000344098250 1026002559 /nfs/dbraw/zinc/00/25/59/1026002559.db2.gz IXAXAIUKFBZBNO-OAQYLSRUSA-N 2 0 339.458 4.104 20 0 EIADRP C[C@@H]([NH2+]CCCN1CCCO[C@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000432447188 1026028553 /nfs/dbraw/zinc/02/85/53/1026028553.db2.gz OKURUDITGZEMKQ-ZIAGYGMSSA-N 2 0 345.314 4.145 20 0 EIADRP Fc1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C2CC2)cc1 ZINC001167969903 1026041542 /nfs/dbraw/zinc/04/15/42/1026041542.db2.gz HQFXFMPPASFWAZ-OTYNDTSQSA-N 2 0 328.475 4.272 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)CC1 ZINC000324684479 1026068398 /nfs/dbraw/zinc/06/83/98/1026068398.db2.gz KOKGGOQWNXHBRC-NRFANRHFSA-N 2 0 326.459 4.237 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cc(C)c(Br)s2)C1 ZINC000512130022 1026076679 /nfs/dbraw/zinc/07/66/79/1026076679.db2.gz MNMSTUIGANKHDT-QWHCGFSZSA-N 2 0 345.350 4.202 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCOc3c(C)cc(Cl)cc32)C1 ZINC000431347648 1026083421 /nfs/dbraw/zinc/08/34/21/1026083421.db2.gz GGIVQORIIKOZFS-CRAIPNDOSA-N 2 0 336.907 4.184 20 0 EIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3cccc4[nH]ccc43)C2)CC1 ZINC000512165857 1026192939 /nfs/dbraw/zinc/19/29/39/1026192939.db2.gz IBJLHYRGKYPQCJ-GOSISDBHSA-N 2 0 325.500 4.112 20 0 EIADRP C[C@H](c1ncc(-c2ccccc2)o1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000158057740 1026200513 /nfs/dbraw/zinc/20/05/13/1026200513.db2.gz JGKCGLLWVOUMNO-MRXNPFEDSA-N 2 0 327.472 4.066 20 0 EIADRP COc1cccc(CCC[N@@H+]2CCC[C@H](C[NH+]3CCCC[C@@H]3C)C2)c1 ZINC000303950946 1026296793 /nfs/dbraw/zinc/29/67/93/1026296793.db2.gz VRMRGZNYEFNSAA-FPOVZHCZSA-N 2 0 344.543 4.214 20 0 EIADRP CC(C)(Cc1cccc(F)c1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167977521 1026332641 /nfs/dbraw/zinc/33/26/41/1026332641.db2.gz DEKVHXXNPNFTAT-IHWFROFDSA-N 2 0 330.491 4.142 20 0 EIADRP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1cc(F)cc(F)c1 ZINC001167977903 1026341774 /nfs/dbraw/zinc/34/17/74/1026341774.db2.gz ITUTZYRVLDHYIX-RAFMOHDBSA-N 2 0 334.454 4.411 20 0 EIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]C1CCN([C@H](C)c2ccccc2)CC1 ZINC000511095820 1026389026 /nfs/dbraw/zinc/38/90/26/1026389026.db2.gz XHRJHKSRFHVXPO-QZTJIDSGSA-N 2 0 338.495 4.138 20 0 EIADRP Fc1ccc([C@@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167982805 1026399045 /nfs/dbraw/zinc/39/90/45/1026399045.db2.gz AVWUYKNQKXMVTO-JKWVGCSGSA-N 2 0 328.475 4.368 20 0 EIADRP FC(F)(F)c1cccc([C@@H]2CCC[N@H+](CCCn3ccnc3)C2)c1 ZINC000511105793 1026511369 /nfs/dbraw/zinc/51/13/69/1026511369.db2.gz KFKPLTIUCAMGEE-MRXNPFEDSA-N 2 0 337.389 4.172 20 0 EIADRP C[C@H](c1ccc(F)cc1)[N@@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000337504048 1026528042 /nfs/dbraw/zinc/52/80/42/1026528042.db2.gz XTUTVWVSKUSHCS-WBVHZDCISA-N 2 0 327.447 4.299 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000344727624 1026563300 /nfs/dbraw/zinc/56/33/00/1026563300.db2.gz TXNPLRQIFYMZTI-TZIWHRDSSA-N 2 0 344.543 4.226 20 0 EIADRP C[C@H]([NH2+]Cc1cc2ccncc2s1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000657430593 1026644753 /nfs/dbraw/zinc/64/47/53/1026644753.db2.gz RSQZTABUPRTFDR-HOCLYGCPSA-N 2 0 329.513 4.039 20 0 EIADRP CC(C)(C)OCCCC[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512293897 1026658378 /nfs/dbraw/zinc/65/83/78/1026658378.db2.gz NDFPYPUWRAAVBQ-JOCHJYFZSA-N 2 0 344.543 4.180 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2ccnc3ccccc32)CC1 ZINC000563361630 1026668090 /nfs/dbraw/zinc/66/80/90/1026668090.db2.gz NFENYKNYZVPLFB-LJQANCHMSA-N 2 0 337.511 4.289 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]CCCn3ccnc3C)cs2)cs1 ZINC000338007689 1026704475 /nfs/dbraw/zinc/70/44/75/1026704475.db2.gz AUMMIBFRGOHYJZ-GFCCVEGCSA-N 2 0 346.525 4.426 20 0 EIADRP c1cc(C[NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)n(-c2cc[nH+]cc2)n1 ZINC000657448443 1026743341 /nfs/dbraw/zinc/74/33/41/1026743341.db2.gz ZIYBFXYUBXVLHR-RTBURBONSA-N 2 0 332.451 4.083 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@@H]1C[C@@H](C(C)C)c2ccccc21 ZINC000582540451 1026767354 /nfs/dbraw/zinc/76/73/54/1026767354.db2.gz IGTKRZDRGMQTDZ-ZWWNWMABSA-N 2 0 337.511 4.426 20 0 EIADRP Fc1ccc2c(NC3CC[NH+](Cc4ccccc4)CC3)cc[nH+]c2c1 ZINC000500505249 1026808395 /nfs/dbraw/zinc/80/83/95/1026808395.db2.gz WTVZITOQJPGBSQ-UHFFFAOYSA-N 2 0 335.426 4.450 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)cc1OC ZINC000507479681 1026810168 /nfs/dbraw/zinc/81/01/68/1026810168.db2.gz ORTDBGMKBBDOKJ-QGZVFWFLSA-N 2 0 348.531 4.257 20 0 EIADRP FC1(F)CCC[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]23)C1 ZINC000507507630 1026820836 /nfs/dbraw/zinc/82/08/36/1026820836.db2.gz IOOLLBJQJRQTIL-YDZRNGNQSA-N 2 0 334.454 4.065 20 0 EIADRP Cc1nccn1CCC[N@@H+](C)[C@@H](C)c1ccccc1Br ZINC000342859628 1026854082 /nfs/dbraw/zinc/85/40/82/1026854082.db2.gz JXTKFOBPLPYJJA-ZDUSSCGKSA-N 2 0 336.277 4.037 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCCc3cccnc32)C1 ZINC000684953666 1026888903 /nfs/dbraw/zinc/88/89/03/1026888903.db2.gz QQSJSTXCMJWDET-XMSQKQJNSA-N 2 0 349.522 4.481 20 0 EIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2CCCc3cccnc32)c1 ZINC000684954157 1026889341 /nfs/dbraw/zinc/88/93/41/1026889341.db2.gz UQYZYRNEDYUHMS-OAQYLSRUSA-N 2 0 335.495 4.235 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCCc4cccnc43)CC2)CC1 ZINC000684960804 1026899673 /nfs/dbraw/zinc/89/96/73/1026899673.db2.gz TZUVSLFFRUUNSP-MHJFOBGBSA-N 2 0 327.516 4.092 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000519818975 1027013876 /nfs/dbraw/zinc/01/38/76/1027013876.db2.gz FSPUSGGCZZAEDC-RBQRDFNRSA-N 2 0 349.453 4.180 20 0 EIADRP C[NH+](C)Cc1ccc(CNc2cc[nH+]c3cc(F)ccc23)cc1F ZINC000301867323 1027120854 /nfs/dbraw/zinc/12/08/54/1027120854.db2.gz HOMZQKBAXVNJPP-UHFFFAOYSA-N 2 0 327.378 4.187 20 0 EIADRP Cc1cc(N2CCC(CCC[NH+](C)C)CC2)c2cc(F)ccc2[nH+]1 ZINC000301933567 1027154797 /nfs/dbraw/zinc/15/47/97/1027154797.db2.gz PTLXBKGNSJQYFN-UHFFFAOYSA-N 2 0 329.463 4.241 20 0 EIADRP Cc1cc2c(cn1)[C@H]([NH2+]C1C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C1)CC2 ZINC001168037447 1027253549 /nfs/dbraw/zinc/25/35/49/1027253549.db2.gz YNXQNUNCCVXXKE-IUKKYPGJSA-N 2 0 349.522 4.409 20 0 EIADRP Cc1ccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c(Cl)c1 ZINC000657613186 1027289550 /nfs/dbraw/zinc/28/95/50/1027289550.db2.gz HQCYCNVWVKWGSF-UHFFFAOYSA-N 2 0 343.902 4.045 20 0 EIADRP CS[C@@H]1CCCC[NH+](C[C@@H](C)C[N@H+]2CCCC[C@H](SC)C2)C1 ZINC000441136042 1027300435 /nfs/dbraw/zinc/30/04/35/1027300435.db2.gz UXTYYTNSAHFJQD-NNZMDNLPSA-N 2 0 344.634 4.058 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@H](C)[C@H](C)c2ccc(OC)c(OC)c2)CC1 ZINC000474614529 1027310345 /nfs/dbraw/zinc/31/03/45/1027310345.db2.gz WVNCGQDHBATZNY-DLBZAZTESA-N 2 0 348.531 4.050 20 0 EIADRP Cc1cc(NC[C@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)c(F)c2)cc[nH+]1 ZINC000302504979 1027324228 /nfs/dbraw/zinc/32/42/28/1027324228.db2.gz WBRVNHILBAMCQG-KDOFPFPSSA-N 2 0 333.838 4.287 20 0 EIADRP C[NH+]1CCC(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)s2)CC1 ZINC000520214381 1027328329 /nfs/dbraw/zinc/32/83/29/1027328329.db2.gz ZMJCMRUZLJCLQG-UHFFFAOYSA-N 2 0 334.916 4.500 20 0 EIADRP C[NH+]1CCC(C[NH2+]CCCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000474707995 1027426258 /nfs/dbraw/zinc/42/62/58/1027426258.db2.gz BCLJLPPDNIAIDA-UHFFFAOYSA-N 2 0 329.315 4.248 20 0 EIADRP CC1(C)CC([NH2+]Cc2cccc(OCC(F)(F)F)c2)CC(C)(C)[NH2+]1 ZINC000103341012 1027468574 /nfs/dbraw/zinc/46/85/74/1027468574.db2.gz TZEILHYTXUMQQT-UHFFFAOYSA-N 2 0 344.421 4.027 20 0 EIADRP C[C@H](c1ccc(OC(F)F)cc1)[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000441331243 1027468918 /nfs/dbraw/zinc/46/89/18/1027468918.db2.gz NMXPITKARPHRJM-ZBFHGGJFSA-N 2 0 326.431 4.155 20 0 EIADRP CC(C)C1=[NH+]CCc2ccc(N3C(C)(C)CC([NH3+])CC3(C)C)cc21 ZINC001167626409 1027482458 /nfs/dbraw/zinc/48/24/58/1027482458.db2.gz KHOYNDGPLVNHNH-UHFFFAOYSA-N 2 0 327.516 4.173 20 0 EIADRP Fc1ccc(C2=CC[C@H]([NH2+]C3CC([NH+]4CCCCC4)C3)CC2)cc1 ZINC000475574756 1027667808 /nfs/dbraw/zinc/66/78/08/1027667808.db2.gz XSZXXEXRBWFTQJ-MWXLCCTBSA-N 2 0 328.475 4.368 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1OC ZINC000474877574 1027724039 /nfs/dbraw/zinc/72/40/39/1027724039.db2.gz KKDCIOPJBOOVKF-HUUCEWRRSA-N 2 0 348.531 4.095 20 0 EIADRP Clc1ccc(CCCC[NH2+][C@@H]2CCn3ccnc3C2)cc1Cl ZINC000474922600 1027802680 /nfs/dbraw/zinc/80/26/80/1027802680.db2.gz GPVOGBSUYQKIRD-CQSZACIVSA-N 2 0 338.282 4.117 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CC[C@H](C)[NH+]2CCCCC2)cc1OC ZINC000474941549 1027811062 /nfs/dbraw/zinc/81/10/62/1027811062.db2.gz JLHHRLRTIZVMQR-RCCFBDPRSA-N 2 0 348.531 4.050 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc(-c4ccsc4)cc3)CC[C@@H]21 ZINC001167648117 1027841964 /nfs/dbraw/zinc/84/19/64/1027841964.db2.gz RIYKVYBVUJUIQP-ICSRJNTNSA-N 2 0 326.509 4.331 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000548786340 1027931847 /nfs/dbraw/zinc/93/18/47/1027931847.db2.gz KJQZTKGRJGTALY-KMPOOHAWSA-N 2 0 340.433 4.429 20 0 EIADRP CC[N@@H+](Cc1c[nH]c2ccccc12)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000443859400 1028010327 /nfs/dbraw/zinc/01/03/27/1028010327.db2.gz YHXCZPDTPQSCDV-UHFFFAOYSA-N 2 0 345.450 4.079 20 0 EIADRP c1ccc2c(c1)cccc2OCC[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000441453153 1028024673 /nfs/dbraw/zinc/02/46/73/1028024673.db2.gz XMLVHJLOAWDSNA-IBGZPJMESA-N 2 0 338.495 4.026 20 0 EIADRP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000150769371 1028048974 /nfs/dbraw/zinc/04/89/74/1028048974.db2.gz WKDZRVQOBNPRSP-LSDHHAIUSA-N 2 0 326.406 4.184 20 0 EIADRP Cc1ccc2cc(C[NH2+]CCCC[NH+]3CCC(C)CC3)ccc2n1 ZINC000189256504 1028113012 /nfs/dbraw/zinc/11/30/12/1028113012.db2.gz DYJSDJVIMHHPKD-UHFFFAOYSA-N 2 0 325.500 4.145 20 0 EIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000280934736 1028284013 /nfs/dbraw/zinc/28/40/13/1028284013.db2.gz SAHHWROHTDIUSV-CQSZACIVSA-N 2 0 340.433 4.243 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](Cc1cccc(F)c1)C(C)C ZINC000346187461 1028291857 /nfs/dbraw/zinc/29/18/57/1028291857.db2.gz WTXKXGPZAXAJJJ-UHFFFAOYSA-N 2 0 338.430 4.125 20 0 EIADRP CC[N@H+](CCc1cccs1)Cc1nc2c(s1)CN(C(C)C)CC2 ZINC000346165743 1028300751 /nfs/dbraw/zinc/30/07/51/1028300751.db2.gz FENGIZHYMVNKGR-UHFFFAOYSA-N 2 0 349.569 4.036 20 0 EIADRP FC(F)(F)c1ccc([C@H]2C[C@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)cc1 ZINC000280963621 1028311099 /nfs/dbraw/zinc/31/10/99/1028311099.db2.gz ZGTUYTMNSFGFMK-VDHUWJSZSA-N 2 0 338.417 4.168 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1CN1CC[C@H]1c1ccc(Cl)cc1 ZINC000346194040 1028317327 /nfs/dbraw/zinc/31/73/27/1028317327.db2.gz XOKNLNMVBZUERY-IBGZPJMESA-N 2 0 338.842 4.176 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C(C)(C)C)cc2)[C@@H](C)C1 ZINC000523733322 1028342045 /nfs/dbraw/zinc/34/20/45/1028342045.db2.gz VVRWNXYVOJKGRP-RXVVDRJESA-N 2 0 346.559 4.211 20 0 EIADRP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000281146186 1028396550 /nfs/dbraw/zinc/39/65/50/1028396550.db2.gz GFOUATQIQWMDSZ-CQSZACIVSA-N 2 0 340.433 4.243 20 0 EIADRP CC[NH+](CC)Cc1ccccc1CN[C@H](c1ncc[nH]1)c1ccccc1 ZINC000125618167 1028438467 /nfs/dbraw/zinc/43/84/67/1028438467.db2.gz CFIWQTBMCIADFZ-NRFANRHFSA-N 2 0 348.494 4.131 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](CC(C)C)c2ccncc2)c1 ZINC000647288186 1028587799 /nfs/dbraw/zinc/58/77/99/1028587799.db2.gz RBRFYLCQLKYGDR-NRFANRHFSA-N 2 0 325.500 4.410 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCC12CCOCC2 ZINC000548794488 1028697870 /nfs/dbraw/zinc/69/78/70/1028697870.db2.gz HYECITHUGVEMOS-NQIIRXRSSA-N 2 0 342.527 4.110 20 0 EIADRP CC[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1ccc(OC)c(OC)c1 ZINC000346860194 1028796587 /nfs/dbraw/zinc/79/65/87/1028796587.db2.gz JASNXCIVUBDZEX-FUHWJXTLSA-N 2 0 334.504 4.009 20 0 EIADRP Clc1ccc([C@H]2C[C@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)cc1Cl ZINC000281644671 1028822277 /nfs/dbraw/zinc/82/22/77/1028822277.db2.gz PEJBTUTTXLYPJY-KLHDSHLOSA-N 2 0 339.310 4.456 20 0 EIADRP CC[N@H+](CCCN[C@@H]1CC[NH2+][C@@H](c2ccccc2)C1)C1CCCCC1 ZINC000650710351 1028847012 /nfs/dbraw/zinc/84/70/12/1028847012.db2.gz NFVCRNSBMKOVGK-IFMALSPDSA-N 2 0 343.559 4.114 20 0 EIADRP CCCCCOc1ccc(C[NH2+]Cc2ccc(C[NH3+])cc2F)cc1 ZINC000650718237 1028875646 /nfs/dbraw/zinc/87/56/46/1028875646.db2.gz DLRFZXFWZKZLAK-UHFFFAOYSA-N 2 0 330.447 4.143 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1cc(C(F)(F)F)ccc1Cl ZINC000650719277 1028881451 /nfs/dbraw/zinc/88/14/51/1028881451.db2.gz KCBMRIXZKSBWKW-UHFFFAOYSA-N 2 0 342.792 4.368 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2sc(-c3ccccc3)nc2C)C1 ZINC000163286709 1028956334 /nfs/dbraw/zinc/95/63/34/1028956334.db2.gz KPILKJDLKVOZQB-HOCLYGCPSA-N 2 0 329.513 4.111 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cccc(C(F)(F)F)c1 ZINC000650751870 1029145113 /nfs/dbraw/zinc/14/51/13/1029145113.db2.gz CZZGDUJZXANGRZ-NSHDSACASA-N 2 0 326.337 4.154 20 0 EIADRP CCN(CC)[C@@H](C[NH2+]C1CCC2(CCCO2)CC1)c1ccccc1 ZINC000583787244 1029173642 /nfs/dbraw/zinc/17/36/42/1029173642.db2.gz TYMAOUZAUWGHED-KBWCOIMZSA-N 2 0 330.516 4.151 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCCOc2cc(Cl)ccc21 ZINC000650756427 1029191821 /nfs/dbraw/zinc/19/18/21/1029191821.db2.gz ABRLSFGMVLRGRF-GOSISDBHSA-N 2 0 330.859 4.063 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CCCc2c(C)cccc21 ZINC000657796322 1029201391 /nfs/dbraw/zinc/20/13/91/1029201391.db2.gz FHDOITCJIOBKOC-OAQYLSRUSA-N 2 0 332.451 4.051 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@H+](C)C[C@H]1CCC[NH2+]C1 ZINC000469980249 1029205107 /nfs/dbraw/zinc/20/51/07/1029205107.db2.gz DVHXQSPCKUADKV-HOTGVXAUSA-N 2 0 329.513 4.111 20 0 EIADRP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ccccc1C[NH2+]C ZINC000650758056 1029218728 /nfs/dbraw/zinc/21/87/28/1029218728.db2.gz HSMSZPQJYFQZHT-AWEZNQCLSA-N 2 0 332.875 4.309 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2-n2ccnc2)C1 ZINC000343438857 1029244051 /nfs/dbraw/zinc/24/40/51/1029244051.db2.gz GHIFJXDIWAHEHO-UYAOXDASSA-N 2 0 346.478 4.392 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CCC1CC[NH2+]CC1 ZINC000650763020 1029270880 /nfs/dbraw/zinc/27/08/80/1029270880.db2.gz OZFBGTYMDXGHHT-INIZCTEOSA-N 2 0 327.516 4.203 20 0 EIADRP Fc1ccc(C([NH2+]CCC2CC[NH2+]CC2)c2ccc(F)cc2)cc1 ZINC000650763369 1029272483 /nfs/dbraw/zinc/27/24/83/1029272483.db2.gz YPRWWFONRDGDJL-UHFFFAOYSA-N 2 0 330.422 4.034 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CCC1CC[NH2+]CC1 ZINC000650763955 1029276693 /nfs/dbraw/zinc/27/66/93/1029276693.db2.gz MWHIVTOBDONVNG-ZDUSSCGKSA-N 2 0 347.503 4.298 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccc(F)cc1 ZINC000532480467 1029289531 /nfs/dbraw/zinc/28/95/31/1029289531.db2.gz XMIIPMXKCAJVIN-IRXDYDNUSA-N 2 0 344.474 4.220 20 0 EIADRP COC1CCC(C)(C[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)CC1 ZINC000475211957 1029445069 /nfs/dbraw/zinc/44/50/69/1029445069.db2.gz CPAWARYNNYWMPT-IDGBJLRDSA-N 2 0 336.564 4.214 20 0 EIADRP C[C@H](C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000475225689 1029448451 /nfs/dbraw/zinc/44/84/51/1029448451.db2.gz UKSZVOXBXAGXMW-IEBWSBKVSA-N 2 0 326.459 4.041 20 0 EIADRP CSC1(C[NH2+][C@H](C)c2cccc3ccccc32)CC[NH+](C)CC1 ZINC000583987275 1029464339 /nfs/dbraw/zinc/46/43/39/1029464339.db2.gz KDWOYKAAYASYCY-MRXNPFEDSA-N 2 0 328.525 4.318 20 0 EIADRP C[C@@H]1CC([N@@H+]2CCC[C@H](C(F)F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168064288 1029625585 /nfs/dbraw/zinc/62/55/85/1029625585.db2.gz PSUSMUZAAHPBMS-NUJGCVRESA-N 2 0 336.470 4.405 20 0 EIADRP Fc1ccc(C2=CC[C@@H]([NH2+]CC3CC[NH+](C4CC4)CC3)CC2)cc1 ZINC000446887305 1029631736 /nfs/dbraw/zinc/63/17/36/1029631736.db2.gz QYLDJAXCCDCVNZ-HXUWFJFHSA-N 2 0 328.475 4.226 20 0 EIADRP CC[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000657834020 1029667785 /nfs/dbraw/zinc/66/77/85/1029667785.db2.gz IDFGTPBPGJVEKP-RDJZCZTQSA-N 2 0 340.433 4.100 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]C1CC(CF)(CF)C1 ZINC000657838423 1029717788 /nfs/dbraw/zinc/71/77/88/1029717788.db2.gz SYEWLHLVSLTVPF-MRXNPFEDSA-N 2 0 336.470 4.238 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657839226 1029740768 /nfs/dbraw/zinc/74/07/68/1029740768.db2.gz PLEIZMJYRLJVNW-XHSDSOJGSA-N 2 0 339.474 4.428 20 0 EIADRP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000657840122 1029756208 /nfs/dbraw/zinc/75/62/08/1029756208.db2.gz MGTNJZLLVVUNOZ-KURKYZTESA-N 2 0 340.433 4.243 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(F)c(Br)c1 ZINC000584365103 1029766998 /nfs/dbraw/zinc/76/69/98/1029766998.db2.gz GPCKLESISZXWSR-LMWSTFAQSA-N 2 0 343.284 4.112 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(Cl)s1 ZINC000708528738 1029813392 /nfs/dbraw/zinc/81/33/92/1029813392.db2.gz IGKGJNJDPDFCDV-GDBMZVCRSA-N 2 0 334.916 4.259 20 0 EIADRP C[C@H]([NH2+][C@H]1CCc2ccc(F)cc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000089552505 1029854898 /nfs/dbraw/zinc/85/48/98/1029854898.db2.gz BKFSJGVMIRCNBW-BTYIYWSLSA-N 2 0 342.458 4.104 20 0 EIADRP CCOc1ccccc1CC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000089551114 1029855053 /nfs/dbraw/zinc/85/50/53/1029855053.db2.gz GIGOTVIFJMNVID-UHFFFAOYSA-N 2 0 330.516 4.015 20 0 EIADRP Cc1c(F)cccc1-c1ccc(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)o1 ZINC000092071838 1029899184 /nfs/dbraw/zinc/89/91/84/1029899184.db2.gz WRPQTTZCAISSLK-HNNXBMFYSA-N 2 0 339.414 4.497 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2sc(C)nc2C)cc1 ZINC000170972845 1029970994 /nfs/dbraw/zinc/97/09/94/1029970994.db2.gz UNZQUHZEPVHARJ-AWEZNQCLSA-N 2 0 331.529 4.453 20 0 EIADRP C[C@H](Cc1ccc(Cl)cc1)[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC001168155799 1030002016 /nfs/dbraw/zinc/00/20/16/1030002016.db2.gz HCOYOLSEKDFDAW-MRXNPFEDSA-N 2 0 346.902 4.001 20 0 EIADRP C[C@H](c1ccccc1Br)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000138374989 1030041795 /nfs/dbraw/zinc/04/17/95/1030041795.db2.gz HMPTYAZUMMFDQL-CQSZACIVSA-N 2 0 339.321 4.174 20 0 EIADRP C[C@H](C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1)c1cccc(Cl)c1 ZINC000525874925 1030090764 /nfs/dbraw/zinc/09/07/64/1030090764.db2.gz RSMXODSGCRGHPK-MDYRTPRTSA-N 2 0 332.919 4.392 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(OC(F)F)cc1 ZINC000447569469 1030153365 /nfs/dbraw/zinc/15/33/65/1030153365.db2.gz PJAAPKLXGUJQJL-GOSISDBHSA-N 2 0 338.442 4.203 20 0 EIADRP FC(F)c1ccc(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000525985507 1030171949 /nfs/dbraw/zinc/17/19/49/1030171949.db2.gz WVFGMOFIUXKSAD-LJQANCHMSA-N 2 0 344.449 4.278 20 0 EIADRP C[C@H](c1ccc(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cc1)C(F)(F)F ZINC000451066190 1030219490 /nfs/dbraw/zinc/21/94/90/1030219490.db2.gz BTWDZOIDUNLJKO-CRAIPNDOSA-N 2 0 340.433 4.270 20 0 EIADRP C[C@@H](C[NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccccc1 ZINC000447822795 1030345224 /nfs/dbraw/zinc/34/52/24/1030345224.db2.gz RMUOWKREZQNQLU-KRWDZBQOSA-N 2 0 328.525 4.353 20 0 EIADRP C[C@H]([NH2+]CCc1cncn1C)c1ccc(-c2ccccc2F)s1 ZINC000530407359 1030377775 /nfs/dbraw/zinc/37/77/75/1030377775.db2.gz SJBSNLNYMMUZMF-ZDUSSCGKSA-N 2 0 329.444 4.181 20 0 EIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+][C@@H]1CCCSCC1 ZINC000657907120 1030455825 /nfs/dbraw/zinc/45/58/25/1030455825.db2.gz GTJZGQOJIRYUSN-ZHALLVOQSA-N 2 0 332.557 4.018 20 0 EIADRP C[C@@H](CCSc1ccccc1)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000431607619 1030473803 /nfs/dbraw/zinc/47/38/03/1030473803.db2.gz IIYDPFJVKASULJ-HKUYNNGSSA-N 2 0 332.557 4.221 20 0 EIADRP C[C@H](CCSc1ccccc1)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000431607621 1030473954 /nfs/dbraw/zinc/47/39/54/1030473954.db2.gz IIYDPFJVKASULJ-MJGOQNOKSA-N 2 0 332.557 4.221 20 0 EIADRP CC(C)Oc1ccccc1[C@H](C)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000392620155 1030636722 /nfs/dbraw/zinc/63/67/22/1030636722.db2.gz BZCKLEWTUOXZJE-KRWDZBQOSA-N 2 0 339.483 4.188 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(C(F)F)nc1 ZINC000657999297 1030768759 /nfs/dbraw/zinc/76/87/59/1030768759.db2.gz TXCYQKJMBFALSV-WBVHZDCISA-N 2 0 345.437 4.192 20 0 EIADRP CC(C)CC[C@H]1CCC[C@H]1[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658066590 1030812032 /nfs/dbraw/zinc/81/20/32/1030812032.db2.gz CCHCYMFHMSNLIH-TZIWHRDSSA-N 2 0 336.564 4.072 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@H]21)c1ccccn1 ZINC000658066532 1030813835 /nfs/dbraw/zinc/81/38/35/1030813835.db2.gz MJXQFIANKRHLSJ-IYSOMAHNSA-N 2 0 349.522 4.218 20 0 EIADRP Clc1ccc2c(c1)C[C@@H]1[C@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)[C@H]21 ZINC000527751439 1030843070 /nfs/dbraw/zinc/84/30/70/1030843070.db2.gz YBSMDJPBJNAFKS-HBMCJLEFSA-N 2 0 344.930 4.365 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1csc(Cl)c1 ZINC000658163725 1030860210 /nfs/dbraw/zinc/86/02/10/1030860210.db2.gz AJGNYBJPBNBYFW-AWEZNQCLSA-N 2 0 349.931 4.359 20 0 EIADRP CC(C)[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccc1 ZINC000658164170 1030860932 /nfs/dbraw/zinc/86/09/32/1030860932.db2.gz CCSBDZRZDRYKNW-JOCHJYFZSA-N 2 0 337.511 4.281 20 0 EIADRP c1cc2c(s1)CCC[C@@H]2[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658165366 1030863161 /nfs/dbraw/zinc/86/31/61/1030863161.db2.gz IUTGHUKTDAYJPJ-IBGZPJMESA-N 2 0 341.524 4.022 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)[C@H](C)c1ccccc1 ZINC000658168735 1030863634 /nfs/dbraw/zinc/86/36/34/1030863634.db2.gz YDWAEYOPHZOHAT-RBUKOAKNSA-N 2 0 337.511 4.075 20 0 EIADRP Cc1cc(C)cc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000658168805 1030863893 /nfs/dbraw/zinc/86/38/93/1030863893.db2.gz ZELSEUJFOBSYHK-IBGZPJMESA-N 2 0 337.511 4.261 20 0 EIADRP C[C@H](c1ccccc1)[C@H](C)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658168734 1030864710 /nfs/dbraw/zinc/86/47/10/1030864710.db2.gz YDWAEYOPHZOHAT-OALUTQOASA-N 2 0 337.511 4.075 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cccnc1 ZINC000658320510 1030985663 /nfs/dbraw/zinc/98/56/63/1030985663.db2.gz YWLGNKGGFLMZFN-WIYYLYMNSA-N 2 0 335.495 4.035 20 0 EIADRP COCCC[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccc(F)cc1 ZINC000658352103 1031020155 /nfs/dbraw/zinc/02/01/55/1031020155.db2.gz DAJFFWXPJPFBHN-NRFANRHFSA-N 2 0 348.506 4.005 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2ccsc2S1 ZINC000658357962 1031023700 /nfs/dbraw/zinc/02/37/00/1031023700.db2.gz WKGAINPULDTCLZ-GUYCJALGSA-N 2 0 336.570 4.385 20 0 EIADRP C[C@@H](c1ccccc1)N1CCC([NH2+][C@@H]2CCc3cccnc3CC2)CC1 ZINC000421830392 1031036441 /nfs/dbraw/zinc/03/64/41/1031036441.db2.gz JUUDDVRAZPSZLW-GHTZIAJQSA-N 2 0 349.522 4.144 20 0 EIADRP C[C@H]([NH2+]CCO[C@@H]1CCCC[C@H]1C)c1ccc(-n2ccnc2)cc1 ZINC000532448164 1031075357 /nfs/dbraw/zinc/07/53/57/1031075357.db2.gz SJQNLCLADFSNJH-FUHIMQAGSA-N 2 0 327.472 4.118 20 0 EIADRP CC(C)C[NH+]1CCC(N[C@H](C)c2ccccc2OC(F)(F)F)CC1 ZINC000532451944 1031084662 /nfs/dbraw/zinc/08/46/62/1031084662.db2.gz KECAHKFBKUZKGV-CQSZACIVSA-N 2 0 344.421 4.356 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](CC)CC1)c1cccc(Br)c1 ZINC000044517803 1031111378 /nfs/dbraw/zinc/11/13/78/1031111378.db2.gz UKGUKDYLFKQKFC-QGZVFWFLSA-N 2 0 339.321 4.222 20 0 EIADRP CN1CC[C@H]([NH2+]Cc2cccc3cccnc32)C[C@@H]1c1ccccc1 ZINC000340213235 1031191027 /nfs/dbraw/zinc/19/10/27/1031191027.db2.gz VDTBZFZNZFNWFT-LEWJYISDSA-N 2 0 331.463 4.160 20 0 EIADRP CCC(CC)(CN[C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C)[NH2+][C@@H](C)c1ccccc1 ZINC000532517025 1031247669 /nfs/dbraw/zinc/24/76/69/1031247669.db2.gz MAWIRKASXQLFEJ-XODKDNOYSA-N 2 0 345.575 4.214 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cc3cccnc3o2)CC1 ZINC000449038147 1031378215 /nfs/dbraw/zinc/37/82/15/1031378215.db2.gz RXBITQALKOWGSL-KRWDZBQOSA-N 2 0 341.499 4.304 20 0 EIADRP CC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCOC4(CCC4)C3)cc2)CC1 ZINC000449073223 1031425342 /nfs/dbraw/zinc/42/53/42/1031425342.db2.gz RRTWOZOUYWJPNF-NRFANRHFSA-N 2 0 342.527 4.110 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000532626173 1031441054 /nfs/dbraw/zinc/44/10/54/1031441054.db2.gz MCVBXDINYMBSLK-SJORKVTESA-N 2 0 343.540 4.350 20 0 EIADRP Cc1noc(C)c1CC[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449127959 1031463892 /nfs/dbraw/zinc/46/38/92/1031463892.db2.gz RAUXAMCAWOFZCD-UHFFFAOYSA-N 2 0 335.536 4.103 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H]2CCCOc3ccc(Cl)cc32)c1 ZINC000123594011 1031473740 /nfs/dbraw/zinc/47/37/40/1031473740.db2.gz NGWMBAWUGBVZKD-IBGZPJMESA-N 2 0 344.886 4.405 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@@H]2CSCCc3ccccc32)C1 ZINC000531681413 1031474531 /nfs/dbraw/zinc/47/45/31/1031474531.db2.gz VHWIFIOIVVOQKZ-FXAWDEMLSA-N 2 0 332.557 4.119 20 0 EIADRP c1ccc(C[NH+]2CCCCCC2)c(C[NH2+][C@@H]2CCOC3(CCC3)C2)c1 ZINC000449140222 1031475271 /nfs/dbraw/zinc/47/52/71/1031475271.db2.gz IIQVLFOKVJIZBE-OAQYLSRUSA-N 2 0 342.527 4.254 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)c1cccc(OC)c1 ZINC000123910662 1031491636 /nfs/dbraw/zinc/49/16/36/1031491636.db2.gz YNSPASMOJZOVDZ-NRFANRHFSA-N 2 0 326.484 4.388 20 0 EIADRP CCC1(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CCOCC1 ZINC000449170040 1031491826 /nfs/dbraw/zinc/49/18/26/1031491826.db2.gz FISKOKHBOIPBAL-UHFFFAOYSA-N 2 0 338.580 4.462 20 0 EIADRP CC[C@H](C[C@H](C)CO)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449172912 1031494926 /nfs/dbraw/zinc/49/49/26/1031494926.db2.gz KGIFPHQPSITMEM-DLBZAZTESA-N 2 0 326.569 4.052 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CC2(CCO)CCCC2)CC1 ZINC000449177777 1031517526 /nfs/dbraw/zinc/51/75/26/1031517526.db2.gz TWGJQZWMUGMJNR-UHFFFAOYSA-N 2 0 338.580 4.198 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)O[C@H](C)C3)cc2)o1 ZINC000124650211 1031543901 /nfs/dbraw/zinc/54/39/01/1031543901.db2.gz KWLNYRNDEJJFQJ-KURKYZTESA-N 2 0 342.483 4.048 20 0 EIADRP CC[C@H](CC(F)(F)F)[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449243599 1031578656 /nfs/dbraw/zinc/57/86/56/1031578656.db2.gz LXNFBYZYFBMLNE-NVXWUHKLSA-N 2 0 342.449 4.403 20 0 EIADRP CC(C)[N@H+](C)CCCN[C@@H](C)c1ccc(Oc2ccccc2)cn1 ZINC000453088991 1031579601 /nfs/dbraw/zinc/57/96/01/1031579601.db2.gz ZSIXXJVXYLWSAB-KRWDZBQOSA-N 2 0 327.472 4.255 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCO[C@H](C3CC3)C2)CC1 ZINC000449247437 1031584062 /nfs/dbraw/zinc/58/40/62/1031584062.db2.gz GFEXEYBFHUKCII-OALUTQOASA-N 2 0 336.564 4.213 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC2(C(F)(F)F)CC2)CC1 ZINC000449318372 1031633042 /nfs/dbraw/zinc/63/30/42/1031633042.db2.gz CUCFFHRRCXUTLS-OAHLLOKOSA-N 2 0 340.433 4.014 20 0 EIADRP Cc1cc([C@H](C)[NH2+]C2CCN([C@H](C)c3ccncc3)CC2)cs1 ZINC000453176534 1031650140 /nfs/dbraw/zinc/65/01/40/1031650140.db2.gz RCVJAULUTVYPEU-JKSUJKDBSA-N 2 0 329.513 4.328 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]C2CCN([C@H](C)c3ccncc3)CC2)cs1 ZINC000453176533 1031650210 /nfs/dbraw/zinc/65/02/10/1031650210.db2.gz RCVJAULUTVYPEU-HZPDHXFCSA-N 2 0 329.513 4.328 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)c2sccc21 ZINC000453162596 1031665059 /nfs/dbraw/zinc/66/50/59/1031665059.db2.gz PBWLPFYIQKBPFZ-FDPIWHGQSA-N 2 0 348.556 4.044 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H]([NH2+]CCCc3ccccn3)[C@@H]3CCC[C@@H]32)cc1 ZINC000453163299 1031665321 /nfs/dbraw/zinc/66/53/21/1031665321.db2.gz PXXDVVCJCTYYCO-VABKMULXSA-N 2 0 349.522 4.047 20 0 EIADRP COc1ccc([C@H]2CCCC[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1F ZINC000453359685 1031889406 /nfs/dbraw/zinc/88/94/06/1031889406.db2.gz QFNHWAAPNACHMS-CMOVJTKZSA-N 2 0 346.490 4.075 20 0 EIADRP Cc1cc(C)c(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cn1 ZINC000453383512 1031892430 /nfs/dbraw/zinc/89/24/30/1031892430.db2.gz YZTUHIAUNIZJLO-UHFFFAOYSA-N 2 0 337.511 4.231 20 0 EIADRP CCN(c1ccccc1)c1ccc(C[NH2+][C@@H]2CC[N@H+](C)C[C@H]2C)cc1 ZINC000531980184 1031929317 /nfs/dbraw/zinc/92/93/17/1031929317.db2.gz AOEPSNZGRMTPHM-XMSQKQJNSA-N 2 0 337.511 4.274 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]C[C@@H]2CCOC(C)(C)C2)cc1 ZINC000453417281 1031951313 /nfs/dbraw/zinc/95/13/13/1031951313.db2.gz KCOWSAHJEAKWAT-NVXWUHKLSA-N 2 0 327.472 4.037 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@@H](Cc1ccccc1)c1ccccc1 ZINC000531993768 1031960695 /nfs/dbraw/zinc/96/06/95/1031960695.db2.gz LEIBZYUZJOKJCW-DAVBRLECSA-N 2 0 336.523 4.331 20 0 EIADRP Cc1nc(CN2CCC(C[NH2+]C[C@@H]3C(C)=CCC[C@@H]3C)CC2)oc1C ZINC000134186683 1031993447 /nfs/dbraw/zinc/99/34/47/1031993447.db2.gz RDOAYLQZCNPGCZ-OXJNMPFZSA-N 2 0 345.531 4.085 20 0 EIADRP CC(C)(C)c1cccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC001168264686 1032026039 /nfs/dbraw/zinc/02/60/39/1032026039.db2.gz LTKYTYDHUCOSQM-RXVVDRJESA-N 2 0 326.528 4.433 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1ccns1 ZINC000924862644 1033448355 /nfs/dbraw/zinc/44/83/55/1033448355.db2.gz XBWOZOKSGPZZKS-MRXNPFEDSA-N 2 0 329.513 4.370 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000261722893 1034080873 /nfs/dbraw/zinc/08/08/73/1034080873.db2.gz LYXUBZKTVBOUGR-DYVFJYSZSA-N 2 0 326.406 4.230 20 0 EIADRP c1ccc2c(c1)CCS[C@@H]2C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000513042565 1034350521 /nfs/dbraw/zinc/35/05/21/1034350521.db2.gz RVXPAVUEJNHBAU-OAQYLSRUSA-N 2 0 344.568 4.404 20 0 EIADRP Clc1ccc([C@H]2C[C@H]([NH2+][C@@H]3CC[C@H]4C[NH2+]C[C@H]4C3)C2)cc1Cl ZINC000647796725 1034621229 /nfs/dbraw/zinc/62/12/29/1034621229.db2.gz LDSJANMPIDPYBL-RBZJEDDUSA-N 2 0 339.310 4.217 20 0 EIADRP Cc1ccc(C[NH+]2CCC3(CC2)CC[NH+]([C@@H]2C[C@H]4C[C@H]4C2)CC3)cc1 ZINC001167933129 1034695952 /nfs/dbraw/zinc/69/59/52/1034695952.db2.gz BBVBSJIFAISAGB-KOUNCHBCSA-N 2 0 338.539 4.472 20 0 EIADRP Clc1ccc(CC[N@@H+]2CCCC3(CC[NH2+]CC3)C2)c(Cl)c1 ZINC001204727664 1034716594 /nfs/dbraw/zinc/71/65/94/1034716594.db2.gz IVDBXWHJPASBSO-UHFFFAOYSA-N 2 0 327.299 4.002 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000333347530 1034816782 /nfs/dbraw/zinc/81/67/82/1034816782.db2.gz ZPKMZMYIDKMKLB-PMPSAXMXSA-N 2 0 327.497 4.047 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000333347528 1034817138 /nfs/dbraw/zinc/81/71/38/1034817138.db2.gz ZPKMZMYIDKMKLB-OAGGEKHMSA-N 2 0 327.497 4.047 20 0 EIADRP Cc1nc(C)c(C[NH2+]CC[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)s1 ZINC000513493701 1034985226 /nfs/dbraw/zinc/98/52/26/1034985226.db2.gz CDCMRPVIUGMDNV-HNAYVOBHSA-N 2 0 343.540 4.150 20 0 EIADRP C[N@H+](CCC[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1)C1CCCCC1 ZINC000501379490 1035436583 /nfs/dbraw/zinc/43/65/83/1035436583.db2.gz BBZVFUPJFKATMS-AZUAARDMSA-N 2 0 329.532 4.352 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000501423739 1035443369 /nfs/dbraw/zinc/44/33/69/1035443369.db2.gz OJDHFAZUHJSFJS-SFKKXYGYSA-N 2 0 340.433 4.430 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]CCC[NH+]1CCCC1 ZINC000501476051 1035452705 /nfs/dbraw/zinc/45/27/05/1035452705.db2.gz USKNBQXDSXDTGZ-SQFISAMPSA-N 2 0 326.406 4.184 20 0 EIADRP FC(F)(F)c1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000261818053 1035483006 /nfs/dbraw/zinc/48/30/06/1035483006.db2.gz WIZAOJBFLINDQT-IXDOHACOSA-N 2 0 326.406 4.106 20 0 EIADRP Cc1nc([C@H](C)[NH+]2CCC(C[NH3+])CC2)oc1-c1ccc(Cl)cc1 ZINC000420267160 1035490302 /nfs/dbraw/zinc/49/03/02/1035490302.db2.gz FAZMEKIJVCGOEA-ZDUSSCGKSA-N 2 0 333.863 4.035 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[N@H+](C)CC[C@H]2CC[NH2+]C2)cc1 ZINC000420294552 1035492892 /nfs/dbraw/zinc/49/28/92/1035492892.db2.gz BBEGUNNBGNMCFG-QZTJIDSGSA-N 2 0 338.495 4.355 20 0 EIADRP Cc1nc([C@H](C)[NH+]2CCC([C@H](C)[NH3+])CC2)oc1-c1ccc(Cl)cc1 ZINC000420281965 1035496994 /nfs/dbraw/zinc/49/69/94/1035496994.db2.gz AUTLEKLMWYDFRQ-JSGCOSHPSA-N 2 0 347.890 4.424 20 0 EIADRP [NH3+]C[C@@H]1C[N@@H+]([C@H]2CCc3c2cccc3Cl)C[C@H]1c1ccccc1 ZINC000420315844 1035511158 /nfs/dbraw/zinc/51/11/58/1035511158.db2.gz MVQOMNXGDPLRQU-BPAFIMBUSA-N 2 0 326.871 4.002 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[N@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000420326863 1035529949 /nfs/dbraw/zinc/52/99/49/1035529949.db2.gz XSWMONHUSDQKKZ-IRXDYDNUSA-N 2 0 343.540 4.419 20 0 EIADRP CC[C@H](c1ccc(Cl)cc1)[NH+]1CCC([C@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000420374526 1035543682 /nfs/dbraw/zinc/54/36/82/1035543682.db2.gz HLEMUUBLFXBLHT-IPMKNSEASA-N 2 0 336.907 4.009 20 0 EIADRP CSCC1(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000595065891 1035545210 /nfs/dbraw/zinc/54/52/10/1035545210.db2.gz FWBZSBOXOLZYKV-ACDBMABISA-N 2 0 344.568 4.305 20 0 EIADRP CC(C)c1ccc([C@H](C)[NH+]2CCC([C@H]3C[C@@H]([NH3+])CCO3)CC2)cc1 ZINC000420388976 1035565455 /nfs/dbraw/zinc/56/54/55/1035565455.db2.gz LUDVXPYYDYPUPK-ORYQWCPZSA-N 2 0 330.516 4.089 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccccc2Br)CC1 ZINC000501775602 1035582941 /nfs/dbraw/zinc/58/29/41/1035582941.db2.gz LZQOYEGGALTIFR-UHFFFAOYSA-N 2 0 339.321 4.003 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2sccc2Br)CC1 ZINC000501795612 1035612639 /nfs/dbraw/zinc/61/26/39/1035612639.db2.gz ONAKXPVIKPLRBD-UHFFFAOYSA-N 2 0 345.350 4.064 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]CC2)c1cccc(Cl)c1Cl ZINC000574994742 1035649303 /nfs/dbraw/zinc/64/93/03/1035649303.db2.gz IOWNIWAZDBBUGZ-GFCCVEGCSA-N 2 0 335.278 4.490 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H](c2cccc(F)c2)c2cccc(Cl)c2)CC1 ZINC000491002460 1035752328 /nfs/dbraw/zinc/75/23/28/1035752328.db2.gz BSFZDWRFXWXIPE-HXUWFJFHSA-N 2 0 346.877 4.500 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H](C)c2nc(-c3ccccc3)cs2)CC1 ZINC000571138024 1035970406 /nfs/dbraw/zinc/97/04/06/1035970406.db2.gz UBAWAPFWNRZONH-OAHLLOKOSA-N 2 0 329.513 4.193 20 0 EIADRP C[C@@H](COc1ccc(Cl)c(Cl)c1)[NH2+]CCCCn1ccnc1 ZINC000571254430 1036011745 /nfs/dbraw/zinc/01/17/45/1036011745.db2.gz JQIJAQDCWISIRX-ZDUSSCGKSA-N 2 0 342.270 4.027 20 0 EIADRP CC(C)[NH+]1CCC([NH2+]CC2(c3ccc(F)cc3F)CCCC2)CC1 ZINC000485699369 1036194930 /nfs/dbraw/zinc/19/49/30/1036194930.db2.gz HHDXVMQXAKLWFK-UHFFFAOYSA-N 2 0 336.470 4.239 20 0 EIADRP COc1ccc(C2CCC([NH2+]C[C@H]3CC[N@@H+](C(C)C)C3)CC2)cc1 ZINC000571807296 1036260304 /nfs/dbraw/zinc/26/03/04/1036260304.db2.gz XWHHSHZXOHLBSZ-PGYGNJIDSA-N 2 0 330.516 4.041 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000421370500 1036319553 /nfs/dbraw/zinc/31/95/53/1036319553.db2.gz JMMFWIVOXCGSLN-UHFFFAOYSA-N 2 0 334.813 4.321 20 0 EIADRP C[C@H]1CN(C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000572526520 1036784893 /nfs/dbraw/zinc/78/48/93/1036784893.db2.gz HHOKKCMPDOCUNR-KSSFIOAISA-N 2 0 332.488 4.326 20 0 EIADRP C[C@H]1CN(C)CC[C@H]1[N@H+](C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000572526515 1036785571 /nfs/dbraw/zinc/78/55/71/1036785571.db2.gz HHOKKCMPDOCUNR-KBXCAEBGSA-N 2 0 332.488 4.326 20 0 EIADRP CC[N@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)CC1(SC)CCC1 ZINC000589503844 1036804531 /nfs/dbraw/zinc/80/45/31/1036804531.db2.gz YBSNPHSYFPEUOM-LJQANCHMSA-N 2 0 332.557 4.116 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Cl)ccc1OC(F)F ZINC000421884980 1036832961 /nfs/dbraw/zinc/83/29/61/1036832961.db2.gz UNHSOIIPOXOBCV-XGNXJENSSA-N 2 0 346.849 4.465 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1[nH]nc2ccccc21 ZINC000589641371 1036857096 /nfs/dbraw/zinc/85/70/96/1036857096.db2.gz JBKFLTDUTOWVOI-KRWDZBQOSA-N 2 0 348.494 4.227 20 0 EIADRP c1nc2cc(C[NH2+]Cc3ccc(C[NH+]4CCCCCC4)cc3)ccc2[nH]1 ZINC000589647615 1036861374 /nfs/dbraw/zinc/86/13/74/1036861374.db2.gz QWMDPCNMOVLYMK-UHFFFAOYSA-N 2 0 348.494 4.229 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2c(F)cccc2Cl)C1 ZINC000589837216 1036880527 /nfs/dbraw/zinc/88/05/27/1036880527.db2.gz LPDHIDUHXQWPSJ-GJZGRUSLSA-N 2 0 326.887 4.327 20 0 EIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CC3CCC(F)(F)CC3)CC2)C1 ZINC000503053482 1036890335 /nfs/dbraw/zinc/89/03/35/1036890335.db2.gz VCACOMPIALAVEO-MAUKXSAKSA-N 2 0 328.491 4.445 20 0 EIADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000503081984 1036894757 /nfs/dbraw/zinc/89/47/57/1036894757.db2.gz VMUDZVNAKVSFDF-INIZCTEOSA-N 2 0 338.948 4.381 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C/C=C\c3ccncc3)cc2)C1 ZINC000486943618 1036897886 /nfs/dbraw/zinc/89/78/86/1036897886.db2.gz OBKWRIRGHWCTDJ-LVXZVAJSSA-N 2 0 335.495 4.117 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+]C[C@@H]2CCSC2)C1 ZINC000486982924 1036934831 /nfs/dbraw/zinc/93/48/31/1036934831.db2.gz VJVFQPOHCWERLG-KSZLIROESA-N 2 0 332.557 4.007 20 0 EIADRP CCc1ccc(-c2nc(C[NH+]3CCC(C[NH+](C)C)CC3)cs2)cc1 ZINC000590125110 1036979604 /nfs/dbraw/zinc/97/96/04/1036979604.db2.gz GWECBTFVSNAOOQ-UHFFFAOYSA-N 2 0 343.540 4.146 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@H]2CCC23CCOCC3)cc1 ZINC000669698637 1037015760 /nfs/dbraw/zinc/01/57/60/1037015760.db2.gz VPQYIEAEZUJZCL-NQIIRXRSSA-N 2 0 342.527 4.110 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000271902761 1037048257 /nfs/dbraw/zinc/04/82/57/1037048257.db2.gz VXFQGOVNUZZHKS-CYBMUJFWSA-N 2 0 345.487 4.170 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccccc2Br)CC1 ZINC000590787122 1037166142 /nfs/dbraw/zinc/16/61/42/1037166142.db2.gz XMWGECJKAHHPFW-UHFFFAOYSA-N 2 0 339.321 4.001 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000272625649 1037252338 /nfs/dbraw/zinc/25/23/38/1037252338.db2.gz ZGHKGNIQZYIPGX-CABCVRRESA-N 2 0 331.529 4.110 20 0 EIADRP CCC[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cccnc1 ZINC000273469304 1037474973 /nfs/dbraw/zinc/47/49/73/1037474973.db2.gz FLIGOZAHROUNJN-OAQYLSRUSA-N 2 0 341.499 4.043 20 0 EIADRP CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)CS1 ZINC000488402696 1037568835 /nfs/dbraw/zinc/56/88/35/1037568835.db2.gz CCLXYXWUIVPESY-OALUTQOASA-N 2 0 332.557 4.292 20 0 EIADRP c1sc(C2CCCCC2)nc1C[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000573497377 1037569365 /nfs/dbraw/zinc/56/93/65/1037569365.db2.gz XJIWWWTYHJCQNP-DLBZAZTESA-N 2 0 333.545 4.012 20 0 EIADRP C[C@@H]1C[C@@H]1C[NH2+]C[C@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000488415363 1037583883 /nfs/dbraw/zinc/58/38/83/1037583883.db2.gz AMULRZHPYCSPRT-GFOCRRMGSA-N 2 0 340.433 4.334 20 0 EIADRP CC(C)C1CC([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000488465068 1037612460 /nfs/dbraw/zinc/61/24/60/1037612460.db2.gz UFTRMLCALHSGBG-UHFFFAOYSA-N 2 0 344.543 4.082 20 0 EIADRP CC(C)(C)[C@H]1C[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)CS1 ZINC000488467723 1037617352 /nfs/dbraw/zinc/61/73/52/1037617352.db2.gz WYKVWFNQDWJZQI-RTBURBONSA-N 2 0 332.557 4.292 20 0 EIADRP C[C@@H](C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(C(F)(F)F)cc1 ZINC000414654315 1037671536 /nfs/dbraw/zinc/67/15/36/1037671536.db2.gz ITXDZNKXGOJOFZ-QIXHYMPYSA-N 2 0 326.406 4.024 20 0 EIADRP C[C@@H]1C[C@H](C[N@@H+]2CCc3sccc3[C@H]2c2cccs2)CC[NH2+]1 ZINC000414680354 1037794344 /nfs/dbraw/zinc/79/43/44/1037794344.db2.gz MYGTWSVJFFXDLF-LBTNJELSSA-N 2 0 332.538 4.145 20 0 EIADRP C[C@@H]1C[C@H](C[N@@H+]2CCc3sccc3[C@@H]2c2cccs2)CC[NH2+]1 ZINC000414680353 1037794410 /nfs/dbraw/zinc/79/44/10/1037794410.db2.gz MYGTWSVJFFXDLF-HBUWYVDXSA-N 2 0 332.538 4.145 20 0 EIADRP FC(F)(F)c1cccc(CCC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)c1 ZINC000422710656 1037803942 /nfs/dbraw/zinc/80/39/42/1037803942.db2.gz FHJRTOOHKFSMHI-KURKYZTESA-N 2 0 340.433 4.148 20 0 EIADRP CC1CC[NH+](Cc2cccc(CN[C@@H]3C[C@@H]([NH3+])c4ccccc43)c2)CC1 ZINC000422745039 1037822059 /nfs/dbraw/zinc/82/20/59/1037822059.db2.gz ULQQAESAYUWCMU-DHIUTWEWSA-N 2 0 349.522 4.153 20 0 EIADRP [NH3+]CC1CCC([NH2+][C@H](COCc2ccccc2)c2ccccc2)CC1 ZINC000422777458 1037831307 /nfs/dbraw/zinc/83/13/07/1037831307.db2.gz GAJZASHZKRVYHI-FQUBMZHMSA-N 2 0 338.495 4.052 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(Cl)s1 ZINC000422807362 1037837742 /nfs/dbraw/zinc/83/77/42/1037837742.db2.gz MMMJLSILKPCPHR-WRSAYESZSA-N 2 0 348.899 4.308 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)cc1 ZINC000422791602 1037840348 /nfs/dbraw/zinc/84/03/48/1037840348.db2.gz YQYCBSLFYNDEPE-ZWOKBUDYSA-N 2 0 338.495 4.401 20 0 EIADRP C[C@H](CC[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1 ZINC000422857704 1037847594 /nfs/dbraw/zinc/84/75/94/1037847594.db2.gz YTTZJFQTFDFTHI-NQSCKRDGSA-N 2 0 336.479 4.026 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@@H](C)CCCC[NH3+])ccc1OC1CCCC1 ZINC000422875743 1037851135 /nfs/dbraw/zinc/85/11/35/1037851135.db2.gz DBBNHFNYRYXUKH-HOTGVXAUSA-N 2 0 334.504 4.185 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422884744 1037854515 /nfs/dbraw/zinc/85/45/15/1037854515.db2.gz FOYIQBCSQMNLAV-WDEREUQCSA-N 2 0 335.904 4.030 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H]2CCCOc3c(Cl)c(Cl)ccc32)CC1 ZINC000422897786 1037861621 /nfs/dbraw/zinc/86/16/21/1037861621.db2.gz CUNRGVWZJGXBEJ-MGULZYLOSA-N 2 0 329.271 4.067 20 0 EIADRP c1ccc(SC2(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)CC2)cc1 ZINC000422910675 1037865121 /nfs/dbraw/zinc/86/51/21/1037865121.db2.gz RGTGEYDEPNSMEX-GUDVDZBRSA-N 2 0 330.541 4.212 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1Cl)c1cc(F)ccc1F ZINC000422917577 1037878299 /nfs/dbraw/zinc/87/82/99/1037878299.db2.gz GKQXRERQKZUEMV-XIKOKIGWSA-N 2 0 338.829 4.425 20 0 EIADRP COc1ccccc1SC[C@H](C)C[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422947682 1037885983 /nfs/dbraw/zinc/88/59/83/1037885983.db2.gz QWTFEVIMJFDJTD-FHLIZLRMSA-N 2 0 342.508 4.158 20 0 EIADRP CC[C@H](C[N@H+](Cc1ccccn1)[C@@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000414706122 1037887005 /nfs/dbraw/zinc/88/70/05/1037887005.db2.gz AABSGHUCWCBEAR-DENIHFKCSA-N 2 0 337.511 4.220 20 0 EIADRP CC[C@@H](C[N@H+](Cc1ccccn1)[C@@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000414706128 1037887076 /nfs/dbraw/zinc/88/70/76/1037887076.db2.gz AABSGHUCWCBEAR-SIKLNZKXSA-N 2 0 337.511 4.220 20 0 EIADRP CC[C@H](CSc1ccccc1)[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000423007454 1037898815 /nfs/dbraw/zinc/89/88/15/1037898815.db2.gz XSKZFQIKNBYPPR-GDBMZVCRSA-N 2 0 329.513 4.070 20 0 EIADRP c1ccc(N2CCCCC2)c(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000423040658 1037919746 /nfs/dbraw/zinc/91/97/46/1037919746.db2.gz HTJHYFARKXGJJQ-NJDAHSKKSA-N 2 0 341.543 4.077 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000423045184 1037923682 /nfs/dbraw/zinc/92/36/82/1037923682.db2.gz CLHNNTKZMYAKJK-XJKSGUPXSA-N 2 0 347.503 4.434 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cc2ccccc2o1 ZINC000423060289 1037928233 /nfs/dbraw/zinc/92/82/33/1037928233.db2.gz NZUULJMBPZZYBU-YBOAYWMSSA-N 2 0 348.446 4.339 20 0 EIADRP CC(C)c1cccc(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000423050202 1037937307 /nfs/dbraw/zinc/93/73/07/1037937307.db2.gz LDUURPAKVMHHGF-IRLDBZIGSA-N 2 0 336.479 4.156 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(Oc3ccc(F)cc3)cc2)CC[N@@H+]1C ZINC000480449646 1037940486 /nfs/dbraw/zinc/94/04/86/1037940486.db2.gz SDXAQGFFJYFOPO-CRAIPNDOSA-N 2 0 328.431 4.190 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@H](Cc1ccccc1)C(C)C ZINC000423076652 1037941125 /nfs/dbraw/zinc/94/11/25/1037941125.db2.gz ZPWIFXYKNHDVQF-LPHOPBHVSA-N 2 0 325.500 4.014 20 0 EIADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000423096956 1037952532 /nfs/dbraw/zinc/95/25/32/1037952532.db2.gz QDQQPIQVEYPUSB-SRABZTEZSA-N 2 0 326.406 4.059 20 0 EIADRP Fc1cc(F)cc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)C2)c1 ZINC000423098297 1037957703 /nfs/dbraw/zinc/95/77/03/1037957703.db2.gz SALGPRMYZOHUGD-DSFJHFMVSA-N 2 0 334.454 4.111 20 0 EIADRP Fc1ccc2[nH]cc(CCC[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)c2c1 ZINC000423116363 1037962070 /nfs/dbraw/zinc/96/20/70/1037962070.db2.gz POQGUTCSGFOAIY-YZGWKJHDSA-N 2 0 343.490 4.140 20 0 EIADRP C[C@H]([NH2+]CCc1cccc2[nH]ccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000503903618 1037973205 /nfs/dbraw/zinc/97/32/05/1037973205.db2.gz RDJZNOIOIUYCQB-GHTZIAJQSA-N 2 0 347.506 4.211 20 0 EIADRP C[C@@H]([NH2+]C1CCC(C[NH3+])CC1)c1ccc(Oc2cccnc2)cc1 ZINC000423129966 1037976893 /nfs/dbraw/zinc/97/68/93/1037976893.db2.gz RMPXEAGUXWAGFL-KLHKWILBSA-N 2 0 325.456 4.042 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@H](C)Oc1ccc(C(C)C)cc1 ZINC000423105889 1037984197 /nfs/dbraw/zinc/98/41/97/1037984197.db2.gz JCNPTQBCQNICDJ-HOTGVXAUSA-N 2 0 341.499 4.090 20 0 EIADRP COCC[C@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000423108908 1037991099 /nfs/dbraw/zinc/99/10/99/1037991099.db2.gz RSJILAGEIAZZGV-LRDDRELGSA-N 2 0 333.303 4.178 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000503941010 1038031006 /nfs/dbraw/zinc/03/10/06/1038031006.db2.gz DWBPAGQLOBYYGB-NTCAYCPXSA-N 2 0 340.433 4.382 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+][C@@H](C)[C@@H]3CCC[NH2+]C3)cs2)cs1 ZINC000423216835 1038060672 /nfs/dbraw/zinc/06/06/72/1038060672.db2.gz PCOITSMBJVATIE-SGMGOOAPSA-N 2 0 335.542 4.219 20 0 EIADRP C[C@H]([NH3+])CC[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423224193 1038064705 /nfs/dbraw/zinc/06/47/05/1038064705.db2.gz IMNGNJROCHVBNM-SMDDNHRTSA-N 2 0 335.904 4.168 20 0 EIADRP Fc1cccc([C@@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2cccc(Cl)c2)c1 ZINC000423247871 1038080606 /nfs/dbraw/zinc/08/06/06/1038080606.db2.gz LVXIWRFMPOYUOJ-KUHUBIRLSA-N 2 0 332.850 4.158 20 0 EIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423282384 1038088278 /nfs/dbraw/zinc/08/82/78/1038088278.db2.gz WMDHTQXCOISYEY-GOEBONIOSA-N 2 0 328.422 4.006 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)cc1 ZINC000423259638 1038089531 /nfs/dbraw/zinc/08/95/31/1038089531.db2.gz OQBMLFQVXIELIM-ZWKOTPCHSA-N 2 0 338.495 4.403 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)cc1 ZINC000423288932 1038091838 /nfs/dbraw/zinc/09/18/38/1038091838.db2.gz AAUDJRCGKOJMEP-UGSOOPFHSA-N 2 0 330.859 4.363 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cccc(OC(F)(F)F)c1 ZINC000423290072 1038096122 /nfs/dbraw/zinc/09/61/22/1038096122.db2.gz CHEOENVLQACINH-QWHCGFSZSA-N 2 0 338.373 4.456 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423290812 1038096214 /nfs/dbraw/zinc/09/62/14/1038096214.db2.gz FODDJEPMBCTEFR-JKSUJKDBSA-N 2 0 334.467 4.051 20 0 EIADRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000423293576 1038097984 /nfs/dbraw/zinc/09/79/84/1038097984.db2.gz RTAQIMVERCVJSK-KGLIPLIRSA-N 2 0 334.410 4.467 20 0 EIADRP CSc1cccc([C@H]([NH2+]CCCC[NH3+])c2cc(F)ccc2F)c1 ZINC000423319484 1038112223 /nfs/dbraw/zinc/11/22/23/1038112223.db2.gz FMAGGHNGGDAWTO-SFHVURJKSA-N 2 0 336.451 4.105 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCc3ccc(Br)cc32)cc1 ZINC000423294179 1038118868 /nfs/dbraw/zinc/11/88/68/1038118868.db2.gz TXPDVMMRUVWUKO-KZULUSFZSA-N 2 0 345.284 4.246 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2CCc3ccc(Br)cc32)cc1 ZINC000423294181 1038124609 /nfs/dbraw/zinc/12/46/09/1038124609.db2.gz TXPDVMMRUVWUKO-XIKOKIGWSA-N 2 0 345.284 4.246 20 0 EIADRP Cc1cc(Cl)c2c(c1)[C@@H](NC1CC[NH+](CC3CC3)CC1)CCCO2 ZINC000489589475 1038133123 /nfs/dbraw/zinc/13/31/23/1038133123.db2.gz VJKMIZADTAKGTG-IBGZPJMESA-N 2 0 348.918 4.326 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423329050 1038144042 /nfs/dbraw/zinc/14/40/42/1038144042.db2.gz DULPDPXEKBHJIQ-IIBYNOLFSA-N 2 0 327.516 4.203 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423335840 1038148381 /nfs/dbraw/zinc/14/83/81/1038148381.db2.gz SFBSTSXWKOORPR-MRXNPFEDSA-N 2 0 327.516 4.203 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]CCC[N@H+]2CCCC[C@@H]2C)C1 ZINC000467312505 1038152106 /nfs/dbraw/zinc/15/21/06/1038152106.db2.gz FUWZWUMYNRSPNV-ZCNNSNEGSA-N 2 0 329.532 4.270 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000423385169 1038195008 /nfs/dbraw/zinc/19/50/08/1038195008.db2.gz GKVVXRQQHWAWPX-ZQIUZPCESA-N 2 0 329.513 4.076 20 0 EIADRP Clc1cccc([C@@H]2CC[C@H]([NH2+]Cc3ccc4c(c3)C[NH2+]C4)C2)c1 ZINC000423383639 1038195544 /nfs/dbraw/zinc/19/55/44/1038195544.db2.gz KMWFNNZRWIVIFN-UZLBHIALSA-N 2 0 326.871 4.369 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@H]1CC[NH2+]C[C@@H]1C ZINC000423392762 1038197514 /nfs/dbraw/zinc/19/75/14/1038197514.db2.gz MACWNAVUTASONN-MKBNYLNASA-N 2 0 349.931 4.421 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC[NH2+]1 ZINC000423375475 1038204646 /nfs/dbraw/zinc/20/46/46/1038204646.db2.gz KPEZLNGROAWWSL-DAXOMENPSA-N 2 0 345.487 4.057 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC000423376836 1038210360 /nfs/dbraw/zinc/21/03/60/1038210360.db2.gz LHVAFRSKKRPQJL-SGMGOOAPSA-N 2 0 333.476 4.049 20 0 EIADRP COCC1(C[NH2+][C@@H](C)c2cccc(-c3ccccc3)c2)CC[NH2+]CC1 ZINC000423405487 1038214976 /nfs/dbraw/zinc/21/49/76/1038214976.db2.gz JJTFRPPKZGOHJS-SFHVURJKSA-N 2 0 338.495 4.020 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000423446801 1038225320 /nfs/dbraw/zinc/22/53/20/1038225320.db2.gz ZCJNAFYAASLWCP-CZUORRHYSA-N 2 0 347.503 4.434 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000423437794 1038235455 /nfs/dbraw/zinc/23/54/55/1038235455.db2.gz QRZLOXWQDVLBFW-BEFAXECRSA-N 2 0 331.891 4.126 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000423437796 1038236975 /nfs/dbraw/zinc/23/69/75/1038236975.db2.gz QRZLOXWQDVLBFW-HNAYVOBHSA-N 2 0 331.891 4.126 20 0 EIADRP CC[C@@H]([NH2+][C@H](C)CCC[NH3+])c1ccc(Br)cc1Cl ZINC000423456859 1038238279 /nfs/dbraw/zinc/23/82/79/1038238279.db2.gz OHYYSHOECMKUNP-QMTHXVAHSA-N 2 0 333.701 4.271 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)C1 ZINC000423460918 1038240446 /nfs/dbraw/zinc/24/04/46/1038240446.db2.gz BTOOQXJYPRKEAF-SRCQZFHVSA-N 2 0 342.405 4.143 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)c2cccc(Br)c21 ZINC000423469713 1038244504 /nfs/dbraw/zinc/24/45/04/1038244504.db2.gz VPAQAOGINBUYOS-JXFSHQFZSA-N 2 0 337.305 4.105 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]CCC[C@@H]3CCC[NH2+]3)cs2)cs1 ZINC000423469573 1038244555 /nfs/dbraw/zinc/24/45/55/1038244555.db2.gz COSBYMXYXKBWDG-SWLSCSKDSA-N 2 0 335.542 4.363 20 0 EIADRP c1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)CCC3)cc1 ZINC000423467182 1038244870 /nfs/dbraw/zinc/24/48/70/1038244870.db2.gz BGMGZQPPNOUEBR-IRXDYDNUSA-N 2 0 341.524 4.309 20 0 EIADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(SCC(F)F)cc1 ZINC000423476709 1038247550 /nfs/dbraw/zinc/24/75/50/1038247550.db2.gz JIYOVKAAPSTNOT-HIFRSBDPSA-N 2 0 328.472 4.227 20 0 EIADRP COc1cccc(C[C@H]([NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)c2ccccc2)c1 ZINC000423478701 1038248898 /nfs/dbraw/zinc/24/88/98/1038248898.db2.gz UKRLFEJDIIFMAV-UZKOGDIHSA-N 2 0 338.495 4.086 20 0 EIADRP COc1cccc(C[C@H]([NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)c2ccccc2)c1 ZINC000423478699 1038249982 /nfs/dbraw/zinc/24/99/82/1038249982.db2.gz UKRLFEJDIIFMAV-CBQOVEMMSA-N 2 0 338.495 4.086 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cccs1 ZINC000423480368 1038251841 /nfs/dbraw/zinc/25/18/41/1038251841.db2.gz VVCVEJWMHIYKMJ-JQHSSLGASA-N 2 0 332.488 4.321 20 0 EIADRP CC[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(Br)cc1 ZINC000423484934 1038257432 /nfs/dbraw/zinc/25/74/32/1038257432.db2.gz RJSCFFGKYUPBAJ-CVEARBPZSA-N 2 0 325.294 4.022 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423486450 1038259094 /nfs/dbraw/zinc/25/90/94/1038259094.db2.gz STQODKMARJOLHZ-YOEHRIQHSA-N 2 0 329.513 4.301 20 0 EIADRP COc1ccc([C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)c2ccc(F)cc2)cc1 ZINC000423487925 1038259612 /nfs/dbraw/zinc/25/96/12/1038259612.db2.gz UUZUYZZFOOALKS-PZJWPPBQSA-N 2 0 342.458 4.046 20 0 EIADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(Oc2ccccc2)cn1 ZINC000423490948 1038262492 /nfs/dbraw/zinc/26/24/92/1038262492.db2.gz YEMBKDSVOHJPFG-SJORKVTESA-N 2 0 325.456 4.057 20 0 EIADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(Oc2ccccc2)cn1 ZINC000423490945 1038262658 /nfs/dbraw/zinc/26/26/58/1038262658.db2.gz YEMBKDSVOHJPFG-DLBZAZTESA-N 2 0 325.456 4.057 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000423493041 1038265471 /nfs/dbraw/zinc/26/54/71/1038265471.db2.gz PJBPNTHSRSODBD-DETPVDSQSA-N 2 0 333.476 4.036 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423495236 1038265565 /nfs/dbraw/zinc/26/55/65/1038265565.db2.gz UDXAKRRLLCATNQ-XAUMDUMWSA-N 2 0 342.458 4.183 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423535624 1038269726 /nfs/dbraw/zinc/26/97/26/1038269726.db2.gz DSSXBCAQRVRIPT-CYBMUJFWSA-N 2 0 345.487 4.218 20 0 EIADRP COc1cc(C)c([C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1OC ZINC000423516992 1038270091 /nfs/dbraw/zinc/27/00/91/1038270091.db2.gz YJEAOLWALIJDFK-QFBILLFUSA-N 2 0 342.483 4.143 20 0 EIADRP COc1ccc([C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)c(C)c1OC ZINC000423519684 1038273547 /nfs/dbraw/zinc/27/35/47/1038273547.db2.gz QDLSNRRWVMCUTF-APWZRJJASA-N 2 0 342.483 4.143 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H](c2cccc(F)c2)c2cccc(Cl)c2)C1 ZINC000423517981 1038274863 /nfs/dbraw/zinc/27/48/63/1038274863.db2.gz UVBVTYVXQAMWRD-ZNZDAUKMSA-N 2 0 332.850 4.286 20 0 EIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ncc(-c2ccccc2)n1C ZINC000423518987 1038275520 /nfs/dbraw/zinc/27/55/20/1038275520.db2.gz PNRYVSBWCDFMQB-XLIONFOSSA-N 2 0 348.494 4.218 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423562611 1038280944 /nfs/dbraw/zinc/28/09/44/1038280944.db2.gz WRNNWJRCVNMWLF-GRZALLJUSA-N 2 0 340.433 4.004 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423536183 1038285118 /nfs/dbraw/zinc/28/51/18/1038285118.db2.gz GZHDOBUFXBEKOV-MRXNPFEDSA-N 2 0 325.500 4.124 20 0 EIADRP FC(F)(F)c1cccc([C@@H]2CCC[C@H]2[NH2+]CCC2=CC[NH2+]CC2)c1 ZINC000423541626 1038288603 /nfs/dbraw/zinc/28/86/03/1038288603.db2.gz SLLZMWAEGCGANV-ZWKOTPCHSA-N 2 0 338.417 4.241 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@H]1CCCC[NH2+]C1 ZINC000423556824 1038294665 /nfs/dbraw/zinc/29/46/65/1038294665.db2.gz MTILJOCXGVBWKI-LRDDRELGSA-N 2 0 333.476 4.050 20 0 EIADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc2ccccc2c1OC(F)F ZINC000423569963 1038298207 /nfs/dbraw/zinc/29/82/07/1038298207.db2.gz WMDNGMIWQQNKML-AWEZNQCLSA-N 2 0 346.421 4.402 20 0 EIADRP CC[N@@H+]1CC[C@H](CN[C@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000490167133 1038365946 /nfs/dbraw/zinc/36/59/46/1038365946.db2.gz FYARYIKMISZVGT-OXQOHEQNSA-N 2 0 328.887 4.361 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)CC[N@@H+]1C ZINC000608061540 1038448266 /nfs/dbraw/zinc/44/82/66/1038448266.db2.gz JLQCDGZVCNUQEF-RXVVDRJESA-N 2 0 347.506 4.262 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)c(Cl)c1 ZINC000424257273 1038753964 /nfs/dbraw/zinc/75/39/64/1038753964.db2.gz KFUYCWNJNHSLFP-CQSZACIVSA-N 2 0 332.875 4.261 20 0 EIADRP CCC1(C[NH2+][C@@H](C)c2cscn2)CC[NH+](Cc2ccccc2)CC1 ZINC000539042799 1038782424 /nfs/dbraw/zinc/78/24/24/1038782424.db2.gz MYPCPMNTIOGWCW-KRWDZBQOSA-N 2 0 343.540 4.486 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cc1Cl ZINC000539052647 1038799845 /nfs/dbraw/zinc/79/98/45/1038799845.db2.gz NXEMFGUBIGTKKJ-HOTGVXAUSA-N 2 0 338.923 4.367 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cc1Cl ZINC000539052641 1038800773 /nfs/dbraw/zinc/80/07/73/1038800773.db2.gz NXEMFGUBIGTKKJ-CVEARBPZSA-N 2 0 338.923 4.367 20 0 EIADRP c1ccc(CC[C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000480763301 1038804375 /nfs/dbraw/zinc/80/43/75/1038804375.db2.gz MJCOBARYOHFAJA-OFNKIYASSA-N 2 0 334.507 4.434 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+][C@H](Cc2ccncc2)c2cccs2)CC1 ZINC000424305219 1038812513 /nfs/dbraw/zinc/81/25/13/1038812513.db2.gz RTINEDFXYPUNHI-GOSISDBHSA-N 2 0 343.540 4.279 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H](c2cccnc2C(F)(F)F)C2CC2)CC1 ZINC001168314935 1038819922 /nfs/dbraw/zinc/81/99/22/1038819922.db2.gz IJLXHDJEMULBGI-XUJLQICISA-N 2 0 341.421 4.014 20 0 EIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@H](CC2CC2)c2ccccc2)C[C@H](C)O1 ZINC000539071183 1038820326 /nfs/dbraw/zinc/82/03/26/1038820326.db2.gz FRCBNMYLFVGSSE-LVCYWYKZSA-N 2 0 330.516 4.007 20 0 EIADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000424381085 1038840348 /nfs/dbraw/zinc/84/03/48/1038840348.db2.gz YENNDNIOTLRCEK-XLNGHYISSA-N 2 0 326.406 4.201 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccnn1C1CCC1 ZINC000924686353 1038874736 /nfs/dbraw/zinc/87/47/36/1038874736.db2.gz RIRRRKPVNDTVEF-KZNAEPCWSA-N 2 0 332.536 4.017 20 0 EIADRP C[C@@H](c1ccc(C(C)(C)C)cc1)[N@H+](C)CCN(C)C1CC[NH+](C)CC1 ZINC000539219805 1038890221 /nfs/dbraw/zinc/89/02/21/1038890221.db2.gz RPLQFWCNJZHTPT-SFHVURJKSA-N 2 0 345.575 4.003 20 0 EIADRP c1ccc(CC[NH+]2CCC(NCc3nccc4ccccc43)CC2)cc1 ZINC000462108313 1038909339 /nfs/dbraw/zinc/90/93/39/1038909339.db2.gz DTAOXZNANHHJQM-UHFFFAOYSA-N 2 0 345.490 4.032 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc3cc(OC)ccc3c2)C1 ZINC000481023375 1038960710 /nfs/dbraw/zinc/96/07/10/1038960710.db2.gz NDLRMRVNLVIEHW-IAGOWNOFSA-N 2 0 326.484 4.231 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(OCC(F)(F)F)cc2)C1 ZINC000481024741 1038965440 /nfs/dbraw/zinc/96/54/40/1038965440.db2.gz OQTDSOJOKCVWHG-LSDHHAIUSA-N 2 0 344.421 4.010 20 0 EIADRP CCCCOc1ccc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1OC ZINC000414806759 1039018149 /nfs/dbraw/zinc/01/81/49/1039018149.db2.gz ICSKWBAFDWSSDU-INIZCTEOSA-N 2 0 342.483 4.184 20 0 EIADRP CCCCOc1cc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)ccc1OC ZINC000414809644 1039032049 /nfs/dbraw/zinc/03/20/49/1039032049.db2.gz MMWJJUWWILMLFL-MRXNPFEDSA-N 2 0 342.483 4.184 20 0 EIADRP C[C@@H]1CCC[C@@H](C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)C1 ZINC000539377625 1039034379 /nfs/dbraw/zinc/03/43/79/1039034379.db2.gz SZXSLKAHBDHRKG-GGPKGHCWSA-N 2 0 342.527 4.391 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CC2(O)CCCCCC2)CC1 ZINC000552046812 1039065914 /nfs/dbraw/zinc/06/59/14/1039065914.db2.gz SKSBFFLRRCYAOH-UHFFFAOYSA-N 2 0 344.543 4.105 20 0 EIADRP Cc1ccc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c(Br)c1 ZINC000414813452 1039083092 /nfs/dbraw/zinc/08/30/92/1039083092.db2.gz TVFFTXMNXFUPOI-CYBMUJFWSA-N 2 0 333.273 4.067 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)c(C)c1OC ZINC000552062773 1039084264 /nfs/dbraw/zinc/08/42/64/1039084264.db2.gz GJYXPSKPJAIPNQ-ZWKOTPCHSA-N 2 0 348.531 4.031 20 0 EIADRP C([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@H]1CCC2(CCCCC2)O1 ZINC000477858131 1039136840 /nfs/dbraw/zinc/13/68/40/1039136840.db2.gz KVVUNBFYQABDLN-HXUWFJFHSA-N 2 0 334.548 4.255 20 0 EIADRP CCC[NH+]1CCC([N@H+](C)Cc2cccc(Br)c2C)CC1 ZINC000534134273 1039150492 /nfs/dbraw/zinc/15/04/92/1039150492.db2.gz WIZHXWALSNKMBE-UHFFFAOYSA-N 2 0 339.321 4.064 20 0 EIADRP Cc1nc(C(C)C)ccc1C[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000555422766 1039179805 /nfs/dbraw/zinc/17/98/05/1039179805.db2.gz FOGQAIWSMYBRLQ-APWZRJJASA-N 2 0 329.532 4.256 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccc(OC)cc2)cc1 ZINC000120579263 1039181373 /nfs/dbraw/zinc/18/13/73/1039181373.db2.gz UKGREZROYZUDLE-KRWDZBQOSA-N 2 0 326.484 4.388 20 0 EIADRP FC(F)(F)c1ccc([C@H]2CCC[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000414829703 1039223844 /nfs/dbraw/zinc/22/38/44/1039223844.db2.gz NZMDDXRWOHFIGE-CIQAELJKSA-N 2 0 338.417 4.214 20 0 EIADRP CCC[C@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1cccc(C(F)(F)F)c1 ZINC000481325246 1039297382 /nfs/dbraw/zinc/29/73/82/1039297382.db2.gz VBJJTDJWJMBBMT-PBHICJAKSA-N 2 0 328.422 4.478 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(N[C@@H]2CC[NH+](C)[C@H]3CCC[C@@H]32)cc1 ZINC000552276353 1039353473 /nfs/dbraw/zinc/35/34/73/1039353473.db2.gz UNCGNKJUYDYSCW-CIQXWFTPSA-N 2 0 341.543 4.346 20 0 EIADRP C[C@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)COCc1ccccc1 ZINC000481405817 1039389316 /nfs/dbraw/zinc/38/93/16/1039389316.db2.gz QINQJPKCEWBQAO-LJQANCHMSA-N 2 0 344.543 4.226 20 0 EIADRP C[C@@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)COCc1ccccc1 ZINC000481405814 1039389766 /nfs/dbraw/zinc/38/97/66/1039389766.db2.gz QINQJPKCEWBQAO-IBGZPJMESA-N 2 0 344.543 4.226 20 0 EIADRP Clc1ccc(-c2n[nH]cc2C[NH2+]CCCCC[NH+]2CCCC2)cc1 ZINC000555615420 1039427441 /nfs/dbraw/zinc/42/74/41/1039427441.db2.gz WSORCOXWBFBHND-UHFFFAOYSA-N 2 0 346.906 4.086 20 0 EIADRP [NH3+]CCCCCC[NH+]1CCC(c2cccc(C(F)(F)F)c2)CC1 ZINC000200845022 1039508419 /nfs/dbraw/zinc/50/84/19/1039508419.db2.gz NIHNDUWTGOYBNZ-UHFFFAOYSA-N 2 0 328.422 4.404 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+][C@H]2CC23CC[NH2+]CC3)cc1 ZINC000643534269 1039715931 /nfs/dbraw/zinc/71/59/31/1039715931.db2.gz PFWIVDIAVAGURS-IERDGZPVSA-N 2 0 336.479 4.155 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000414850108 1039776390 /nfs/dbraw/zinc/77/63/90/1039776390.db2.gz YTEOIKWXDPUECS-GDBMZVCRSA-N 2 0 328.422 4.006 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)[C@@H](C)c2nc3ccccc3s2)CC1 ZINC000122730301 1039782858 /nfs/dbraw/zinc/78/28/58/1039782858.db2.gz HALOPFXHFUSDES-CVEARBPZSA-N 2 0 345.556 4.500 20 0 EIADRP CCC[NH+]1CCC([NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)CC1 ZINC000550857225 1039788150 /nfs/dbraw/zinc/78/81/50/1039788150.db2.gz OREIXNBBBSICAK-KRWDZBQOSA-N 2 0 328.422 4.187 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CCCCc2ccccc21 ZINC000481742492 1039805404 /nfs/dbraw/zinc/80/54/04/1039805404.db2.gz LMJQBHPKOKOOKR-OAQYLSRUSA-N 2 0 338.495 4.184 20 0 EIADRP COc1ccc2ccccc2c1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000537647607 1039806761 /nfs/dbraw/zinc/80/67/61/1039806761.db2.gz UUJYJCPSXSKQEU-SFHVURJKSA-N 2 0 338.495 4.156 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CC1CC[NH+](C)CC1 ZINC000550890382 1039812774 /nfs/dbraw/zinc/81/27/74/1039812774.db2.gz HBNPRJXOGWNPAX-MRXNPFEDSA-N 2 0 327.516 4.156 20 0 EIADRP Clc1ccccc1-c1ccc(C[NH2+][C@H]2CC23CC[NH2+]CC3)s1 ZINC000666952446 1039852445 /nfs/dbraw/zinc/85/24/45/1039852445.db2.gz WTFDPSAHNBQMGE-KRWDZBQOSA-N 2 0 332.900 4.300 20 0 EIADRP C[C@H](NC1(C[NH2+][C@H]2CC(C)(C)C[C@H]2C)CCOCC1)c1ccccc1 ZINC000434760093 1039860918 /nfs/dbraw/zinc/86/09/18/1039860918.db2.gz YAGJDADQRXOQKK-HBFSDRIKSA-N 2 0 344.543 4.301 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cc(C)c1O ZINC000551019676 1039884556 /nfs/dbraw/zinc/88/45/56/1039884556.db2.gz VCDPDTKEVUJHDS-UHFFFAOYSA-N 2 0 338.495 4.285 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H](c2cccnc2)C2CCC2)C1 ZINC000481922280 1039895526 /nfs/dbraw/zinc/89/55/26/1039895526.db2.gz XUYVXBVHIKKIPK-LVCYWYKZSA-N 2 0 329.532 4.271 20 0 EIADRP CN(C)c1ccccc1C[NH2+][C@@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000567851432 1039928967 /nfs/dbraw/zinc/92/89/67/1039928967.db2.gz HQAAAEPWXSJPKA-OAQYLSRUSA-N 2 0 349.522 4.039 20 0 EIADRP CN(c1ccccc1C[N@@H+]1CC[C@@H]1c1ccccc1)C1CC[NH+](C)CC1 ZINC000434986059 1039984532 /nfs/dbraw/zinc/98/45/32/1039984532.db2.gz MCCNCNUUAFFMCO-HSZRJFAPSA-N 2 0 349.522 4.164 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ncc(-c3ccccc3)s2)CC1 ZINC000553134660 1040010094 /nfs/dbraw/zinc/01/00/94/1040010094.db2.gz NVSKLTZZAFMQAW-UHFFFAOYSA-N 2 0 343.540 4.362 20 0 EIADRP C[C@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cc(F)cc(F)c1 ZINC000482132483 1040025552 /nfs/dbraw/zinc/02/55/52/1040025552.db2.gz YHANFRQDDNUZKB-KKSFZXQISA-N 2 0 344.449 4.008 20 0 EIADRP C[C@H]([NH2+]Cc1coc2ccccc12)c1ccc(OCC[NH+](C)C)cc1 ZINC000551205297 1040060077 /nfs/dbraw/zinc/06/00/77/1040060077.db2.gz JBHXJTQJZKRFTE-INIZCTEOSA-N 2 0 338.451 4.224 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccc(Br)cc1 ZINC000551262803 1040121551 /nfs/dbraw/zinc/12/15/51/1040121551.db2.gz HVLVATWOWRXJSB-HNNXBMFYSA-N 2 0 339.321 4.366 20 0 EIADRP CCOC[C@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)C(C)C ZINC000551279881 1040142047 /nfs/dbraw/zinc/14/20/47/1040142047.db2.gz KRNHUUYWOOFYCP-CBNMVNINSA-N 2 0 332.532 4.080 20 0 EIADRP [NH3+]CCN(c1cccc2ccccc21)C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167958105 1040158416 /nfs/dbraw/zinc/15/84/16/1040158416.db2.gz BYDXPMNJXDYUNW-WCRBZPEASA-N 2 0 349.522 4.010 20 0 EIADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(-c2ccccc2F)s1 ZINC000553439250 1040220055 /nfs/dbraw/zinc/22/00/55/1040220055.db2.gz UDKDPPJBNQZMRO-AWEZNQCLSA-N 2 0 330.472 4.467 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc(F)c1 ZINC000482442759 1040251238 /nfs/dbraw/zinc/25/12/38/1040251238.db2.gz XCIACAPNNAVCIN-HKUYNNGSSA-N 2 0 326.459 4.041 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(Br)s2)CC1 ZINC000482507810 1040306125 /nfs/dbraw/zinc/30/61/25/1040306125.db2.gz IKAGTVKJSUBIHC-GFCCVEGCSA-N 2 0 345.350 4.283 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccccc1OCc1ccccc1 ZINC000482569982 1040360146 /nfs/dbraw/zinc/36/01/46/1040360146.db2.gz RRIPIZAIJOFZKA-GOSISDBHSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccccc1OCc1ccccc1 ZINC000482569983 1040361635 /nfs/dbraw/zinc/36/16/35/1040361635.db2.gz RRIPIZAIJOFZKA-SFHVURJKSA-N 2 0 338.495 4.258 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000551530082 1040387596 /nfs/dbraw/zinc/38/75/96/1040387596.db2.gz NLMDRIMAVNBKAN-YGWPLHOASA-N 2 0 332.532 4.143 20 0 EIADRP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995699 1040393458 /nfs/dbraw/zinc/39/34/58/1040393458.db2.gz WWJXPZNWKYHUTC-OLZOCXBDSA-N 2 0 327.299 4.189 20 0 EIADRP CC[C@H](C[N@@H+](Cc1scnc1C)C[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000435447650 1040395182 /nfs/dbraw/zinc/39/51/82/1040395182.db2.gz HVSMZVGYXGXIGI-ZWKOTPCHSA-N 2 0 343.540 4.057 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cc(C)cc(C)c2)[C@@H](C)C1 ZINC000482647708 1040407909 /nfs/dbraw/zinc/40/79/09/1040407909.db2.gz BMAQCEUHBIJGKV-ZJOUEHCJSA-N 2 0 332.532 4.091 20 0 EIADRP Cc1cc(Cl)cc2c1OCCC[C@@H]2NC1CC([NH+]2CCCCC2)C1 ZINC000479546480 1040450267 /nfs/dbraw/zinc/45/02/67/1040450267.db2.gz UMCCHBPHIKLURE-TVPLGVNVSA-N 2 0 348.918 4.469 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH2+]CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000515053378 1040451869 /nfs/dbraw/zinc/45/18/69/1040451869.db2.gz VGZHNNVULHVELB-INIZCTEOSA-N 2 0 342.458 4.055 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000482900164 1040566342 /nfs/dbraw/zinc/56/63/42/1040566342.db2.gz ZSZUDPRLLPYMHH-FXAWDEMLSA-N 2 0 338.495 4.008 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](C[C@@H]2CCC3(CCCC3)O2)CC1 ZINC000515218179 1040573195 /nfs/dbraw/zinc/57/31/95/1040573195.db2.gz UUDZWFHXVXCMDC-FQEVSTJZSA-N 2 0 336.564 4.312 20 0 EIADRP CC(C)[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551811868 1040622725 /nfs/dbraw/zinc/62/27/25/1040622725.db2.gz IHMORPFLQLZPOW-RTWAWAEBSA-N 2 0 330.516 4.074 20 0 EIADRP C[N@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCc2ccc(F)cc21 ZINC000483088698 1040697318 /nfs/dbraw/zinc/69/73/18/1040697318.db2.gz LILZWBICRUBQOU-AVRDEDQJSA-N 2 0 338.470 4.267 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)c1cccs1)c1cccc(OCC[NH+](C)C)c1 ZINC000483121815 1040702898 /nfs/dbraw/zinc/70/28/98/1040702898.db2.gz RCFUFRJNBLBPHV-MRXNPFEDSA-N 2 0 346.540 4.317 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1c2ccccc2CCC[C@H]1C ZINC000462540688 1040714646 /nfs/dbraw/zinc/71/46/46/1040714646.db2.gz UOGZTSJPLRPYJA-OPAMFIHVSA-N 2 0 346.478 4.379 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)ccc1SC ZINC000483204025 1040759376 /nfs/dbraw/zinc/75/93/76/1040759376.db2.gz RXSIJQNSJBXHRJ-KBXCAEBGSA-N 2 0 338.561 4.434 20 0 EIADRP C[C@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1ccccc1OC(F)F ZINC000483188980 1040762062 /nfs/dbraw/zinc/76/20/62/1040762062.db2.gz YHOXJVZEFABAIP-XJKSGUPXSA-N 2 0 328.447 4.305 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(OCC3CC3)cc2)CC1 ZINC000483280788 1040805464 /nfs/dbraw/zinc/80/54/64/1040805464.db2.gz RAIUDGASTBQXMX-UHFFFAOYSA-N 2 0 330.516 4.029 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](CCCOc3cccc4ccccc43)CC[C@H]21 ZINC000483485343 1040874637 /nfs/dbraw/zinc/87/46/37/1040874637.db2.gz RQPXRQZARCKAHI-PZJWPPBQSA-N 2 0 338.495 4.025 20 0 EIADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000537938482 1040901940 /nfs/dbraw/zinc/90/19/40/1040901940.db2.gz BAICTLKMIXXNBH-VGSWGCGISA-N 2 0 338.495 4.274 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cc(Cl)ccc1OC(F)F ZINC000515649933 1040947595 /nfs/dbraw/zinc/94/75/95/1040947595.db2.gz RLWQXYITEPQMNV-LLVKDONJSA-N 2 0 340.801 4.251 20 0 EIADRP COc1ccc([C@H]2CCCC[C@@H]2[NH2+]C2CC[NH+](C(C)C)CC2)cc1F ZINC000537972461 1040975439 /nfs/dbraw/zinc/97/54/39/1040975439.db2.gz LIWVJHFMFGQGDU-QUCCMNQESA-N 2 0 348.506 4.323 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CCOc2ccccc2C)cc1 ZINC000537992287 1040987795 /nfs/dbraw/zinc/98/77/95/1040987795.db2.gz XIWDKGBXDUNWLQ-QGZVFWFLSA-N 2 0 335.451 4.219 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cc3c(cccc3F)[nH]2)c1 ZINC000436270715 1041039849 /nfs/dbraw/zinc/03/98/49/1041039849.db2.gz PIQVJZHJZXPAKU-UHFFFAOYSA-N 2 0 339.458 4.439 20 0 EIADRP c1ccc(C[C@H]2CC[C@@H]([NH2+]C3CC[NH+](C4CCCC4)CC3)C2)cc1 ZINC000436299784 1041068621 /nfs/dbraw/zinc/06/86/21/1041068621.db2.gz HKHPKHDORIPZHP-TZIWHRDSSA-N 2 0 326.528 4.394 20 0 EIADRP Cc1ccsc1CC[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000538116111 1041068713 /nfs/dbraw/zinc/06/87/13/1041068713.db2.gz DZHWNKNFWBEJFP-MJGOQNOKSA-N 2 0 328.525 4.099 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000436315440 1041083273 /nfs/dbraw/zinc/08/32/73/1041083273.db2.gz PKUMMOQJYBTHLZ-VVMVDLBUSA-N 2 0 340.433 4.270 20 0 EIADRP C[C@H]([NH2+][C@H](c1cccs1)C1CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000480230097 1041104276 /nfs/dbraw/zinc/10/42/76/1041104276.db2.gz QXYJGIAMXHNENU-YWZLYKJASA-N 2 0 344.524 4.490 20 0 EIADRP C[C@H]([NH2+][C@@H](c1cccs1)C1CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000480230093 1041105998 /nfs/dbraw/zinc/10/59/98/1041105998.db2.gz QXYJGIAMXHNENU-MGPUTAFESA-N 2 0 344.524 4.490 20 0 EIADRP C[C@@H](Nc1cc2c(c[nH+]1)CCCC2)c1cccc(OCC[NH+](C)C)c1 ZINC000462957420 1041140920 /nfs/dbraw/zinc/14/09/20/1041140920.db2.gz QSBZPNRLPKGDOE-MRXNPFEDSA-N 2 0 339.483 4.074 20 0 EIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)c(F)c1 ZINC000540137282 1041182848 /nfs/dbraw/zinc/18/28/48/1041182848.db2.gz SBOBQVQARUXJFB-CQSZACIVSA-N 2 0 347.865 4.441 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000540150167 1041199160 /nfs/dbraw/zinc/19/91/60/1041199160.db2.gz CBIUQHJIFFEVLH-JKSUJKDBSA-N 2 0 340.458 4.307 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc3c(c2)COC3)CC1 ZINC000484301177 1041202339 /nfs/dbraw/zinc/20/23/39/1041202339.db2.gz UZSFHTPAMOIRBD-KRWDZBQOSA-N 2 0 330.516 4.126 20 0 EIADRP COc1cccc2c1CC[C@H]2[NH2+]CC1CC[NH+](CCC(C)C)CC1 ZINC000484306785 1041202395 /nfs/dbraw/zinc/20/23/95/1041202395.db2.gz XQZXOXCFLADQMK-HXUWFJFHSA-N 2 0 330.516 4.030 20 0 EIADRP CN(c1ccccc1C[NH2+]CCC1=CCCCC1)C1CC[NH+](C)CC1 ZINC000538313151 1041258228 /nfs/dbraw/zinc/25/82/28/1041258228.db2.gz MLBUPNBBTVOOGD-UHFFFAOYSA-N 2 0 341.543 4.197 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000554586092 1041260533 /nfs/dbraw/zinc/26/05/33/1041260533.db2.gz QRJVEHBCPXBRTP-GOSISDBHSA-N 2 0 340.433 4.478 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@@H]1CC2c3ccccc3C1c1ccccc12 ZINC000540194450 1041270729 /nfs/dbraw/zinc/27/07/29/1041270729.db2.gz ITZWRVHOUMJDPF-UDYOMSLQSA-N 2 0 346.518 4.214 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(F)c(Br)c1 ZINC000484481752 1041273238 /nfs/dbraw/zinc/27/32/38/1041273238.db2.gz AEMUEQBZBVNVCM-YUTCNCBUSA-N 2 0 343.284 4.112 20 0 EIADRP COCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CCCC1 ZINC000484508612 1041292959 /nfs/dbraw/zinc/29/29/59/1041292959.db2.gz PZOPMQYWSOVDFT-TZIWHRDSSA-N 2 0 344.543 4.084 20 0 EIADRP COc1ccc([C@H]([NH2+]CCCC[NH+]2CCC(C)CC2)C2CC2)cc1 ZINC000540259071 1041326066 /nfs/dbraw/zinc/32/60/66/1041326066.db2.gz OUCPHVQZWBCUSV-OAQYLSRUSA-N 2 0 330.516 4.248 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C(C)C)C1 ZINC000540261237 1041328992 /nfs/dbraw/zinc/32/89/92/1041328992.db2.gz XIANTHRQDXOUMZ-RHSMWYFYSA-N 2 0 328.422 4.334 20 0 EIADRP COc1cc(C)c([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1OC ZINC000480611632 1041421714 /nfs/dbraw/zinc/42/17/14/1041421714.db2.gz OPJGOJUXXAZOIY-FUHWJXTLSA-N 2 0 348.531 4.175 20 0 EIADRP CC(C)C[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)CCO1 ZINC000538579548 1041431320 /nfs/dbraw/zinc/43/13/20/1041431320.db2.gz XACSQFSAXHDBFI-CWJKEVGVSA-N 2 0 336.564 4.213 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CC[C@H](c2ccccc2)C[C@H]1C ZINC000467554509 1041434659 /nfs/dbraw/zinc/43/46/59/1041434659.db2.gz OHSINPYAQIJJAL-XLIONFOSSA-N 2 0 346.478 4.344 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCSCc2ccc(Cl)cc2Cl)CC[N@@H+]1C ZINC000540396765 1041440477 /nfs/dbraw/zinc/44/04/77/1041440477.db2.gz DLILSPOWAWAWBZ-DOMZBBRYSA-N 2 0 347.355 4.299 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C3(Cc4ccccc4)CC3)CC2)C1 ZINC000480668081 1041459883 /nfs/dbraw/zinc/45/98/83/1041459883.db2.gz VDHWVBLGLJIIEX-WIYYLYMNSA-N 2 0 326.528 4.394 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)C(F)(F)F ZINC000480668810 1041461430 /nfs/dbraw/zinc/46/14/30/1041461430.db2.gz WOZCBRVWDMKCSV-NRSFXHEJSA-N 2 0 340.433 4.075 20 0 EIADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)[C@@H]1C ZINC000540467218 1041472929 /nfs/dbraw/zinc/47/29/29/1041472929.db2.gz DTIWEAGNBNALIW-IZBJGVDFSA-N 2 0 342.527 4.389 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C)c(Br)c2)C[C@H]1C ZINC000538718941 1041489953 /nfs/dbraw/zinc/48/99/53/1041489953.db2.gz YBRDCWWMOVARIR-GDBMZVCRSA-N 2 0 339.321 4.062 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2c(OC)ccc3ccccc32)[C@@H](C)C1 ZINC000538738758 1041510709 /nfs/dbraw/zinc/51/07/09/1041510709.db2.gz XOMNFXNLWGXCPN-JXFKEZNVSA-N 2 0 326.484 4.011 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2c(OC)ccc3ccccc32)[C@H](C)C1 ZINC000538738760 1041511030 /nfs/dbraw/zinc/51/10/30/1041511030.db2.gz XOMNFXNLWGXCPN-OXQOHEQNSA-N 2 0 326.484 4.011 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cnc(-c3cccs3)s2)CC1 ZINC000506873439 1041551257 /nfs/dbraw/zinc/55/12/57/1041551257.db2.gz GFZPLKSUNWUQGA-UHFFFAOYSA-N 2 0 349.569 4.425 20 0 EIADRP OCCCCCCCCCCCC[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001168359937 1041602163 /nfs/dbraw/zinc/60/21/63/1041602163.db2.gz IKNAMMHINBLPOS-UHFFFAOYSA-N 2 0 338.580 4.344 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000539040592 1041616735 /nfs/dbraw/zinc/61/67/35/1041616735.db2.gz DNZHJXOMVWBMAS-LNLFQRSKSA-N 2 0 341.474 4.172 20 0 EIADRP CC(C)[NH2+]CCC[NH2+][C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000516921157 1041810987 /nfs/dbraw/zinc/81/09/87/1041810987.db2.gz GGOCKVRSJBZPOF-INIZCTEOSA-N 2 0 347.503 4.304 20 0 EIADRP COc1cc([C@H](C)[NH2+]CCC[N@H+](C)Cc2ccccc2)ccc1F ZINC000301718695 1041982717 /nfs/dbraw/zinc/98/27/17/1041982717.db2.gz PUUCTDFKDFLOJC-INIZCTEOSA-N 2 0 330.447 4.007 20 0 EIADRP Cc1cc(C[NH+]2CCC(CCC[NH+](C)C)CC2)cc2cccnc12 ZINC000541535399 1041999222 /nfs/dbraw/zinc/99/92/22/1041999222.db2.gz XHURNLTXPUYHCM-UHFFFAOYSA-N 2 0 325.500 4.097 20 0 EIADRP C[C@@H](NCc1cccc(OC(C)(C)C)n1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541603186 1042038771 /nfs/dbraw/zinc/03/87/71/1042038771.db2.gz ORGLHWFQCXOBAK-IAGOWNOFSA-N 2 0 345.531 4.002 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1)C[NH+](C)C ZINC000425945556 1042045857 /nfs/dbraw/zinc/04/58/57/1042045857.db2.gz RHVBOGOIZNXPCT-FRFSOERESA-N 2 0 328.422 4.129 20 0 EIADRP C[C@]1(c2ccccc2)CC[C@H]([N@@H+]2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)C1 ZINC000438119929 1042062219 /nfs/dbraw/zinc/06/22/19/1042062219.db2.gz LAFTUKSKZIACIF-IITNATTFSA-N 2 0 338.539 4.446 20 0 EIADRP c1ccc(OCCCCC[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000438121444 1042062644 /nfs/dbraw/zinc/06/26/44/1042062644.db2.gz PKEDYNLRPXFFJI-SIKLNZKXSA-N 2 0 342.527 4.184 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)CC1 ZINC000438178543 1042072483 /nfs/dbraw/zinc/07/24/83/1042072483.db2.gz OSJDILNUWKQMNW-SJORKVTESA-N 2 0 334.470 4.455 20 0 EIADRP C[C@@]1(c2ccccc2)CC[C@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C1 ZINC000438192921 1042085404 /nfs/dbraw/zinc/08/54/04/1042085404.db2.gz RQNMERPIXNAZLH-RBBKRZOGSA-N 2 0 326.528 4.493 20 0 EIADRP Cc1ccc([C@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)C2CCC2)o1 ZINC000541744762 1042092048 /nfs/dbraw/zinc/09/20/48/1042092048.db2.gz MSSZGSICIVJMKG-OAQYLSRUSA-N 2 0 342.483 4.159 20 0 EIADRP C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccc(Cl)cc3)s2)C1 ZINC000541909516 1042167088 /nfs/dbraw/zinc/16/70/88/1042167088.db2.gz ZBRIOAJLPPVCRQ-CQSZACIVSA-N 2 0 334.916 4.452 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]Cc3cccc4cc[nH]c43)CC2)C1 ZINC000467373546 1042299117 /nfs/dbraw/zinc/29/91/17/1042299117.db2.gz NKAYFJFVANAOGS-UZLBHIALSA-N 2 0 325.500 4.301 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C/C=C\c2ccc(OCc3ccccc3)cc2)CC[NH2+]1 ZINC000414962041 1042394375 /nfs/dbraw/zinc/39/43/75/1042394375.db2.gz ZMBHWQGZMHNHJL-CDKMSYNUSA-N 2 0 336.479 4.009 20 0 EIADRP S=c1ccn(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c2ccccc12 ZINC000151823246 1042505637 /nfs/dbraw/zinc/50/56/37/1042505637.db2.gz IEPXUHGAXCTSKR-UHFFFAOYSA-N 2 0 341.524 4.136 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCc3ccc(C)cc32)[C@@H](C)C1 ZINC000426289009 1042513517 /nfs/dbraw/zinc/51/35/17/1042513517.db2.gz FJHMJMMQTCHPLV-YUXAGFNASA-N 2 0 344.543 4.099 20 0 EIADRP C[NH+](C)CC(C)(C)C[NH2+][C@@H](c1ccc(Br)s1)C1CC1 ZINC000439148301 1042520469 /nfs/dbraw/zinc/52/04/69/1042520469.db2.gz WXMVZWIXASDAJN-CQSZACIVSA-N 2 0 345.350 4.139 20 0 EIADRP Clc1cccc(OCCC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167963895 1042546573 /nfs/dbraw/zinc/54/65/73/1042546573.db2.gz HMZKCUMGGMNQST-YQQQUEKLSA-N 2 0 348.918 4.104 20 0 EIADRP C[C@@H]([NH2+]CCCc1cccc(F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492326083 1042614272 /nfs/dbraw/zinc/61/42/72/1042614272.db2.gz BBAFCNLNSXYOKN-NQIIRXRSSA-N 2 0 340.486 4.259 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2ccc3[nH]cnc3c2)cc1 ZINC000518761411 1042678949 /nfs/dbraw/zinc/67/89/49/1042678949.db2.gz ULIJMJOASULBQZ-KRWDZBQOSA-N 2 0 348.494 4.227 20 0 EIADRP C[NH+](C)CCOc1ccc(CC[NH2+]Cc2ccc3ccccc3c2)cc1 ZINC000518778593 1042682983 /nfs/dbraw/zinc/68/29/83/1042682983.db2.gz UCEUBTDVCNRIEN-UHFFFAOYSA-N 2 0 348.490 4.113 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc(Br)cc1F ZINC000036984881 1042725652 /nfs/dbraw/zinc/72/56/52/1042725652.db2.gz UQJVYYJAUDXPPM-ZDUSSCGKSA-N 2 0 345.300 4.188 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](Cc1ccccc1C)C1CC1 ZINC000542464107 1042751791 /nfs/dbraw/zinc/75/17/91/1042751791.db2.gz MUXQLCNUMHCIDL-UHFFFAOYSA-N 2 0 332.451 4.049 20 0 EIADRP C[C@@H]([NH2+]CCC[N@H+](C)Cc1ccccc1)c1cnc2ccsc2c1 ZINC000309942191 1042824419 /nfs/dbraw/zinc/82/44/19/1042824419.db2.gz ISXWVDAKTBEZMB-MRXNPFEDSA-N 2 0 339.508 4.469 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)[C@@H](C)C2 ZINC000493206341 1042843142 /nfs/dbraw/zinc/84/31/42/1042843142.db2.gz QIQZHFIGICTPRM-YCRPNKLZSA-N 2 0 326.459 4.219 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H]2CCCc3ccc(C(C)C)cc32)CC1 ZINC000536420621 1042848971 /nfs/dbraw/zinc/84/89/71/1042848971.db2.gz LDUMLUIMYBSSHT-QFIPXVFZSA-N 2 0 344.543 4.278 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc2ccccc2n1 ZINC000178106392 1042858649 /nfs/dbraw/zinc/85/86/49/1042858649.db2.gz SLOIYUYIWWYOOE-SFHVURJKSA-N 2 0 325.500 4.398 20 0 EIADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000493890812 1042972853 /nfs/dbraw/zinc/97/28/53/1042972853.db2.gz HMTGJMDJNPFGOK-XMSQKQJNSA-N 2 0 340.511 4.393 20 0 EIADRP CC[C@@H]1C[C@@H](C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)CCO1 ZINC000507791858 1042975275 /nfs/dbraw/zinc/97/52/75/1042975275.db2.gz DEELGINHOSLZLF-SESVDKBCSA-N 2 0 336.564 4.168 20 0 EIADRP Cc1nc2ccc(C[NH2+]C[C@H]3CCC[N@@H+](CC(C)C)C3)cc2s1 ZINC000494170658 1043025256 /nfs/dbraw/zinc/02/52/56/1043025256.db2.gz FITQWQQODNXEGF-QGZVFWFLSA-N 2 0 331.529 4.062 20 0 EIADRP CC(C)Oc1ccc(C[NH+]2CCC(CC[NH+](C)C)CC2)cc1Cl ZINC000494188306 1043031422 /nfs/dbraw/zinc/03/14/22/1043031422.db2.gz IVPGMKYRBNLRJT-UHFFFAOYSA-N 2 0 338.923 4.291 20 0 EIADRP CC(C)[NH+](CCN[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC001168008697 1043077582 /nfs/dbraw/zinc/07/75/82/1043077582.db2.gz FTKIJGFLVGKRGX-VTYHHJSWSA-N 2 0 345.575 4.136 20 0 EIADRP CN1CCC([N@H+](C2CCCC2)[C@H]2Cc3cccc(Cl)c3C2)CC1 ZINC001168743179 1043086763 /nfs/dbraw/zinc/08/67/63/1043086763.db2.gz JOYOKHJDBFDYMH-SFHVURJKSA-N 2 0 332.919 4.146 20 0 EIADRP Fc1ccc(F)c2c1CC[C@@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000507820523 1043106021 /nfs/dbraw/zinc/10/60/21/1043106021.db2.gz DFTLBAKETYDJQH-FQEVSTJZSA-N 2 0 342.433 4.338 20 0 EIADRP CCO[C@H]1C[C@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C12CCCCC2 ZINC000766187421 1043156425 /nfs/dbraw/zinc/15/64/25/1043156425.db2.gz MMJBVNQTENXNJV-PMACEKPBSA-N 2 0 334.548 4.111 20 0 EIADRP CCSc1cccc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000185617406 1043203774 /nfs/dbraw/zinc/20/37/74/1043203774.db2.gz MMDJHSROAUYLNQ-UHFFFAOYSA-N 2 0 341.524 4.200 20 0 EIADRP C[C@@H]([NH2+]CC1([NH3+])CCCC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000665249771 1043262367 /nfs/dbraw/zinc/26/23/67/1043262367.db2.gz YVAJOTAPZUHDQC-NEPJUHHUSA-N 2 0 331.287 4.010 20 0 EIADRP COc1ccc(C[NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001168010947 1043297913 /nfs/dbraw/zinc/29/79/13/1043297913.db2.gz LOTJLHBZHXKZEK-RMFSNUHRSA-N 2 0 338.495 4.226 20 0 EIADRP COc1cccc(-c2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)c1 ZINC000166714958 1043307829 /nfs/dbraw/zinc/30/78/29/1043307829.db2.gz QRQZWRHCYRVCIM-LEWJYISDSA-N 2 0 336.479 4.079 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)C1CCC(F)(F)CC1 ZINC000474025942 1043384200 /nfs/dbraw/zinc/38/42/00/1043384200.db2.gz YSSDFAKIPKVDOF-ZDUSSCGKSA-N 2 0 328.422 4.191 20 0 EIADRP C[C@@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)c1ccc(Oc2cccnc2)cc1 ZINC000672806877 1043407118 /nfs/dbraw/zinc/40/71/18/1043407118.db2.gz YYTCGYYMFVTPKK-IAGOWNOFSA-N 2 0 339.483 4.255 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCC[C@@H]2[C@@H]2CCOC2)c1 ZINC000474029120 1043441984 /nfs/dbraw/zinc/44/19/84/1043441984.db2.gz LEEKHBHTUFICGT-YPAWHYETSA-N 2 0 344.543 4.212 20 0 EIADRP CC(C)Oc1cccc(C[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)c1 ZINC000520948961 1043453576 /nfs/dbraw/zinc/45/35/76/1043453576.db2.gz KSUYSYBSZIJHMJ-RTBURBONSA-N 2 0 332.532 4.322 20 0 EIADRP Nc1ccc2c(c1)CC[C@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000665272159 1043477308 /nfs/dbraw/zinc/47/73/08/1043477308.db2.gz ZPMPOKKSJQOYJG-ADYITMSISA-N 2 0 347.506 4.041 20 0 EIADRP c1ccc2c(NCc3ccc(C[NH+]4CCCCC4)cc3)cc[nH+]c2c1 ZINC000521056996 1043509674 /nfs/dbraw/zinc/50/96/74/1043509674.db2.gz DCEMFOMIBHUCBT-UHFFFAOYSA-N 2 0 331.463 4.255 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)[C@H](C)C2 ZINC000665273492 1043511001 /nfs/dbraw/zinc/51/10/01/1043511001.db2.gz XYEDBKUSCRSIGP-UCMODRJZSA-N 2 0 348.490 4.074 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2cccc(CC(C)C)c2)CC[NH+](C)CC1 ZINC000521320530 1043708177 /nfs/dbraw/zinc/70/81/77/1043708177.db2.gz ZCFRAGKKPIKYLS-KRWDZBQOSA-N 2 0 334.573 4.363 20 0 EIADRP C[C@H]([NH2+]Cc1cc2ccccc2[nH]1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000681390515 1043732363 /nfs/dbraw/zinc/73/23/63/1043732363.db2.gz NDKONQWKLCBASK-FXAWDEMLSA-N 2 0 333.479 4.168 20 0 EIADRP C([NH2+][C@H](C1CCC1)C1CCCCC1)C1CC[NH+](C2CCOCC2)CC1 ZINC000658069851 1043740355 /nfs/dbraw/zinc/74/03/55/1043740355.db2.gz JTMJYMGCIPGLPU-QFIPXVFZSA-N 2 0 348.575 4.216 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc2c(c1)CCC(C)(C)O2 ZINC000731675797 1043815140 /nfs/dbraw/zinc/81/51/40/1043815140.db2.gz ZWTMRRWDSBFOEK-KRWDZBQOSA-N 2 0 332.532 4.390 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)CCS2 ZINC000191535764 1043824778 /nfs/dbraw/zinc/82/47/78/1043824778.db2.gz ZGNYFVITIOGBBW-VQIMIIECSA-N 2 0 348.556 4.190 20 0 EIADRP FC(F)C1CCC([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000442774053 1043830531 /nfs/dbraw/zinc/83/05/31/1043830531.db2.gz YLQGJEZIOSZJOW-UHFFFAOYSA-N 2 0 336.470 4.312 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCc4ccccc4OC3)CC2)CC1 ZINC000494593813 1043837414 /nfs/dbraw/zinc/83/74/14/1043837414.db2.gz ZYZWPLOWFHCOGQ-NYLDSWQDSA-N 2 0 342.527 4.013 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](CC2=Cc3ccccc3OC2)CC1 ZINC000543105373 1043848757 /nfs/dbraw/zinc/84/87/57/1043848757.db2.gz CKVJHKSDNQXEGI-UHFFFAOYSA-N 2 0 342.527 4.296 20 0 EIADRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000442917289 1043889957 /nfs/dbraw/zinc/88/99/57/1043889957.db2.gz DCWFTKXTXGAQOU-ZDUSSCGKSA-N 2 0 335.904 4.024 20 0 EIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCCCC[C@@H]2c2ccccc2)CC1 ZINC000192723402 1043957165 /nfs/dbraw/zinc/95/71/65/1043957165.db2.gz JKNDZPMLFULORP-JOCHJYFZSA-N 2 0 343.559 4.020 20 0 EIADRP C[C@H](CCCC(C)(C)O)[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168015049 1043963381 /nfs/dbraw/zinc/96/33/81/1043963381.db2.gz ONLONCYDDAXERZ-GUDVDZBRSA-N 2 0 346.559 4.347 20 0 EIADRP C[C@@H]1C[C@@H](n2cc3cc(C[NH3+])ccc3n2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168015203 1044074492 /nfs/dbraw/zinc/07/44/92/1044074492.db2.gz PMGFFALJBGJOBK-UPHUGPLXSA-N 2 0 348.494 4.109 20 0 EIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000193973971 1044224898 /nfs/dbraw/zinc/22/48/98/1044224898.db2.gz SYSNDIKJARECGP-GOEBONIOSA-N 2 0 340.433 4.100 20 0 EIADRP CCC[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccsc1 ZINC000191207876 1044279074 /nfs/dbraw/zinc/27/90/74/1044279074.db2.gz MFOAXVQKAOGAOT-IBGZPJMESA-N 2 0 332.513 4.320 20 0 EIADRP c1cc(OCC[NH+]2CCCC2)ccc1CC[NH2+][C@H]1CCC12CCCC2 ZINC000474045494 1044294443 /nfs/dbraw/zinc/29/44/43/1044294443.db2.gz PBGHAEJROITUHQ-NRFANRHFSA-N 2 0 342.527 4.016 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]CC2CCC(C(F)(F)F)CC2)C1 ZINC000466361381 1044322557 /nfs/dbraw/zinc/32/25/57/1044322557.db2.gz UWKMVHVQYOWYAJ-CGZBRXJRSA-N 2 0 334.470 4.313 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000675489079 1044359349 /nfs/dbraw/zinc/35/93/49/1044359349.db2.gz FTWITTOWMBUAKI-RBUKOAKNSA-N 2 0 325.500 4.222 20 0 EIADRP Clc1cccc2c1C[C@H]([NH2+]C1CC[NH+](C[C@H]3CC=CCC3)CC1)C2 ZINC001168719147 1044409684 /nfs/dbraw/zinc/40/96/84/1044409684.db2.gz UYAWVCYYPGIPQX-QFBILLFUSA-N 2 0 344.930 4.218 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCC(C)(C)c2ccccc2)[C@@H](C)C1 ZINC000675770732 1044484361 /nfs/dbraw/zinc/48/43/61/1044484361.db2.gz YLVAVAKSBPVVMV-FPOVZHCZSA-N 2 0 346.559 4.081 20 0 EIADRP CCC[C@@H]([NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccccn1 ZINC000675817958 1044515793 /nfs/dbraw/zinc/51/57/93/1044515793.db2.gz ZHIYONBCPOHGQS-LAUBAEHRSA-N 2 0 341.499 4.214 20 0 EIADRP C[C@@H]1C[C@@H](n2ncc3cccc(C[NH3+])c32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168022528 1044521048 /nfs/dbraw/zinc/52/10/48/1044521048.db2.gz TXBBNVBDPWLRSE-UPHUGPLXSA-N 2 0 348.494 4.109 20 0 EIADRP C[C@@H]1CC(n2ncc3cccc(C[NH3+])c32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168022526 1044521171 /nfs/dbraw/zinc/52/11/71/1044521171.db2.gz TXBBNVBDPWLRSE-IAGOWNOFSA-N 2 0 348.494 4.109 20 0 EIADRP C[NH+](C)CC1(C[NH2+][C@@H](C[C@H]2CCOC2)c2ccc(F)cc2)CCCC1 ZINC000494943709 1044529075 /nfs/dbraw/zinc/52/90/75/1044529075.db2.gz ZDOMUQYNKXAKRG-XLIONFOSSA-N 2 0 348.506 4.005 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)c1ccc(F)cc1Cl)C1CC[NH+](C)CC1 ZINC000675878316 1044550457 /nfs/dbraw/zinc/55/04/57/1044550457.db2.gz RZXDNIQOUSIOQV-CYBMUJFWSA-N 2 0 326.887 4.077 20 0 EIADRP CS[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C(C)(C)C ZINC000543411863 1044552603 /nfs/dbraw/zinc/55/26/03/1044552603.db2.gz BZWRZFFEHJLASS-YTQUADARSA-N 2 0 334.573 4.407 20 0 EIADRP C[C@H](CC[NH2+][C@H](C[C@@H]1CCOC1)c1ccc(F)cc1)[NH+]1CCCCC1 ZINC000494976018 1044553378 /nfs/dbraw/zinc/55/33/78/1044553378.db2.gz OGVBHQSADHXCLF-LVCYWYKZSA-N 2 0 348.506 4.148 20 0 EIADRP C[C@H](CC[NH2+][C@@H](C)c1ccc(OC(F)F)cc1)[NH+]1CCCCC1 ZINC000543417861 1044561542 /nfs/dbraw/zinc/56/15/42/1044561542.db2.gz FZHYGVRDAUYLEX-CABCVRRESA-N 2 0 326.431 4.203 20 0 EIADRP COc1ccc2nc(C[NH2+]CCCCC[NH+]3CCCCC3)sc2c1 ZINC000474362443 1044883884 /nfs/dbraw/zinc/88/38/84/1044883884.db2.gz JGKLJBOKUKWPNV-UHFFFAOYSA-N 2 0 347.528 4.051 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2scnc2C2CC2)cc1 ZINC000486936223 1045222018 /nfs/dbraw/zinc/22/20/18/1045222018.db2.gz NBWKNGXOIRAOGU-UHFFFAOYSA-N 2 0 329.513 4.152 20 0 EIADRP Clc1sccc1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000397518528 1045600235 /nfs/dbraw/zinc/60/02/35/1045600235.db2.gz TUUFKSYJHVTAGM-UHFFFAOYSA-N 2 0 334.916 4.403 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1cccc(F)c1 ZINC000397545086 1045631732 /nfs/dbraw/zinc/63/17/32/1045631732.db2.gz NRXJFCMXBKBHHQ-KRWDZBQOSA-N 2 0 326.459 4.389 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@H]3CCOC4(CCCC4)C3)CC2)C1 ZINC000246890812 1045833099 /nfs/dbraw/zinc/83/30/99/1045833099.db2.gz MATZZTSUOAOGQV-YZGWKJHDSA-N 2 0 334.548 4.111 20 0 EIADRP C[C@@H](CC(C)(C)c1ccccc1)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459389387 1045834067 /nfs/dbraw/zinc/83/40/67/1045834067.db2.gz NKHFMQANSTWXPI-SFHVURJKSA-N 2 0 337.511 4.396 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1cnn(C)c1 ZINC000247210522 1045843440 /nfs/dbraw/zinc/84/34/40/1045843440.db2.gz WXIFTLYPYRJPKO-DYESRHJHSA-N 2 0 340.515 4.035 20 0 EIADRP CCc1noc(C)c1[C@H](C)[NH2+]Cc1ccc(C[NH+](CC)CC)cc1 ZINC000769866499 1046083676 /nfs/dbraw/zinc/08/36/76/1046083676.db2.gz GFWQIUFGMRHKRO-HNNXBMFYSA-N 2 0 329.488 4.238 20 0 EIADRP CCc1noc(C)c1[C@H](C)[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000769867255 1046086227 /nfs/dbraw/zinc/08/62/27/1046086227.db2.gz JFBIELGINBPJJC-INIZCTEOSA-N 2 0 341.499 4.382 20 0 EIADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000261658764 1046132231 /nfs/dbraw/zinc/13/22/31/1046132231.db2.gz BLLDDEIDVFBFJL-YJBOKZPZSA-N 2 0 344.449 4.156 20 0 EIADRP COc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000123706465 1046194213 /nfs/dbraw/zinc/19/42/13/1046194213.db2.gz RJOHPIDEVPQDHN-CQSZACIVSA-N 2 0 332.875 4.261 20 0 EIADRP CCC(C)(C)[NH2+][C@@H](C)C(=O)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000476006311 1046195095 /nfs/dbraw/zinc/19/50/95/1046195095.db2.gz BCSIFLTXAXHIBN-IRXDYDNUSA-N 2 0 345.531 4.166 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cc3cc(OC)ccc3o2)c1 ZINC000125000781 1046278612 /nfs/dbraw/zinc/27/86/12/1046278612.db2.gz VPTKBIZSACRUJD-UHFFFAOYSA-N 2 0 338.451 4.183 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)[C@@H](C)c2nc3ccccc3s2)C1 ZINC000125857521 1046356297 /nfs/dbraw/zinc/35/62/97/1046356297.db2.gz JGIVLSNKGKSIEI-IXDOHACOSA-N 2 0 345.556 4.498 20 0 EIADRP Cc1cc(N2CCC[C@H]([NH+](C)C)CC2)c2cc(Cl)cc(C)c2[nH+]1 ZINC000428669402 1046510151 /nfs/dbraw/zinc/51/01/51/1046510151.db2.gz JZIZJYRCJOPUAF-INIZCTEOSA-N 2 0 331.891 4.426 20 0 EIADRP C[C@H]([N@H+](C)Cc1ccccc1N(C)C1CC[NH+](C)CC1)C(C)(C)C ZINC000536655869 1046602522 /nfs/dbraw/zinc/60/25/22/1046602522.db2.gz BTHLHEPXCHMRDA-KRWDZBQOSA-N 2 0 331.548 4.083 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(OC)c3ccccc23)[C@@H](C)C1 ZINC000536682575 1046646484 /nfs/dbraw/zinc/64/64/84/1046646484.db2.gz YTJIHQCDTSXIMP-JXFKEZNVSA-N 2 0 326.484 4.011 20 0 EIADRP FC(F)(F)[C@H]1CCC[C@H](C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000459428616 1046662430 /nfs/dbraw/zinc/66/24/30/1046662430.db2.gz OUQOVBISLUBZND-GJZGRUSLSA-N 2 0 341.421 4.009 20 0 EIADRP CC[C@H](CSc1ccccc1)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459456716 1046692390 /nfs/dbraw/zinc/69/23/90/1046692390.db2.gz WZJAJUMVROZSAC-QGZVFWFLSA-N 2 0 341.524 4.211 20 0 EIADRP C[C@H](C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000536703789 1046704024 /nfs/dbraw/zinc/70/40/24/1046704024.db2.gz YQTJWQSGBYNGLK-LJQANCHMSA-N 2 0 337.511 4.424 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(F)c(Cl)c1 ZINC000536860570 1046828083 /nfs/dbraw/zinc/82/80/83/1046828083.db2.gz YXDMWRCWYDDBLW-KFWWJZLASA-N 2 0 342.886 4.019 20 0 EIADRP C[C@@H](CCCc1cccnc1)[NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1 ZINC000459645832 1046832992 /nfs/dbraw/zinc/83/29/92/1046832992.db2.gz HOZDBUYPELEKMM-XQBPLPMBSA-N 2 0 343.559 4.426 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@H]1c1ccccc1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000459730171 1046865304 /nfs/dbraw/zinc/86/53/04/1046865304.db2.gz LNWYHFCAVKASNX-DCZASFAJSA-N 2 0 338.470 4.182 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C3CCC(C(F)F)CC3)CC2)C1 ZINC000459713202 1046868049 /nfs/dbraw/zinc/86/80/49/1046868049.db2.gz NZJYVQDSHMUDJQ-IDMDMSBLSA-N 2 0 328.491 4.443 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000459737544 1046876249 /nfs/dbraw/zinc/87/62/49/1046876249.db2.gz RLPZZZNVIMRBKH-IBGZPJMESA-N 2 0 338.495 4.184 20 0 EIADRP Cc1c([C@@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)cnn1C(C)C ZINC000786915853 1046881329 /nfs/dbraw/zinc/88/13/29/1046881329.db2.gz OHWFPQKUHZSLAQ-IPJUCJBFSA-N 2 0 332.536 4.220 20 0 EIADRP CC(C)[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000536998061 1046889687 /nfs/dbraw/zinc/88/96/87/1046889687.db2.gz CYABIDFZTKQNEC-YOEHRIQHSA-N 2 0 328.422 4.334 20 0 EIADRP Cc1cccc(O[C@H]2CCCC[C@@H]2[NH2+]C2CC[NH+](CC3CC3)CC2)c1 ZINC000537095019 1046943905 /nfs/dbraw/zinc/94/39/05/1046943905.db2.gz GRGOZWXPHOGJSD-VXKWHMMOSA-N 2 0 342.527 4.149 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2cc3cccc(OC)c3o2)CC1 ZINC000537294002 1047074847 /nfs/dbraw/zinc/07/48/47/1047074847.db2.gz PVIJCCYQLFXRCY-HNNXBMFYSA-N 2 0 330.472 4.214 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000497839064 1047114750 /nfs/dbraw/zinc/11/47/50/1047114750.db2.gz FTLPMRFFWXGHGJ-UWJYYQICSA-N 2 0 330.491 4.472 20 0 EIADRP Clc1ccc2c(n1)CC[C@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000806128392 1047153212 /nfs/dbraw/zinc/15/32/12/1047153212.db2.gz QSSBCYQLDDGBII-GOSISDBHSA-N 2 0 341.886 4.108 20 0 EIADRP FC(F)(F)c1cnc(C[NH2+]C2CCC([NH+]3CCCCC3)CC2)s1 ZINC000788522800 1047213440 /nfs/dbraw/zinc/21/34/40/1047213440.db2.gz XICHNQXCGSMQFR-UHFFFAOYSA-N 2 0 347.450 4.049 20 0 EIADRP CC(C)[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@@H](O)c1ccccc1 ZINC000788622279 1047251726 /nfs/dbraw/zinc/25/17/26/1047251726.db2.gz QPYNIWDAVGRGJV-VXKWHMMOSA-N 2 0 344.543 4.131 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000508780797 1047270228 /nfs/dbraw/zinc/27/02/28/1047270228.db2.gz VTQKBRIKDSWXSU-MNDPQUGUSA-N 2 0 344.543 4.290 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000508780795 1047271002 /nfs/dbraw/zinc/27/10/02/1047271002.db2.gz VTQKBRIKDSWXSU-KNTRCKAVSA-N 2 0 344.543 4.290 20 0 EIADRP COc1ccc(CCC[NH2+][C@H]2CCN(C)[C@H](c3ccccc3)C2)cc1 ZINC000556058600 1047421446 /nfs/dbraw/zinc/42/14/46/1047421446.db2.gz ABNDWSSEBUJJAJ-UNMCSNQZSA-N 2 0 338.495 4.053 20 0 EIADRP C[C@H]([NH2+][C@H]1CCSC(C)(C)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000897796004 1047485450 /nfs/dbraw/zinc/48/54/50/1047485450.db2.gz VUSHWYNCVIPERR-WDSOQIARSA-N 2 0 332.557 4.161 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000129725737 1047496031 /nfs/dbraw/zinc/49/60/31/1047496031.db2.gz JZQMFMKZEQMDBW-IRXDYDNUSA-N 2 0 328.422 4.349 20 0 EIADRP C[NH+]1CCC(C[NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)CC1 ZINC000790079988 1047507981 /nfs/dbraw/zinc/50/79/81/1047507981.db2.gz IQMVLRQVPNDOPI-UHFFFAOYSA-N 2 0 326.406 4.016 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000129861780 1047518443 /nfs/dbraw/zinc/51/84/43/1047518443.db2.gz RWYWXPRYSIXQFK-WIYYLYMNSA-N 3 0 343.559 4.023 20 0 EIADRP COc1cccc(C[N@@H+]2CCC3(C2)CC[NH+]([C@H]2CC[C@@H](C)C2)CC3)c1 ZINC001170136347 1047590024 /nfs/dbraw/zinc/59/00/24/1047590024.db2.gz JUMFUVWXXICUSI-QUCCMNQESA-N 2 0 342.527 4.172 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1cc(Br)cs1 ZINC000556232499 1047597840 /nfs/dbraw/zinc/59/78/40/1047597840.db2.gz HYMYJYKQGKOSGX-ZDUSSCGKSA-N 2 0 345.350 4.427 20 0 EIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC[C@H]1C1CCOCC1 ZINC000537511244 1047656689 /nfs/dbraw/zinc/65/66/89/1047656689.db2.gz UOLHJYJGWLCPDN-NRFANRHFSA-N 2 0 344.543 4.036 20 0 EIADRP C[NH+](C)C1CCC([NH2+]C2(c3ccccc3C(F)(F)F)CC2)CC1 ZINC001168300291 1047705424 /nfs/dbraw/zinc/70/54/24/1047705424.db2.gz SOJZQCGPQWZBLR-UHFFFAOYSA-N 2 0 326.406 4.157 20 0 EIADRP C[C@@H]1CCCC[C@H]1C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556404281 1047738234 /nfs/dbraw/zinc/73/82/34/1047738234.db2.gz PALZLCWOESVCNY-MJGOQNOKSA-N 2 0 330.516 4.076 20 0 EIADRP CC[C@H]1CCC[C@@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C1 ZINC000556408869 1047739561 /nfs/dbraw/zinc/73/95/61/1047739561.db2.gz HKGJGRUBRUMSHW-PKOBYXMFSA-N 2 0 330.516 4.218 20 0 EIADRP CC[C@@H]1CCC[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C1 ZINC000556408868 1047740192 /nfs/dbraw/zinc/74/01/92/1047740192.db2.gz HKGJGRUBRUMSHW-MJGOQNOKSA-N 2 0 330.516 4.218 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H](c2ccnc(C(F)(F)F)c2)C2CC2)CC1 ZINC001168305289 1047763542 /nfs/dbraw/zinc/76/35/42/1047763542.db2.gz HAOPHIBOWNMASH-DQPZFDDXSA-N 2 0 341.421 4.014 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)c1 ZINC000046836848 1047815761 /nfs/dbraw/zinc/81/57/61/1047815761.db2.gz FPEFDKAHTWNGNT-UHFFFAOYSA-N 2 0 338.426 4.437 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@@]3(C)CC3(Cl)Cl)CC2)C1 ZINC000824773953 1047928494 /nfs/dbraw/zinc/92/84/94/1047928494.db2.gz PJOOTBHUOGUAEB-FVQBIDKESA-N 2 0 333.347 4.203 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C[C@]2(C)CC2(Cl)Cl)CC[N@@H+]1Cc1ccccc1 ZINC000824775053 1047933289 /nfs/dbraw/zinc/93/32/89/1047933289.db2.gz XRDHYLLTENEGDE-PVAVHDDUSA-N 2 0 341.326 4.213 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C[C@]2(C)CC2(Cl)Cl)CC[N@@H+]1Cc1ccccc1 ZINC000824775052 1047934959 /nfs/dbraw/zinc/93/49/59/1047934959.db2.gz XRDHYLLTENEGDE-OIISXLGYSA-N 2 0 341.326 4.213 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c(C)c1OC ZINC000556871739 1048089092 /nfs/dbraw/zinc/08/90/92/1048089092.db2.gz WSCZTVCTFHVERA-YJBOKZPZSA-N 2 0 336.520 4.029 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2csc(-c3ccccc3)n2)CC1 ZINC000556873819 1048093816 /nfs/dbraw/zinc/09/38/16/1048093816.db2.gz MAZOVGFLVKXCQG-HNNXBMFYSA-N 2 0 329.513 4.193 20 0 EIADRP Cc1cncc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000556884236 1048100732 /nfs/dbraw/zinc/10/07/32/1048100732.db2.gz HNESLWXSUKDJBL-DNVJHFABSA-N 2 0 349.522 4.170 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CCc2nc(C3CCCCC3)cs2)[C@@H]2CCC[C@@H]21 ZINC000556886248 1048108245 /nfs/dbraw/zinc/10/82/45/1048108245.db2.gz KDZMNKMJCSMBSV-LNLFQRSKSA-N 2 0 347.572 4.196 20 0 EIADRP CSC1(C[NH2+]C2CC(c3ccccc3Cl)C2)CC[NH+](C)CC1 ZINC000556879349 1048111308 /nfs/dbraw/zinc/11/13/08/1048111308.db2.gz YAIXSHKKRZXLEM-UHFFFAOYSA-N 2 0 338.948 4.003 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CC(C)(C)OC2(C)C)CC1 ZINC000556893307 1048140172 /nfs/dbraw/zinc/14/01/72/1048140172.db2.gz UEHMAOCQFRSXNY-SOAGJPPSSA-N 2 0 344.543 4.365 20 0 EIADRP C[NH+]1CCC(CC[NH2+][C@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171133961 1048411567 /nfs/dbraw/zinc/41/15/67/1048411567.db2.gz RXCIBOKJHXJROD-INIZCTEOSA-N 2 0 341.326 4.172 20 0 EIADRP C[NH+](C)CCCCC[NH2+][C@@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171138392 1048416620 /nfs/dbraw/zinc/41/66/20/1048416620.db2.gz CLCNMLIFRHWAGG-OAHLLOKOSA-N 2 0 329.315 4.172 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171144820 1048449425 /nfs/dbraw/zinc/44/94/25/1048449425.db2.gz RTKQYLNRVYBLQP-MRXNPFEDSA-N 2 0 341.326 4.172 20 0 EIADRP CCc1cc(C[N@H+](C2CCCC2)C2CCN(C)CC2)cc(CC)c1O ZINC001144149610 1048460291 /nfs/dbraw/zinc/46/02/91/1048460291.db2.gz JSEKWHWHCVEADX-UHFFFAOYSA-N 2 0 344.543 4.356 20 0 EIADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCc3cc(Cl)c(Cl)cc3C2)C1 ZINC001171149491 1048482124 /nfs/dbraw/zinc/48/21/24/1048482124.db2.gz WOBJQIPDRAGXTI-OWCLPIDISA-N 2 0 341.326 4.313 20 0 EIADRP Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1ccc(-n2ccnc2)c(F)c1 ZINC000815565114 1048513070 /nfs/dbraw/zinc/51/30/70/1048513070.db2.gz CVCRRTHJIFBCOJ-AWEZNQCLSA-N 2 0 327.378 4.310 20 0 EIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccc(SC(F)F)cc3)C2)CC1 ZINC000809754760 1048520288 /nfs/dbraw/zinc/52/02/88/1048520288.db2.gz ANKHPTJUDZVQPL-INIZCTEOSA-N 2 0 340.483 4.165 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+][C@@H]3CCCOCC3)[C@H](C)C2)CC[C@H]1[NH3+] ZINC001170793292 1048520978 /nfs/dbraw/zinc/52/09/78/1048520978.db2.gz XZMUMOWOUKDTHA-SUZJGXHKSA-N 2 0 336.564 4.104 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1 ZINC000844904755 1048539735 /nfs/dbraw/zinc/53/97/35/1048539735.db2.gz PZTDQLDEIUZHKF-UHFFFAOYSA-N 2 0 342.792 4.368 20 0 EIADRP Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3ccc([C@H]4CCC[NH2+]4)cc3)c2c1 ZINC001171169625 1048622201 /nfs/dbraw/zinc/62/22/01/1048622201.db2.gz QMKMZAYAFHTIJW-IIBYNOLFSA-N 2 0 333.479 4.253 20 0 EIADRP CSc1ccc2cc(C[NH+]3CCC(CC[NH3+])CC3)c(Cl)nc2c1 ZINC000846225052 1048843459 /nfs/dbraw/zinc/84/34/59/1048843459.db2.gz FYVOGAJITAQBLX-UHFFFAOYSA-N 2 0 349.931 4.171 20 0 EIADRP C[N@@H+](Cc1cccc2cccnc21)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076109859 1048854562 /nfs/dbraw/zinc/85/45/62/1048854562.db2.gz CCESCVNXHYZSKE-FQEVSTJZSA-N 2 0 345.490 4.189 20 0 EIADRP Cc1cc(F)ccc1-c1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)o1 ZINC000237098283 1048884753 /nfs/dbraw/zinc/88/47/53/1048884753.db2.gz UCKHZGCZAWEZFB-AYHJJNSGSA-N 2 0 342.458 4.499 20 0 EIADRP c1ccc([C@@H]2OCC[C@H]2C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000191852969 1048982743 /nfs/dbraw/zinc/98/27/43/1048982743.db2.gz GNASTVXSULYUEZ-UGKGYDQZSA-N 2 0 342.527 4.151 20 0 EIADRP c1cc2c(s1)CC[NH+](CCCC[N@@H+]1CCc3sccc3C1)C2 ZINC000077248307 1048998690 /nfs/dbraw/zinc/99/86/90/1048998690.db2.gz XZUFNPCMXLYSHU-UHFFFAOYSA-N 2 0 332.538 4.006 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CCC[NH2+]C(C)C)ccc1SC(F)F ZINC000817953963 1049066844 /nfs/dbraw/zinc/06/68/44/1049066844.db2.gz SZQATLQYEKLPAE-GFCCVEGCSA-N 2 0 332.460 4.049 20 0 EIADRP Cc1cc(Cl)c2c(c1)[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)CCCO2 ZINC000817950279 1049067175 /nfs/dbraw/zinc/06/71/75/1049067175.db2.gz XQWVEDYKZPTWKZ-LJQANCHMSA-N 2 0 344.886 4.153 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(SC(F)F)cc1 ZINC000817967985 1049072215 /nfs/dbraw/zinc/07/22/15/1049072215.db2.gz DQVAOHXAJUYRAQ-LBPRGKRZSA-N 2 0 334.435 4.455 20 0 EIADRP FC(F)Sc1ccc2c(c1)CCC[C@@H]2[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000817976645 1049075962 /nfs/dbraw/zinc/07/59/62/1049075962.db2.gz QCXMIIYYSZTLHQ-HOTGVXAUSA-N 2 0 338.467 4.110 20 0 EIADRP COc1cc(C)c([C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1C ZINC000817982856 1049078590 /nfs/dbraw/zinc/07/85/90/1049078590.db2.gz IRWCKGUGDSAVRA-XLIONFOSSA-N 2 0 326.484 4.443 20 0 EIADRP Fc1ccccc1CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000135257584 1049096390 /nfs/dbraw/zinc/09/63/90/1049096390.db2.gz SSFBICODDTUSFK-SEJPIABJSA-N 2 0 338.470 4.153 20 0 EIADRP [NH3+]CCC[C@H]([NH3+])Nc1c(-c2ccccc2)cccc1-c1ccccc1 ZINC001170898532 1049127692 /nfs/dbraw/zinc/12/76/92/1049127692.db2.gz CXJWRROXYCNSFG-OAQYLSRUSA-N 2 0 331.463 4.456 20 0 EIADRP COc1ccc([C@@H](C)[NH2+][C@@H]2C[C@H]3C[C@H]3C2)cc1C[NH+]1CCCCC1 ZINC000818359347 1049150698 /nfs/dbraw/zinc/15/06/98/1049150698.db2.gz JKPZWVDIZLATGO-PHXBYCTMSA-N 2 0 328.500 4.130 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+][C@H]1CCc2cc(F)cc(F)c2C1)c1ccccc1 ZINC001170657878 1049343726 /nfs/dbraw/zinc/34/37/26/1049343726.db2.gz HICFQHHXLDIOAL-RXVVDRJESA-N 2 0 344.449 4.105 20 0 EIADRP C[NH+](C)CC[C@@H]([NH2+][C@@H]1CCc2c(F)cc(F)cc2C1)c1ccccc1 ZINC001171335786 1049355580 /nfs/dbraw/zinc/35/55/80/1049355580.db2.gz ATQNHPUSZQFFND-WIYYLYMNSA-N 2 0 344.449 4.105 20 0 EIADRP Fc1cccc2c1C[C@H]([NH2+]CC1CC[NH+](C3CCCCC3)CC1)CC2 ZINC001170955128 1049575181 /nfs/dbraw/zinc/57/51/81/1049575181.db2.gz JRAQNJLPFKOPJN-LJQANCHMSA-N 2 0 344.518 4.317 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1CCc2c(F)cccc2C1 ZINC001171439396 1049692238 /nfs/dbraw/zinc/69/22/38/1049692238.db2.gz YKEDZPQBCRVPBI-IPMKNSEASA-N 2 0 330.491 4.022 20 0 EIADRP FC1(F)CCC[C@@H]1C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716704538 1049701788 /nfs/dbraw/zinc/70/17/88/1049701788.db2.gz GIHUGJXMZINIDQ-MANSERQUSA-N 2 0 334.454 4.065 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CCc2cc(F)c(F)c(F)c2C1 ZINC001171505596 1049738570 /nfs/dbraw/zinc/73/85/70/1049738570.db2.gz KHDFLCBSIDPHLF-DZGCQCFKSA-N 2 0 342.449 4.061 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc(OC(F)(F)F)cc2)CC1(C)C ZINC001171619783 1049766323 /nfs/dbraw/zinc/76/63/23/1049766323.db2.gz PZAGDCXOJZTEHB-UHFFFAOYSA-N 2 0 344.421 4.326 20 0 EIADRP C[NH+]1C(C)(C)CC(n2cc(CCC[NH3+])c3ccccc32)CC1(C)C ZINC001171621584 1049766677 /nfs/dbraw/zinc/76/66/77/1049766677.db2.gz NVPUFUKQQIRLEU-UHFFFAOYSA-N 2 0 327.516 4.357 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@H]2CCC[C@@H]2OCc2ccccc2)CC1(C)C ZINC001171622873 1049767609 /nfs/dbraw/zinc/76/76/09/1049767609.db2.gz AWOUMGDUJHSJLQ-PMACEKPBSA-N 2 0 344.543 4.365 20 0 EIADRP CSc1ccc(OCC[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1 ZINC001171624480 1049768373 /nfs/dbraw/zinc/76/83/73/1049768373.db2.gz SNQGCFVBGNUSPL-UHFFFAOYSA-N 2 0 336.545 4.028 20 0 EIADRP COc1ccccc1CC1([NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)CC1 ZINC001171627566 1049769316 /nfs/dbraw/zinc/76/93/16/1049769316.db2.gz WXJIJZHPJAXDLZ-UHFFFAOYSA-N 2 0 330.516 4.011 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CC2(Cc3ccccn3)CCC2)CC1(C)C ZINC001171627333 1049769534 /nfs/dbraw/zinc/76/95/34/1049769534.db2.gz PUCVQBMYHNWHKG-UHFFFAOYSA-N 2 0 329.532 4.035 20 0 EIADRP Cc1ccc(CC[C@@H](C)[NH2+]CC2CC[NH+](CC3CCC3)CC2)cc1 ZINC001171666919 1049772696 /nfs/dbraw/zinc/77/26/96/1049772696.db2.gz SAPNSTYOXSIYHP-LJQANCHMSA-N 2 0 328.544 4.418 20 0 EIADRP CCC(CC)C[N@H+](C)Cc1ccc(C[NH+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC001171636431 1049776928 /nfs/dbraw/zinc/77/69/28/1049776928.db2.gz OGPYMDUOWMZGAU-HDICACEKSA-N 2 0 332.532 4.164 20 0 EIADRP C[NH2+]Cc1cn(C2CC(C)(C)[NH+](C)C(C)(C)C2)c2ccc(C)cc12 ZINC001171641085 1049778501 /nfs/dbraw/zinc/77/85/01/1049778501.db2.gz CHORJQPQRMODPM-UHFFFAOYSA-N 2 0 327.516 4.493 20 0 EIADRP COc1ccc([C@@H]2CCC[N@@H+]2C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1 ZINC001171637891 1049778597 /nfs/dbraw/zinc/77/85/97/1049778597.db2.gz RFFPGFWIMOVNKM-IBGZPJMESA-N 2 0 330.516 4.484 20 0 EIADRP COC1(c2ccccc2)CC[NH+](C2CC(C)(C)[NH+](C)C(C)(C)C2)CC1 ZINC001171642758 1049780480 /nfs/dbraw/zinc/78/04/80/1049780480.db2.gz MHBZPMADNYQXTA-UHFFFAOYSA-N 2 0 344.543 4.276 20 0 EIADRP Oc1cccc(CNC2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000813790786 1049817918 /nfs/dbraw/zinc/81/79/18/1049817918.db2.gz YAQXKGLSUKHFPH-SEJPIABJSA-N 2 0 336.479 4.068 20 0 EIADRP CC(C)[NH+]1CCC(C[NH2+][C@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001171959125 1049822232 /nfs/dbraw/zinc/82/22/32/1049822232.db2.gz QRKXZZYGHAMBLG-OAHLLOKOSA-N 2 0 342.449 4.346 20 0 EIADRP CC1(C)C[C@H](Nc2ccc(CC[NH3+])cc2)CC[N@@H+]1Cc1ccccc1 ZINC001171961740 1049824576 /nfs/dbraw/zinc/82/45/76/1049824576.db2.gz AMTPLZIVIPHRGY-OAQYLSRUSA-N 2 0 337.511 4.043 20 0 EIADRP CC1(C)C[C@@H]([NH2+]C2Cc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001171962346 1049825262 /nfs/dbraw/zinc/82/52/62/1049825262.db2.gz COAWYPCSPPPLFJ-NRFANRHFSA-N 2 0 334.507 4.187 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[N@@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001171966401 1049826403 /nfs/dbraw/zinc/82/64/03/1049826403.db2.gz VBEFQJBELLSBHQ-DOTOQJQBSA-N 2 0 342.449 4.477 20 0 EIADRP CC1(C)C[C@H]([NH+]2CC[C@@H](C(F)(F)F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171987846 1049840537 /nfs/dbraw/zinc/84/05/37/1049840537.db2.gz KOOYREGVYRUNKH-IAGOWNOFSA-N 2 0 340.433 4.314 20 0 EIADRP CCOCC1CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171986314 1049841115 /nfs/dbraw/zinc/84/11/15/1049841115.db2.gz HEXJOEJKONIIOQ-OAQYLSRUSA-N 2 0 344.543 4.178 20 0 EIADRP CC(C)(C)[PH+](CCC[NH2+][C@H]1CCN(C2CC2)C(=O)C1)C(C)(C)C ZINC001172016214 1049842301 /nfs/dbraw/zinc/84/23/01/1049842301.db2.gz SAGYSCXZCAZQRE-HNNXBMFYSA-N 2 0 340.492 4.198 20 0 EIADRP CS[C@@H]1CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000245738942 1049844537 /nfs/dbraw/zinc/84/45/37/1049844537.db2.gz RFUHKMZCLCDMOQ-ALGQRKQJSA-N 2 0 344.568 4.446 20 0 EIADRP CS[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000245738954 1049845007 /nfs/dbraw/zinc/84/50/07/1049845007.db2.gz RFUHKMZCLCDMOQ-SSSFQFABSA-N 2 0 344.568 4.446 20 0 EIADRP CC(C)([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccncc1 ZINC001172077401 1049846543 /nfs/dbraw/zinc/84/65/43/1049846543.db2.gz QXQIDDDCSUOZRJ-KOUNCHBCSA-N 2 0 349.522 4.492 20 0 EIADRP C[NH2+]Cc1cccc(N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172084276 1049847809 /nfs/dbraw/zinc/84/78/09/1049847809.db2.gz VRQWAMNNQVPIOP-NUNAXRQHSA-N 2 0 349.522 4.404 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCCC[C@H]1OCc1ccccc1)C2 ZINC001172098206 1049849874 /nfs/dbraw/zinc/84/98/74/1049849874.db2.gz BUXLJIZEAMZAEU-PVIWCNJMSA-N 2 0 342.527 4.119 20 0 EIADRP c1cc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)cs1 ZINC001172064440 1049851661 /nfs/dbraw/zinc/85/16/61/1049851661.db2.gz GBGFHMCZRLFEED-ACDBMABISA-N 2 0 326.509 4.423 20 0 EIADRP C[C@H](Cc1cccs1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245770363 1049852753 /nfs/dbraw/zinc/85/27/53/1049852753.db2.gz XEBGOLFGCFCYGV-RSPOEFSDSA-N 2 0 340.536 4.464 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCc1c(Cl)cccc1Cl)C2 ZINC001172102966 1049855422 /nfs/dbraw/zinc/85/54/22/1049855422.db2.gz RBUCNPBIXQSQLY-ZSOGYDGISA-N 2 0 327.299 4.141 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Br)s1 ZINC001172103744 1049855826 /nfs/dbraw/zinc/85/58/26/1049855826.db2.gz XDUHJBGCTDZDSX-FVCCEPFGSA-N 2 0 343.334 4.177 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCc1ccc(Cl)cc1Cl)C2 ZINC001172102439 1049856013 /nfs/dbraw/zinc/85/60/13/1049856013.db2.gz NCGATRVRSVEUJH-MUJYYYPQSA-N 2 0 327.299 4.141 20 0 EIADRP CN(Cc1ccc(Cl)cc1Cl)[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172112773 1049856334 /nfs/dbraw/zinc/85/63/34/1049856334.db2.gz FESJTKFZHUUUBZ-MUJYYYPQSA-N 2 0 327.299 4.441 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CC[C@@H](OCc3ccccc3)CC1)C2 ZINC001172110372 1049856877 /nfs/dbraw/zinc/85/68/77/1049856877.db2.gz LRLYPNARXJVHFH-MRWPOJJOSA-N 2 0 342.527 4.119 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](n1cc(C3CC[NH2+]CC3)c3ccccc31)C2 ZINC001172120925 1049858290 /nfs/dbraw/zinc/85/82/90/1049858290.db2.gz HRMYIYPYHACMCT-BWTSREIZSA-N 2 0 337.511 4.296 20 0 EIADRP COc1ccc(CC2(C[NH2+][C@@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4C)CCC2)cc1 ZINC001172110955 1049858822 /nfs/dbraw/zinc/85/88/22/1049858822.db2.gz MOZYXYLHYPPARU-OWZKRDHZSA-N 2 0 342.527 4.013 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+]C3C[C@H]4CC[C@@H](C3)O4)[C@@H](C)C2)CC[C@@H]1[NH3+] ZINC001172224582 1049867404 /nfs/dbraw/zinc/86/74/04/1049867404.db2.gz UJKCPLPHUNDJIV-REPHXLRBSA-N 2 0 348.575 4.244 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+]C3C[C@@H]4C=C[C@H](C3)O4)[C@H](C)C2)CC[C@@H]1[NH3+] ZINC001172235309 1049870692 /nfs/dbraw/zinc/87/06/92/1049870692.db2.gz XPPFTCOFIOIPJD-JZRHJFRBSA-N 2 0 346.559 4.020 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171033896 1049882204 /nfs/dbraw/zinc/88/22/04/1049882204.db2.gz QHVQDLHSGPDJCW-KURKYZTESA-N 2 0 334.935 4.440 20 0 EIADRP Clc1cnc2oc(C[NH2+]C3CCC([NH+]4CCCCC4)CC3)cc2c1 ZINC000823966428 1049888010 /nfs/dbraw/zinc/88/80/10/1049888010.db2.gz OILGDWZKXUNLGM-UHFFFAOYSA-N 2 0 347.890 4.368 20 0 EIADRP CC[C@@H](C)OCC[C@@H](C)[NH+]1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC001172340467 1049889258 /nfs/dbraw/zinc/88/92/58/1049889258.db2.gz KBARCGNPTXHPAJ-RTBURBONSA-N 2 0 332.532 4.177 20 0 EIADRP CC[C@H](CC(C)C)[NH+]1CCC2(CC[N@H+](Cc3cccnc3)C2)CC1 ZINC001172396479 1049907197 /nfs/dbraw/zinc/90/71/97/1049907197.db2.gz DFCJIUURFJMGCW-HXUWFJFHSA-N 2 0 329.532 4.194 20 0 EIADRP CC(C)OCC[C@H](C)[N@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172437570 1049912748 /nfs/dbraw/zinc/91/27/48/1049912748.db2.gz RKIXQVPGDRDMJT-WDSOQIARSA-N 2 0 336.495 4.101 20 0 EIADRP CC(C)OCC[C@H](C)[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001172459669 1049916914 /nfs/dbraw/zinc/91/69/14/1049916914.db2.gz KPSHRPILUNLAIX-BVSLBCMMSA-N 2 0 344.543 4.034 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@@H]1CCC[N@H+](C)CC1 ZINC001172577002 1049932447 /nfs/dbraw/zinc/93/24/47/1049932447.db2.gz QLAKXGGTKDLWKQ-TZMCWYRMSA-N 2 0 330.850 4.013 20 0 EIADRP CCN1CCC[C@H]1C[NH2+][C@H](C)CCc1c(F)cc(Cl)cc1F ZINC001172566243 1049935509 /nfs/dbraw/zinc/93/55/09/1049935509.db2.gz UVHAFHWYQIFJMM-OCCSQVGLSA-N 2 0 330.850 4.013 20 0 EIADRP FC1CC[NH+](C2CC[NH+]([C@@H]3CC[C@@H](c4ccccc4)C3)CC2)CC1 ZINC001172565126 1049935762 /nfs/dbraw/zinc/93/57/62/1049935762.db2.gz RMQVGTWXXGCUSB-WIYYLYMNSA-N 2 0 330.491 4.221 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC001172575651 1049942081 /nfs/dbraw/zinc/94/20/81/1049942081.db2.gz JOBGNSNWNYYBAT-UONOGXRCSA-N 2 0 344.877 4.261 20 0 EIADRP Clc1ccc2c(c1)C[C@@H]([NH2+]C1CC[NH+](C[C@@H]3CC=CCC3)CC1)C2 ZINC001172717000 1049963835 /nfs/dbraw/zinc/96/38/35/1049963835.db2.gz VAZPHKHLLIUKTF-IERDGZPVSA-N 2 0 344.930 4.218 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+][C@H]1Cc2ccc(Cl)cc2C1)c1ccccc1 ZINC001172708948 1049971354 /nfs/dbraw/zinc/97/13/54/1049971354.db2.gz QFIOGWLBLUPARM-PMACEKPBSA-N 2 0 328.887 4.090 20 0 EIADRP CC(C)(C)C[N@H+]([C@@H]1Cc2ccc(Cl)cc2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172711931 1049971978 /nfs/dbraw/zinc/97/19/78/1049971978.db2.gz JOMYPMSRUGFIGJ-GUDVDZBRSA-N 2 0 334.935 4.425 20 0 EIADRP CC[C@@H]1C[C@H](C)CC[C@H]1[NH2+]C1CCN([C@@H](C)c2ccncc2)CC1 ZINC000246547235 1049985305 /nfs/dbraw/zinc/98/53/05/1049985305.db2.gz WHFRBBYBBHCZOH-BMQTXXJKSA-N 2 0 329.532 4.411 20 0 EIADRP Cc1ccccc1[C@H](C)[NH2+]Cc1cccc(CN2CCO[C@@H](C)C2)c1 ZINC000246871827 1050003987 /nfs/dbraw/zinc/00/39/87/1050003987.db2.gz DMNJQWANWBTTDJ-OALUTQOASA-N 2 0 338.495 4.067 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248894212 1050083426 /nfs/dbraw/zinc/08/34/26/1050083426.db2.gz ZMTOUURPIPFELT-NLWGTHIKSA-N 2 0 334.548 4.111 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCc1nc(C2CCCCC2)cs1 ZINC000090046553 1050152589 /nfs/dbraw/zinc/15/25/89/1050152589.db2.gz MALQIVZUPVOWJJ-BFYDXBDKSA-N 2 0 335.561 4.052 20 0 EIADRP CC[NH+](CC)[C@H](CNCc1[nH+]c(C(C)C)n2ccccc12)CC(C)C ZINC001177209254 1050161117 /nfs/dbraw/zinc/16/11/17/1050161117.db2.gz KKRWIOLVMRXDEQ-SFHVURJKSA-N 2 0 344.547 4.304 20 0 EIADRP CC[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC001177191134 1050166655 /nfs/dbraw/zinc/16/66/55/1050166655.db2.gz LMWYGZZUIBWSQQ-FPOVZHCZSA-N 2 0 330.516 4.220 20 0 EIADRP COCc1c(C)cc(C)c(C[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)c1C ZINC001177299366 1050180156 /nfs/dbraw/zinc/18/01/56/1050180156.db2.gz PIYJOGSJLHIXSD-KRWDZBQOSA-N 2 0 346.559 4.360 20 0 EIADRP Cc1coc(C[NH2+]Cc2ccc(C[N@H+]3C[C@H](C)C[C@H](C)C3)cc2)c1 ZINC001177282843 1050187758 /nfs/dbraw/zinc/18/77/58/1050187758.db2.gz OCSPKTWVOLTSER-CALCHBBNSA-N 2 0 326.484 4.356 20 0 EIADRP C[C@@H](C[NH2+]Cc1ccc(-c2ccccc2F)s1)C[NH+]1CCCC1 ZINC001177328926 1050192575 /nfs/dbraw/zinc/19/25/75/1050192575.db2.gz VXYGVEYVVVINDZ-HNNXBMFYSA-N 2 0 332.488 4.376 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]CCCCC[NH+]1CCCC1 ZINC001172861360 1050198222 /nfs/dbraw/zinc/19/82/22/1050198222.db2.gz QNQASLPDYIVWLJ-HNNXBMFYSA-N 2 0 326.887 4.266 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC001172871042 1050208503 /nfs/dbraw/zinc/20/85/03/1050208503.db2.gz HLHKHJPXKCIEPW-HNNXBMFYSA-N 2 0 338.898 4.218 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1cccc(F)c1F ZINC000090963484 1050218280 /nfs/dbraw/zinc/21/82/80/1050218280.db2.gz ZNBNKCSLDIFSJP-LSDHHAIUSA-N 2 0 348.437 4.317 20 0 EIADRP CO[C@@H]1CCC[C@@H]([N@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172928122 1050238167 /nfs/dbraw/zinc/23/81/67/1050238167.db2.gz IXZRQQUZHITUAG-XRXFAXGQSA-N 2 0 330.516 4.025 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)CS1 ZINC001177529960 1050243296 /nfs/dbraw/zinc/24/32/96/1050243296.db2.gz WNSAWGXLMXIYMB-XLIONFOSSA-N 2 0 332.557 4.436 20 0 EIADRP CC[C@H](C[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1 ZINC001177668756 1050274594 /nfs/dbraw/zinc/27/45/94/1050274594.db2.gz CNHNQGRCNOUQAM-FCHUYYIVSA-N 2 0 336.523 4.334 20 0 EIADRP CCCOC1CCC([NH2+][C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)CC1 ZINC001173092095 1050283729 /nfs/dbraw/zinc/28/37/29/1050283729.db2.gz IVVUORPUCJZCFT-NTYOPAKOSA-N 2 0 344.543 4.367 20 0 EIADRP CCCOC1CCC([NH2+]CC2CC[NH+](CC3CCCC3)CC2)CC1 ZINC001173093766 1050285636 /nfs/dbraw/zinc/28/56/36/1050285636.db2.gz MVBVHHOWGCOHIJ-UHFFFAOYSA-N 2 0 336.564 4.216 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)CCO1 ZINC001177743001 1050291406 /nfs/dbraw/zinc/29/14/06/1050291406.db2.gz KBIJZEMOHDVQPY-YADHBBJMSA-N 2 0 344.543 4.212 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccc(OC(F)F)cc2)CC1 ZINC001173104285 1050305881 /nfs/dbraw/zinc/30/58/81/1050305881.db2.gz GLUSAYURMYFLKI-UHFFFAOYSA-N 2 0 326.431 4.031 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2(CCOC)CCC(F)(F)CC2)CC1 ZINC001173105721 1050308039 /nfs/dbraw/zinc/30/80/39/1050308039.db2.gz BZQFKARCGJODAN-UHFFFAOYSA-N 2 0 346.506 4.214 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@@H]2c2ccccc2OC)CC1 ZINC001173112658 1050309284 /nfs/dbraw/zinc/30/92/84/1050309284.db2.gz YVGOCGWRCCWNSL-AFMYVXGZSA-N 2 0 330.516 4.485 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCSC[C@H]2c2ccccc2)CC1 ZINC001173114540 1050310692 /nfs/dbraw/zinc/31/06/92/1050310692.db2.gz OGVIAEUERPWKGO-MHJFOBGBSA-N 2 0 332.557 4.430 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCN([C@H](C)c3ccccc3)CC2)CC1 ZINC001173115221 1050311563 /nfs/dbraw/zinc/31/15/63/1050311563.db2.gz ZMGHJEOVQYKFJH-JSRJAPPDSA-N 2 0 343.559 4.018 20 0 EIADRP CCc1ccc(C[C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC001173237248 1050395057 /nfs/dbraw/zinc/39/50/57/1050395057.db2.gz GPIMETLQGHZWRZ-WMZHIEFXSA-N 2 0 336.523 4.292 20 0 EIADRP CCSC[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC001173295230 1050398518 /nfs/dbraw/zinc/39/85/18/1050398518.db2.gz KDIDFQHYGLOBEE-OAHLLOKOSA-N 2 0 340.964 4.283 20 0 EIADRP CCSC[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC001173295226 1050399761 /nfs/dbraw/zinc/39/97/61/1050399761.db2.gz KCGWLKLGTUOGOG-OAHLLOKOSA-N 2 0 340.964 4.283 20 0 EIADRP CCSC[C@H](C)[NH+]1CCC2(CC[N@H+](Cc3cccs3)C2)CC1 ZINC001173303180 1050401380 /nfs/dbraw/zinc/40/13/80/1050401380.db2.gz FKPMXAKRRRHNRG-INIZCTEOSA-N 2 0 338.586 4.178 20 0 EIADRP CC(C)Oc1ccc(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC001178457723 1050475323 /nfs/dbraw/zinc/47/53/23/1050475323.db2.gz CGLPVPRKQIHJMJ-IEBWSBKVSA-N 2 0 330.516 4.216 20 0 EIADRP FC(F)(F)Cc1ccccc1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC001203255965 1050479720 /nfs/dbraw/zinc/47/97/20/1050479720.db2.gz ZXZMVTCJTLREMG-UHFFFAOYSA-N 2 0 340.433 4.003 20 0 EIADRP CCC[N@H+]1C[C@@H]2C[NH+](C3CCC4(CCc5ccccc54)CC3)C[C@@H]2C1 ZINC001173690878 1050544487 /nfs/dbraw/zinc/54/44/87/1050544487.db2.gz CENHUYCRFGJCRZ-CVFDLSLPSA-N 2 0 338.539 4.087 20 0 EIADRP C[N@@H+](Cc1cccc2[nH]ccc21)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000093337027 1050570912 /nfs/dbraw/zinc/57/09/12/1050570912.db2.gz LVBNOXXXJFINIM-LJQANCHMSA-N 2 0 333.479 4.122 20 0 EIADRP Fc1ccc(-c2ccc(C[NH2+]Cc3ccc4c[nH+]cn4c3)s2)cc1 ZINC001178916998 1050590926 /nfs/dbraw/zinc/59/09/26/1050590926.db2.gz SDGIXPCRJDZNOP-UHFFFAOYSA-N 2 0 337.423 4.492 20 0 EIADRP Cc1c(Cl)cccc1C[NH2+]C[C@@H]1C[N@@H+](C)C[C@H]1c1ccccc1 ZINC001179015739 1050610168 /nfs/dbraw/zinc/61/01/68/1050610168.db2.gz KYBLBPNDUXPGDW-MOPGFXCFSA-N 2 0 328.887 4.083 20 0 EIADRP COC[C@H](CC(C)(C)C)[NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC001179034367 1050621670 /nfs/dbraw/zinc/62/16/70/1050621670.db2.gz FCKNKYXZSNDFQU-PMACEKPBSA-N 2 0 344.543 4.224 20 0 EIADRP COC[C@@H](CC(C)(C)C)[NH2+][C@@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC001179034370 1050622272 /nfs/dbraw/zinc/62/22/72/1050622272.db2.gz FCKNKYXZSNDFQU-WOJBJXKFSA-N 2 0 344.543 4.224 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2cccc(-c3cccnc3)c2)CC1 ZINC000093688487 1050660851 /nfs/dbraw/zinc/66/08/51/1050660851.db2.gz GXBGKGAEGMHNSG-UHFFFAOYSA-N 2 0 337.511 4.302 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CS1 ZINC001179278755 1050671515 /nfs/dbraw/zinc/67/15/15/1050671515.db2.gz ZFEDYXIRDIDVRZ-YLJYHZDGSA-N 2 0 332.557 4.162 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2cc(F)cc(C(F)(F)F)c2)CC1 ZINC001179391607 1050689658 /nfs/dbraw/zinc/68/96/58/1050689658.db2.gz VTCCLJSTXIGISG-UHFFFAOYSA-N 2 0 332.385 4.197 20 0 EIADRP C[N@@H+](Cc1cccc(Oc2ccc(F)cc2)c1)CC1CC[NH+](C)CC1 ZINC001180001986 1050845212 /nfs/dbraw/zinc/84/52/12/1050845212.db2.gz HOQQRHSNZWVWGK-UHFFFAOYSA-N 2 0 342.458 4.392 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(Cl)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000152901028 1050880806 /nfs/dbraw/zinc/88/08/06/1050880806.db2.gz OSIPUDAVPJUUBW-OAHLLOKOSA-N 2 0 332.875 4.131 20 0 EIADRP CC(C)(C[NH+]1CCC(C[NH+]2CCCCCC2)CC1)Oc1ccccc1 ZINC001180125422 1050893019 /nfs/dbraw/zinc/89/30/19/1050893019.db2.gz ZEHKHJQEHGDIBP-UHFFFAOYSA-N 2 0 344.543 4.432 20 0 EIADRP Cc1cc(C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)cc(C)c1O ZINC001180225163 1050919170 /nfs/dbraw/zinc/91/91/70/1050919170.db2.gz OQAUJZYSHKCFLC-LJQANCHMSA-N 2 0 344.543 4.486 20 0 EIADRP CO[C@H](C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC001180350276 1050965954 /nfs/dbraw/zinc/96/59/54/1050965954.db2.gz XOTYMGOJWPLFAR-BVYCBKJFSA-N 2 0 344.543 4.082 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C2CCSCC2)cc1C[NH+]1CCCCC1 ZINC000183200667 1051020286 /nfs/dbraw/zinc/02/02/86/1051020286.db2.gz BCULLTSCEAWBKP-MRXNPFEDSA-N 2 0 348.556 4.227 20 0 EIADRP Cc1c[nH+]ccc1Nc1cccc2c1C[N@H+](C)C[C@H]2c1ccccc1 ZINC001174539260 1051032550 /nfs/dbraw/zinc/03/25/50/1051032550.db2.gz ZYAMRGYSWWXDOW-IBGZPJMESA-N 2 0 329.447 4.133 20 0 EIADRP CC(C)(C)[C@]1(C[N@@H+]2CCCSCC2)CC[NH+](Cc2ccccc2)C1 ZINC001180739736 1051070222 /nfs/dbraw/zinc/07/02/22/1051070222.db2.gz GVIAHDHXLKCABX-NRFANRHFSA-N 2 0 346.584 4.364 20 0 EIADRP C[C@H](CC[NH2+][C@@H](C)Cc1ccc(C(F)(F)F)cc1)[NH+]1CCCCC1 ZINC001180810303 1051087793 /nfs/dbraw/zinc/08/77/93/1051087793.db2.gz KZVSXISZRZMZFE-JKSUJKDBSA-N 2 0 342.449 4.491 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CCc2ccc(C)o2)ccc1OC ZINC000775373242 1051160915 /nfs/dbraw/zinc/16/09/15/1051160915.db2.gz PVZPTFOGVSWLIH-KRWDZBQOSA-N 2 0 344.499 4.332 20 0 EIADRP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+]CCN1CCCC(C)(C)C1 ZINC001181244102 1051182840 /nfs/dbraw/zinc/18/28/40/1051182840.db2.gz MRBWZECKULEPLX-OAHLLOKOSA-N 2 0 342.449 4.348 20 0 EIADRP C[C@H](Cc1ccc2c(c1)CCCC2)[NH2+]CCN1CCCC(C)(C)C1 ZINC001181243911 1051183093 /nfs/dbraw/zinc/18/30/93/1051183093.db2.gz LKSDUQXKTLGGSQ-GOSISDBHSA-N 2 0 328.544 4.208 20 0 EIADRP Clc1ccc([C@@H]2CC[C@H]([NH2+]CC3CC[NH+](C4CC4)CC3)C2)cc1 ZINC001181234166 1051190841 /nfs/dbraw/zinc/19/08/41/1051190841.db2.gz HWJPFHFCKJAPLH-MJGOQNOKSA-N 2 0 332.919 4.440 20 0 EIADRP CC[NH+]1CCC(C[NH+]2CCC(C)(c3ccc(Cl)cc3)CC2)CC1 ZINC001181361591 1051210415 /nfs/dbraw/zinc/21/04/15/1051210415.db2.gz SLCICOPCPMYPDA-UHFFFAOYSA-N 2 0 334.935 4.425 20 0 EIADRP CC(C)[N@H+](CC[C@@H]1CCC[NH+]1C)Cc1cccc(C(F)(F)F)c1 ZINC001190661407 1051236677 /nfs/dbraw/zinc/23/66/77/1051236677.db2.gz SEQDIYCDXGBEJX-KRWDZBQOSA-N 2 0 328.422 4.400 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)C1 ZINC000163218180 1051240195 /nfs/dbraw/zinc/24/01/95/1051240195.db2.gz REBSPULOAJQHLZ-ZFWWWQNUSA-N 2 0 347.503 4.250 20 0 EIADRP C[C@H](NC1(C[NH2+][C@@H](C)c2cccs2)CCOCC1)c1ccccc1 ZINC000153916909 1051245548 /nfs/dbraw/zinc/24/55/48/1051245548.db2.gz KVYWEWSIDCLBLB-IRXDYDNUSA-N 2 0 344.524 4.299 20 0 EIADRP C[C@@H](NC1(C[NH2+][C@@H](C)c2cccs2)CCOCC1)c1ccccc1 ZINC000153917020 1051246928 /nfs/dbraw/zinc/24/69/28/1051246928.db2.gz KVYWEWSIDCLBLB-SJORKVTESA-N 2 0 344.524 4.299 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H]2CC=CCC2)cc1C[NH+]1CCCCC1 ZINC000775412107 1051275049 /nfs/dbraw/zinc/27/50/49/1051275049.db2.gz RXHHUVYEUOGOEK-PXNSSMCTSA-N 2 0 328.500 4.440 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@H]2CCC[C@H]2OC)ccc1OC ZINC000775416049 1051289432 /nfs/dbraw/zinc/28/94/32/1051289432.db2.gz CWDTYNUTRUWUJF-ILZDJORESA-N 2 0 348.531 4.003 20 0 EIADRP CC[N@H+](CCc1ccc(Cl)cc1)Cc1ccc(C[NH+](C)C)cc1 ZINC001175063402 1051317172 /nfs/dbraw/zinc/31/71/72/1051317172.db2.gz YRUVUXICDNVZGG-UHFFFAOYSA-N 2 0 330.903 4.466 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000154841476 1051341176 /nfs/dbraw/zinc/34/11/76/1051341176.db2.gz URXFISCUADPVFD-OAQYLSRUSA-N 2 0 326.459 4.443 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cccc3ncccc23)C1 ZINC001191048957 1051350230 /nfs/dbraw/zinc/35/02/30/1051350230.db2.gz VLVCRMHDWSLVHU-OALUTQOASA-N 2 0 337.511 4.321 20 0 EIADRP COc1cc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)ccc1SC ZINC000268843479 1051397087 /nfs/dbraw/zinc/39/70/87/1051397087.db2.gz DHNDXJXUWVLVFG-CVEARBPZSA-N 2 0 336.545 4.188 20 0 EIADRP CO[C@@H](CC(C)C)C[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001191358532 1051429363 /nfs/dbraw/zinc/42/93/63/1051429363.db2.gz MMZBVIWRHYQDJR-VXKWHMMOSA-N 2 0 344.543 4.036 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2cc[nH]c2c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311009192 1051453124 /nfs/dbraw/zinc/45/31/24/1051453124.db2.gz WXUZODRPQNQOLU-DYESRHJHSA-N 2 0 333.479 4.168 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](CCCOc3cccc(C(C)(C)C)c3)CC[C@H]21 ZINC001191521351 1051472650 /nfs/dbraw/zinc/47/26/50/1051472650.db2.gz PYFYREOFWSGLPC-GHTZIAJQSA-N 2 0 344.543 4.169 20 0 EIADRP CC(C)(C)[C@@]1(C[NH2+][C@@H]2C[C@H]3C[C@H]3C2)CC[N@H+](Cc2ccccc2)C1 ZINC001182453369 1051582534 /nfs/dbraw/zinc/58/25/34/1051582534.db2.gz SIVZKAWBVNRCBL-XAPVIXHLSA-N 2 0 326.528 4.313 20 0 EIADRP CCC(CC)(C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)SC ZINC000775511592 1051659612 /nfs/dbraw/zinc/65/96/12/1051659612.db2.gz DUIDCTFIHDIIPZ-HKUYNNGSSA-N 2 0 334.573 4.408 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc2ccccc2c1OC(F)F ZINC000158109823 1051712645 /nfs/dbraw/zinc/71/26/45/1051712645.db2.gz STNZCQWGZNPLOD-LSDHHAIUSA-N 2 0 348.437 4.434 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc2cc(OC)ccc2c1 ZINC000158162354 1051721556 /nfs/dbraw/zinc/72/15/56/1051721556.db2.gz HJHWZLDLJJYTKR-IIBYNOLFSA-N 2 0 326.484 4.231 20 0 EIADRP Cc1ccc2sc(C[N@H+](C)CCCC[NH+]3CCCCC3)nc2c1 ZINC001175687701 1051729594 /nfs/dbraw/zinc/72/95/94/1051729594.db2.gz KQRDKXUWWOHGBY-UHFFFAOYSA-N 2 0 331.529 4.303 20 0 EIADRP CC(C)O[C@H](C[N@H+](C)CCCC[NH+]1CCCCC1)c1ccccc1 ZINC001175687641 1051729719 /nfs/dbraw/zinc/72/97/19/1051729719.db2.gz JSAARRBQGUWRLW-OAQYLSRUSA-N 2 0 332.532 4.351 20 0 EIADRP Cc1nc(C(F)(F)F)c(C[N@H+](C)CCCC[NH+]2CCCCC2)s1 ZINC001175690120 1051730371 /nfs/dbraw/zinc/73/03/71/1051730371.db2.gz VRNKATLGCJOBMX-UHFFFAOYSA-N 2 0 349.466 4.168 20 0 EIADRP C[N@H+](CCCC[NH+]1CCCCC1)Cc1csc(Br)c1 ZINC001175690186 1051731964 /nfs/dbraw/zinc/73/19/64/1051731964.db2.gz WMMUATUTLAAZKP-UHFFFAOYSA-N 2 0 345.350 4.209 20 0 EIADRP C[C@@H](CCc1c[nH]c2ccccc12)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC001183095485 1051787078 /nfs/dbraw/zinc/78/70/78/1051787078.db2.gz QFQVCZGBMOYIHX-PKOBYXMFSA-N 2 0 339.527 4.201 20 0 EIADRP Cc1ccc(N2CCC([NH2+][C@@H](C)c3cccc(Cl)c3)CC2)nc1 ZINC000163496894 1051990727 /nfs/dbraw/zinc/99/07/27/1051990727.db2.gz AVMUTNJLEFNFQL-HNNXBMFYSA-N 2 0 329.875 4.363 20 0 EIADRP CCC[C@@]1(COC)CCC[N@@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001193872401 1052022438 /nfs/dbraw/zinc/02/24/38/1052022438.db2.gz NEFJWJSOJMWSDT-QFIPXVFZSA-N 2 0 344.543 4.454 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(-n3ccnc3C)cc2)CC1 ZINC000164476960 1052031556 /nfs/dbraw/zinc/03/15/56/1052031556.db2.gz WNRNRHCHQOVEAL-QGZVFWFLSA-N 2 0 340.515 4.096 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)cc1 ZINC000165897947 1052080126 /nfs/dbraw/zinc/08/01/26/1052080126.db2.gz YNTVLNYTPFCHOU-QZTJIDSGSA-N 2 0 326.484 4.347 20 0 EIADRP FC(F)(F)c1ccc(C2([NH2+][C@@H]3CC[C@H]4C[NH2+]C[C@H]4C3)CCC2)cc1 ZINC000622043785 1052084283 /nfs/dbraw/zinc/08/42/83/1052084283.db2.gz LRZPEMSXJWATQO-JJRVBVJISA-N 2 0 338.417 4.062 20 0 EIADRP CC1CC[NH+](CCCC[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000166174152 1052087640 /nfs/dbraw/zinc/08/76/40/1052087640.db2.gz SLEGEPRBBNLSNZ-IFMALSPDSA-N 2 0 344.543 4.256 20 0 EIADRP c1cc(C[N@@H+]2CCCSC[C@H]2C2CC2)ccc1C[NH+]1CCCCC1 ZINC001176650355 1052168067 /nfs/dbraw/zinc/16/80/67/1052168067.db2.gz REURFYBCNBMUDD-NRFANRHFSA-N 2 0 344.568 4.390 20 0 EIADRP COc1cccc2cc([C@H](C)[NH2+]Cc3ccc(C[NH+](C)C)cc3)oc21 ZINC000171128277 1052396317 /nfs/dbraw/zinc/39/63/17/1052396317.db2.gz UHWRZGMMOJXOPT-HNNXBMFYSA-N 2 0 338.451 4.354 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000171133261 1052397890 /nfs/dbraw/zinc/39/78/90/1052397890.db2.gz LYUBHMNPYYJZSX-KRWDZBQOSA-N 2 0 326.484 4.388 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000339066076 1052551642 /nfs/dbraw/zinc/55/16/42/1052551642.db2.gz FCEQNTHQKQVAJG-SJBKTWHCSA-N 2 0 344.543 4.399 20 0 EIADRP C[C@H](CCc1ccco1)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000379903737 1052565609 /nfs/dbraw/zinc/56/56/09/1052565609.db2.gz IIFFGIZEADSVOW-HBFSDRIKSA-N 2 0 326.484 4.101 20 0 EIADRP COc1cc([C@H](C)N[C@H]2CC[N@H+](C)C(C)(C)C2)ccc1OC(C)C ZINC000623349598 1052630185 /nfs/dbraw/zinc/63/01/85/1052630185.db2.gz GFVBJKDFFPRKOM-RDJZCZTQSA-N 2 0 334.504 4.006 20 0 EIADRP C[N@@H+]1CC[C@@H]([NH2+]CCCc2cccc(C(F)(F)F)c2)CC1(C)C ZINC000623377636 1052638807 /nfs/dbraw/zinc/63/88/07/1052638807.db2.gz DJVMMLADFFFEBO-MRXNPFEDSA-N 2 0 328.422 4.100 20 0 EIADRP CO[C@@H](C[NH2+][C@@H](C)c1ccc(-n2ccnc2C)cc1)c1ccccc1 ZINC000178458186 1052705795 /nfs/dbraw/zinc/70/57/95/1052705795.db2.gz YHSQQJFIAILUPY-KKSFZXQISA-N 2 0 335.451 4.219 20 0 EIADRP C[C@H]([NH2+][C@@H](c1ccccc1)C1CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000178494131 1052706773 /nfs/dbraw/zinc/70/67/73/1052706773.db2.gz OKIJETOCNYEWEQ-JTSKRJEESA-N 2 0 338.495 4.429 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccccc1N(C)C ZINC000179399632 1052734507 /nfs/dbraw/zinc/73/45/07/1052734507.db2.gz NHASPOSUASBDBU-GOSISDBHSA-N 2 0 337.511 4.199 20 0 EIADRP FC(F)(F)C1(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)CCCC1 ZINC000623788264 1052804561 /nfs/dbraw/zinc/80/45/61/1052804561.db2.gz UKMACSXBKNEOFY-UHFFFAOYSA-N 2 0 332.454 4.496 20 0 EIADRP C[C@@H](NC1CC[NH+](CC2CC2)CC1)c1ccc(F)cc1C(F)(F)F ZINC000623868151 1052830044 /nfs/dbraw/zinc/83/00/44/1052830044.db2.gz URPAZBMHSDOUTG-GFCCVEGCSA-N 2 0 344.396 4.370 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(F)cc1C(F)(F)F ZINC000624002737 1052850816 /nfs/dbraw/zinc/85/08/16/1052850816.db2.gz CUCBKEWGFSVMNU-XGNXJENSSA-N 2 0 332.385 4.368 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccc(F)cc1C(F)(F)F ZINC000624125007 1052868727 /nfs/dbraw/zinc/86/87/27/1052868727.db2.gz QUOXXPWTDWFLTH-QWHCGFSZSA-N 2 0 332.385 4.227 20 0 EIADRP C[C@@H]([NH2+]CCSc1ccc(F)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185706602 1053021086 /nfs/dbraw/zinc/02/10/86/1053021086.db2.gz DKESLWHYHAKWCM-HZPDHXFCSA-N 2 0 336.520 4.160 20 0 EIADRP C[C@H]([NH2+]CCSc1ccc(F)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185706621 1053021554 /nfs/dbraw/zinc/02/15/54/1053021554.db2.gz DKESLWHYHAKWCM-HOTGVXAUSA-N 2 0 336.520 4.160 20 0 EIADRP C[C@@H]([NH2+]Cc1cc(F)cc2cccnc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185722877 1053021642 /nfs/dbraw/zinc/02/16/42/1053021642.db2.gz FBDFHONQBNRCFN-NVXWUHKLSA-N 2 0 341.474 4.117 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@@H]3CCCNc4ccccc43)C2)cc1 ZINC000195138970 1053052746 /nfs/dbraw/zinc/05/27/46/1053052746.db2.gz HNOFEUCVUDALQA-DENIHFKCSA-N 2 0 335.495 4.045 20 0 EIADRP FC(F)(F)c1cccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000381184593 1053056947 /nfs/dbraw/zinc/05/69/47/1053056947.db2.gz LMHMFXSTXULEEL-GOSISDBHSA-N 2 0 348.412 4.317 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)CCO1 ZINC000381195277 1053057774 /nfs/dbraw/zinc/05/77/74/1053057774.db2.gz ZVBSNEPYWJPDKP-VSKRKVRLSA-N 2 0 344.543 4.082 20 0 EIADRP FC1(F)CCCC[C@@H]1C[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000381796054 1053097531 /nfs/dbraw/zinc/09/75/31/1053097531.db2.gz BNLINQCEQLABKV-ZGXWSNOMSA-N 2 0 348.481 4.312 20 0 EIADRP FC1(F)CCCC[C@@H]1C[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12 ZINC000381796053 1053097922 /nfs/dbraw/zinc/09/79/22/1053097922.db2.gz BNLINQCEQLABKV-YSTOQKLRSA-N 2 0 348.481 4.312 20 0 EIADRP c1cc(C[NH+]2CCC(C[NH2+][C@@H]3CC[C@@H]4CCCC[C@H]4C3)CC2)ccn1 ZINC000850516352 1053277399 /nfs/dbraw/zinc/27/73/99/1053277399.db2.gz BTOSQUNGOSPLGX-FDFHNCONSA-N 2 0 341.543 4.242 20 0 EIADRP Cc1ccc(F)cc1C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000383507522 1053346099 /nfs/dbraw/zinc/34/60/99/1053346099.db2.gz KMZPZKCAKOAWAU-PKOBYXMFSA-N 2 0 326.459 4.134 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)c1ccc(SC(F)F)cc1)C[NH+]1CCCC1 ZINC000765119267 1053444650 /nfs/dbraw/zinc/44/46/50/1053444650.db2.gz MSECVGCFRUDVSA-KBPBESRZSA-N 2 0 328.472 4.384 20 0 EIADRP [NH3+]CCCCCCC[N@@H+]1CCc2nc(-c3ccccc3)sc2C1 ZINC000852755151 1053610373 /nfs/dbraw/zinc/61/03/73/1053610373.db2.gz DWOPDRFPCDISOA-UHFFFAOYSA-N 2 0 329.513 4.077 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc2c(ccnc2Cl)o1 ZINC000866222675 1053657032 /nfs/dbraw/zinc/65/70/32/1053657032.db2.gz PKJYYMVFFTVYHX-ZDUSSCGKSA-N 2 0 343.858 4.394 20 0 EIADRP C[C@H](CCc1cccnc1)[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000866249540 1053664517 /nfs/dbraw/zinc/66/45/17/1053664517.db2.gz LEWOCYYDSGSJFB-GOSISDBHSA-N 2 0 329.532 4.037 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)CCc2cncc3ccccc32)C1 ZINC000866260913 1053667864 /nfs/dbraw/zinc/66/78/64/1053667864.db2.gz PHORDZFIMHHLHA-RTBURBONSA-N 2 0 339.527 4.266 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)CCc2cncc3ccccc32)CC1 ZINC000866289381 1053679468 /nfs/dbraw/zinc/67/94/68/1053679468.db2.gz CACWIFITZXIOEG-KRWDZBQOSA-N 2 0 325.500 4.018 20 0 EIADRP C[C@H](CCc1cncc2ccccc21)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000866310821 1053687127 /nfs/dbraw/zinc/68/71/27/1053687127.db2.gz WHIIBWLSMWCGNR-MPQSDHOMSA-N 2 0 339.527 4.266 20 0 EIADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@@H](CCc2ccccc2)c2ccccn2)C1 ZINC000866372470 1053709029 /nfs/dbraw/zinc/70/90/29/1053709029.db2.gz GXFDBBBDCSNYRZ-UNMCSNQZSA-N 2 0 337.511 4.077 20 0 EIADRP CC[N@H+](CCCc1c(F)cccc1F)Cc1ccc(C[NH+](C)C)cc1 ZINC001196624017 1053716643 /nfs/dbraw/zinc/71/66/43/1053716643.db2.gz XJPIZFMNSGSVSQ-UHFFFAOYSA-N 2 0 346.465 4.481 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)cc1OC ZINC000866517293 1053764334 /nfs/dbraw/zinc/76/43/34/1053764334.db2.gz GEPYKRIHJRJWJK-WRHRYDJXSA-N 2 0 348.531 4.048 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)CCS2 ZINC000866518377 1053765495 /nfs/dbraw/zinc/76/54/95/1053765495.db2.gz YKROSWWIUWPTJA-LTCLLZNKSA-N 2 0 334.529 4.085 20 0 EIADRP Cc1c([C@@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)cnn1-c1ccccc1 ZINC000866516368 1053765830 /nfs/dbraw/zinc/76/58/30/1053765830.db2.gz QBHAQDPMDIDCEQ-SRWJYRBRSA-N 2 0 340.515 4.094 20 0 EIADRP COc1cc([C@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)ccc1SC(F)F ZINC000854230011 1053786343 /nfs/dbraw/zinc/78/63/43/1053786343.db2.gz CWGOSWBTTUFBDF-WCQYABFASA-N 2 0 332.460 4.034 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386797872 1053829522 /nfs/dbraw/zinc/82/95/22/1053829522.db2.gz MFGQFWZLYGCAFY-LQWHRVPQSA-N 2 0 340.486 4.257 20 0 EIADRP CC(C)n1c2ccccc2nc1C[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC001199336663 1054385719 /nfs/dbraw/zinc/38/57/19/1054385719.db2.gz UVYHEZNIHSKUAG-GOSISDBHSA-N 2 0 342.531 4.361 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCCc3ccccc3C2)C1 ZINC001199319966 1054390812 /nfs/dbraw/zinc/39/08/12/1054390812.db2.gz GJAGRXXJGCVLFZ-JQVVWYNYSA-N 2 0 328.544 4.282 20 0 EIADRP Cc1nn(C(C)(C)C)c(C)c1C[NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC001199321420 1054392981 /nfs/dbraw/zinc/39/29/81/1054392981.db2.gz XXEXTFHVJZQEAW-IAGOWNOFSA-N 2 0 348.579 4.103 20 0 EIADRP C[N@H+](Cc1ccccc1C[NH2+]Cc1ccnc(F)c1)C1CCCCC1 ZINC000858104507 1054419001 /nfs/dbraw/zinc/41/90/01/1054419001.db2.gz NCUAWSBIXGPNER-UHFFFAOYSA-N 2 0 341.474 4.275 20 0 EIADRP c1cnc2cccc(C[NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)c2c1 ZINC000873009498 1054476893 /nfs/dbraw/zinc/47/68/93/1054476893.db2.gz MCJUTAGWYUKSKD-UHFFFAOYSA-N 2 0 331.463 4.120 20 0 EIADRP [NH3+][C@H]1C[C@@H](C[NH2+]C2CCC(c3cccc(C(F)(F)F)c3)CC2)C1 ZINC000873252099 1054514146 /nfs/dbraw/zinc/51/41/46/1054514146.db2.gz ZVHUMDKXGIZONE-ADZBUSCTSA-N 2 0 326.406 4.059 20 0 EIADRP C[C@@H]([NH2+][C@H](C)C1CC[NH2+]CC1)c1ccc(SCC(F)F)cc1 ZINC000873267926 1054516743 /nfs/dbraw/zinc/51/67/43/1054516743.db2.gz MGCQVBRNYZJGLG-CHWSQXEVSA-N 2 0 328.472 4.083 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873268035 1054518134 /nfs/dbraw/zinc/51/81/34/1054518134.db2.gz PNNMOJAIHBCJRG-HUUCEWRRSA-N 2 0 343.540 4.081 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873259463 1054518154 /nfs/dbraw/zinc/51/81/54/1054518154.db2.gz FJIOKOPDBSNMCE-PLYYQAHHSA-N 2 0 341.524 4.300 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(SC(F)F)cc1 ZINC000873259965 1054518483 /nfs/dbraw/zinc/51/84/83/1054518483.db2.gz POVHQNMSXKPFSH-VIRABCJISA-N 2 0 326.456 4.183 20 0 EIADRP C[C@H]([NH2+][C@H]1CCCc2nc(-c3ccccc3)sc21)C1CC[NH2+]CC1 ZINC000873271765 1054520387 /nfs/dbraw/zinc/52/03/87/1054520387.db2.gz KTQZHOXQHWLSEO-YOEHRIQHSA-N 2 0 341.524 4.165 20 0 EIADRP c1ccc2c(c1)CCC([NH2+]C1CC[NH+](C3CCCCC3)CC1)CC2 ZINC001200863722 1054559244 /nfs/dbraw/zinc/55/92/44/1054559244.db2.gz HQLMEMWBMJATQZ-UHFFFAOYSA-N 2 0 326.528 4.321 20 0 EIADRP Cc1noc(C)c1C[N@@H+]1CCCC12CC[NH+](CC1CCCCC1)CC2 ZINC001201388612 1054786620 /nfs/dbraw/zinc/78/66/20/1054786620.db2.gz BHJSYCDECCSZNN-UHFFFAOYSA-N 2 0 345.531 4.302 20 0 EIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CCCc1cccs1 ZINC001201450600 1054813247 /nfs/dbraw/zinc/81/32/47/1054813247.db2.gz XYCIVNXTNVAOIN-UHFFFAOYSA-N 2 0 330.541 4.429 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(SC(F)F)cc2)CC1 ZINC000765770390 1054843794 /nfs/dbraw/zinc/84/37/94/1054843794.db2.gz ZTPWIPSAXMMCBQ-CYBMUJFWSA-N 2 0 328.472 4.384 20 0 EIADRP CCCC[C@@H](CC)C[NH+]1CCC2(CCCN2Cc2ccn(C)n2)CC1 ZINC001201566413 1054850599 /nfs/dbraw/zinc/85/05/99/1054850599.db2.gz TWHVXGFFACADJS-LJQANCHMSA-N 2 0 346.563 4.067 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2cc(C)cc(C)c2)cc1 ZINC000065932094 1054977719 /nfs/dbraw/zinc/97/77/19/1054977719.db2.gz GQNXARAEQMCGGZ-UHFFFAOYSA-N 2 0 340.511 4.314 20 0 EIADRP CCO[P@@](C)(=O)CC[C@@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000877080461 1055012895 /nfs/dbraw/zinc/01/28/95/1055012895.db2.gz JELFOUXMNBLHJC-WAIKUNEKSA-N 2 0 344.480 4.096 20 0 EIADRP CCO[P@](C)(=O)CC[C@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000877080457 1055013865 /nfs/dbraw/zinc/01/38/65/1055013865.db2.gz JELFOUXMNBLHJC-HJPURHCSSA-N 2 0 344.480 4.096 20 0 EIADRP COCC(C)(C)CC[NH2+][C@H]1CCN(C2CC2)[C@@H](c2ccccc2)C1 ZINC000877803734 1055123236 /nfs/dbraw/zinc/12/32/36/1055123236.db2.gz JDMAKYZATZYEAT-AZUAARDMSA-N 2 0 330.516 4.007 20 0 EIADRP FC(F)n1cc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)c2ccccc21 ZINC000863548092 1055228600 /nfs/dbraw/zinc/22/86/00/1055228600.db2.gz USDQNPYWSMIJRP-YESZJQIVSA-N 2 0 333.426 4.047 20 0 EIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000623656914 1055533383 /nfs/dbraw/zinc/53/33/83/1055533383.db2.gz FMWKFQBMRXWOLV-RBFDBLARSA-N 2 0 338.442 4.013 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+][C@H](c3ccccn3)C3CC3)CC2)c1 ZINC000903083435 1055538213 /nfs/dbraw/zinc/53/82/13/1055538213.db2.gz HAIRBTFSJNEUGL-FQEVSTJZSA-N 2 0 341.524 4.096 20 0 EIADRP CCCCC[C@@H]([NH2+][C@@H]1CCN(C2CC[NH+](C)CC2)C1)c1ccccc1 ZINC000765943429 1056693007 /nfs/dbraw/zinc/69/30/07/1056693007.db2.gz KVJOECNMEVKNLP-IFMALSPDSA-N 2 0 343.559 4.066 20 0 EIADRP Brc1cccc(C2([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CCC2)c1 ZINC000180429448 1058599059 /nfs/dbraw/zinc/59/90/59/1058599059.db2.gz GLCNSMUQVVOPGN-IAGOWNOFSA-N 2 0 349.316 4.045 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)c(OC)c1 ZINC000766514442 1060473325 /nfs/dbraw/zinc/47/33/25/1060473325.db2.gz XDPLUDJRCKSLAP-AOCRQIFASA-N 2 0 346.515 4.152 20 0 EIADRP C[C@@H]1C[N@H+](Cc2cccc(C(F)(F)F)c2Cl)CCC[C@H]1C[NH3+] ZINC001205995737 1060511843 /nfs/dbraw/zinc/51/18/43/1060511843.db2.gz PTMFGELENJHKPF-NEPJUHHUSA-N 2 0 334.813 4.166 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1(c3ccccc3)CCC(F)(F)CC1)C2 ZINC001169117108 1060646565 /nfs/dbraw/zinc/64/65/65/1060646565.db2.gz VSZJLUQWIRYCCG-NNZMDNLPSA-N 2 0 334.454 4.306 20 0 EIADRP CC[NH+]1CCC([NH2+]CC(C)(C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC001169240592 1060717685 /nfs/dbraw/zinc/71/76/85/1060717685.db2.gz BBACHSPYKDAAKL-UHFFFAOYSA-N 2 0 342.449 4.348 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1cc(N2CCCCC2)cc[nH+]1 ZINC001169685384 1060898016 /nfs/dbraw/zinc/89/80/16/1060898016.db2.gz PPPFCCVOUCAEGQ-IBGZPJMESA-N 2 0 336.483 4.312 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cn3ccccc3n2)cc1 ZINC000563671524 370704927 /nfs/dbraw/zinc/70/49/27/370704927.db2.gz YPQHLQGBASCLAU-QGZVFWFLSA-N 2 0 336.483 4.027 20 0 EIADRP CC1CC[NH+](CCCC[NH2+][C@@H]2CSCCc3ccccc32)CC1 ZINC000532192955 1032078302 /nfs/dbraw/zinc/07/83/02/1032078302.db2.gz JZYXBZVTDHPIIR-HXUWFJFHSA-N 2 0 332.557 4.119 20 0 EIADRP C[NH+](C)CC1CC[NH+](Cc2ccc(-c3ccc(Cl)cc3)o2)CC1 ZINC000536629899 1032081614 /nfs/dbraw/zinc/08/16/14/1032081614.db2.gz LSFSAVMAYCCCBL-UHFFFAOYSA-N 2 0 332.875 4.374 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1ccccc1Br ZINC000423470705 1038246133 /nfs/dbraw/zinc/24/61/33/1038246133.db2.gz LTEQLBALCNCOBD-XEZPLFJOSA-N 2 0 325.294 4.007 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccc(C)c(OC)c1 ZINC000194185064 1032215375 /nfs/dbraw/zinc/21/53/75/1032215375.db2.gz AUCBJUREDHHKAO-UHFFFAOYSA-N 2 0 326.484 4.135 20 0 EIADRP C[NH+](C)CC1CCC([NH2+]Cc2ccc(-c3c(F)cccc3F)o2)CC1 ZINC000532721854 1032273682 /nfs/dbraw/zinc/27/36/82/1032273682.db2.gz FMUKIQCQMCMHST-UHFFFAOYSA-N 2 0 348.437 4.435 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)C1CC(F)(F)C1 ZINC000529575084 1032455466 /nfs/dbraw/zinc/45/54/66/1032455466.db2.gz PTTVBMCICXBFGK-SJLPKXTDSA-N 2 0 336.470 4.312 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@@H]1CCC(F)(F)C1 ZINC000450654881 1032624470 /nfs/dbraw/zinc/62/44/70/1032624470.db2.gz RQMWEAQCIRUGKI-QGZVFWFLSA-N 2 0 337.458 4.055 20 0 EIADRP CC[N@H+](CCC1CC[NH+](C[C@H]2CCCCN2C(C)C)CC1)CC1CC1 ZINC000450656843 1032624596 /nfs/dbraw/zinc/62/45/96/1032624596.db2.gz WXKLPKSAXVKNFD-JOCHJYFZSA-N 2 0 349.607 4.083 20 0 EIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000429581004 1032780306 /nfs/dbraw/zinc/78/03/06/1032780306.db2.gz RUEVDFVRJGWJFE-INIZCTEOSA-N 2 0 339.483 4.191 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643547267 1018922388 /nfs/dbraw/zinc/92/23/88/1018922388.db2.gz BXMNXXKFJCXENZ-IAGOWNOFSA-N 2 0 339.527 4.488 20 0 EIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643548982 1018934617 /nfs/dbraw/zinc/93/46/17/1018934617.db2.gz YMLFKCHVMASXPX-YOEHRIQHSA-N 2 0 340.433 4.291 20 0 EIADRP CC/C=C\CC[NH+]1CCC2(CC([N@H+](C)Cc3ccncc3)C2)CC1 ZINC001208727500 1019630661 /nfs/dbraw/zinc/63/06/61/1019630661.db2.gz MZQQARBGEVLUSG-PLNGDYQASA-N 2 0 327.516 4.114 20 0 EIADRP CC[N@H+](CCCCC(F)(F)F)CC1CCN(c2ccccn2)CC1 ZINC000154723577 1019978902 /nfs/dbraw/zinc/97/89/02/1019978902.db2.gz SRTHDZXMXSPPGW-UHFFFAOYSA-N 2 0 343.437 4.353 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2coc(-c3ccccc3F)n2)CC1 ZINC000625137752 1019988683 /nfs/dbraw/zinc/98/86/83/1019988683.db2.gz HIMHCTAKEJJJIB-UHFFFAOYSA-N 2 0 345.462 4.033 20 0 EIADRP COc1ccc2oc([C@@H](C)[NH2+][C@@H](C)C3CC[NH+](C)CC3)c(C)c2c1 ZINC000153666128 1020362961 /nfs/dbraw/zinc/36/29/61/1020362961.db2.gz XFKXPXQTLQMDHJ-LSDHHAIUSA-N 2 0 330.472 4.131 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](COC)c2cccc(Cl)c2)c1 ZINC000579891511 1020485273 /nfs/dbraw/zinc/48/52/73/1020485273.db2.gz VGLVKKGHXZRKOS-HXUWFJFHSA-N 2 0 346.902 4.269 20 0 EIADRP CCCOc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C)CC2)cc1OCCC ZINC000326793219 1020683206 /nfs/dbraw/zinc/68/32/06/1020683206.db2.gz QQEPWGIATWNATG-QGZVFWFLSA-N 2 0 348.531 4.257 20 0 EIADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547831560 1020780297 /nfs/dbraw/zinc/78/02/97/1020780297.db2.gz ACPRCCVYUZNZTO-FKVLARQCSA-N 2 0 344.543 4.080 20 0 EIADRP CC(C)[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cccc(C(F)(F)F)c1 ZINC000655806093 1020975805 /nfs/dbraw/zinc/97/58/05/1020975805.db2.gz ZAESQOMBJDVRCN-XKQJLSEDSA-N 2 0 328.422 4.332 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000655806116 1020976456 /nfs/dbraw/zinc/97/64/56/1020976456.db2.gz ZGEJRYRIHVRDHH-UIAACRFSSA-N 2 0 328.887 4.359 20 0 EIADRP CC[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CCCCO1 ZINC000655850669 1021016759 /nfs/dbraw/zinc/01/67/59/1021016759.db2.gz YJJVKOVFKAMJNS-CUUWFGFTSA-N 2 0 342.527 4.119 20 0 EIADRP C[C@H](NC1CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cc1F ZINC000122162468 1021039696 /nfs/dbraw/zinc/03/96/96/1021039696.db2.gz LHKPGVMTSKDCET-HNNXBMFYSA-N 2 0 330.422 4.280 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000340466005 1021069040 /nfs/dbraw/zinc/06/90/40/1021069040.db2.gz KHFFKUFMLNFWLY-NRFANRHFSA-N 2 0 338.495 4.400 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCCc3c(O)cccc32)cc1 ZINC000340470031 1021074777 /nfs/dbraw/zinc/07/47/77/1021074777.db2.gz YVBPBRCRLUBDKH-OAQYLSRUSA-N 2 0 338.495 4.401 20 0 EIADRP c1ccc(C[N@H+]2CCC[C@@H](C[NH2+][C@H]3CCCNc4ccccc43)C2)cc1 ZINC000683690505 1021098891 /nfs/dbraw/zinc/09/88/91/1021098891.db2.gz LXCNRXJQOCVLDR-REWPJTCUSA-N 2 0 349.522 4.435 20 0 EIADRP Cc1ccncc1CCC[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000584496446 1021330161 /nfs/dbraw/zinc/33/01/61/1021330161.db2.gz DSVRDBQJQDJYCU-HXUWFJFHSA-N 2 0 343.559 4.299 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CCN1Cc1ccccc1 ZINC000570425256 1021433690 /nfs/dbraw/zinc/43/36/90/1021433690.db2.gz OAXCISMVKFWALT-PVSGBFIBSA-N 2 0 334.507 4.433 20 0 EIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+][C@@H](Cc1nccn1C)c1ccccc1 ZINC000683819208 1021694389 /nfs/dbraw/zinc/69/43/89/1021694389.db2.gz OIMDCWYVUSOHDE-AGHHOFFYSA-N 2 0 349.478 4.070 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c(C)c1 ZINC000414063749 1021769337 /nfs/dbraw/zinc/76/93/37/1021769337.db2.gz MTMUCDJHYOIUFY-GOSISDBHSA-N 2 0 338.495 4.450 20 0 EIADRP COc1ccccc1[C@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccccc1 ZINC000089554975 1021934839 /nfs/dbraw/zinc/93/48/39/1021934839.db2.gz LDWRYKZKUPTYLC-HTAPYJJXSA-N 2 0 338.495 4.105 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1csc(-c2ccccc2)n1 ZINC000414148374 1021975729 /nfs/dbraw/zinc/97/57/29/1021975729.db2.gz NUNNHUQTWIIMJJ-OAHLLOKOSA-N 2 0 341.524 4.335 20 0 EIADRP C[C@H](N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cncc(F)c1 ZINC000414148608 1021977030 /nfs/dbraw/zinc/97/70/30/1021977030.db2.gz RYMPYPDTYWCBKA-FCRQHZQGSA-N 2 0 339.458 4.067 20 0 EIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c[nH+]cn3c1)CCCO2 ZINC000414185286 1022064847 /nfs/dbraw/zinc/06/48/47/1022064847.db2.gz OJCZATSXYLHMOH-FQEVSTJZSA-N 2 0 335.451 4.461 20 0 EIADRP C[C@H]([NH2+]C1CCC(C(F)F)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000414196905 1022098834 /nfs/dbraw/zinc/09/88/34/1022098834.db2.gz VNYHXAVJVSZMNJ-OOHWJJMZSA-N 2 0 340.458 4.102 20 0 EIADRP CCOc1cccc2cc([C@H](C)[NH2+]CC[C@H]3CCC[N@H+](C)C3)oc21 ZINC000414199449 1022105248 /nfs/dbraw/zinc/10/52/48/1022105248.db2.gz XBBOVPBWQIZPGU-JKSUJKDBSA-N 2 0 330.472 4.214 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000414202825 1022123900 /nfs/dbraw/zinc/12/39/00/1022123900.db2.gz ZGTPHSNWUGHIHE-GJZGRUSLSA-N 2 0 344.421 4.010 20 0 EIADRP CO[C@](C)([C@@H](C)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)C1CC1 ZINC000414249796 1022310781 /nfs/dbraw/zinc/31/07/81/1022310781.db2.gz XINUBNHKNBESPJ-MTWWTJSRSA-N 2 0 344.543 4.223 20 0 EIADRP Cc1cc(C[NH2+]Cc2cccc(C[NH+](C)C)c2)ccc1C(F)(F)F ZINC000414262210 1022342323 /nfs/dbraw/zinc/34/23/23/1022342323.db2.gz IHRFSUNOGUNNCZ-UHFFFAOYSA-N 2 0 336.401 4.365 20 0 EIADRP COc1ccc(C[N@@H+]2CC[C@H](C3CC[NH+](C)CC3)C2)c2ccccc12 ZINC000580677399 1022366552 /nfs/dbraw/zinc/36/65/52/1022366552.db2.gz NOFOVXGSBUJXHQ-SFHVURJKSA-N 2 0 338.495 4.012 20 0 EIADRP CCCCOc1ccc(C[NH+]2CCC(CC[NH+](C)C)CC2)cc1OC ZINC000511537821 1022486186 /nfs/dbraw/zinc/48/61/86/1022486186.db2.gz AQBWDRGEOPXYDJ-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP CCOc1cccc2cc([C@@H](C)[NH2+]CC3CC[NH+](CC)CC3)oc21 ZINC000580791510 1022500155 /nfs/dbraw/zinc/50/01/55/1022500155.db2.gz QHZLHVMOICTDPG-OAHLLOKOSA-N 2 0 330.472 4.214 20 0 EIADRP FC(F)(F)c1ccccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000261762093 1022674753 /nfs/dbraw/zinc/67/47/53/1022674753.db2.gz PWKBOIFZSGLQFI-USXIJHARSA-N 2 0 326.406 4.106 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000423372070 1022857859 /nfs/dbraw/zinc/85/78/59/1022857859.db2.gz QYWNXQAVZQTLGB-SIXLDLHFSA-N 2 0 326.406 4.201 20 0 EIADRP CN1CC[C@H]([NH2+][C@@H]2CCCc3cc(N)ccc32)C[C@@H]1c1ccccc1 ZINC000423369636 1022860650 /nfs/dbraw/zinc/86/06/50/1022860650.db2.gz SUBYGKHTHQEKMK-KSEOMHKRSA-N 2 0 335.495 4.071 20 0 EIADRP C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548154385 1022871453 /nfs/dbraw/zinc/87/14/53/1022871453.db2.gz NZNDNIVPHMBIEU-BULFRSBZSA-N 2 0 335.495 4.033 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1)C1CC[NH+](C)CC1 ZINC000311094460 1022878832 /nfs/dbraw/zinc/87/88/32/1022878832.db2.gz QMEYJPGXDUMWDO-SFHVURJKSA-N 2 0 338.495 4.086 20 0 EIADRP C[C@H]([NH2+][C@H](c1ccccc1)c1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC000396436946 1023015861 /nfs/dbraw/zinc/01/58/61/1023015861.db2.gz HBHBPEYWSNXXNA-HRAATJIYSA-N 2 0 326.459 4.235 20 0 EIADRP C[C@@H]([NH2+]C(Cc1ccccc1)Cc1ccccc1)C1CC[NH+](C)CC1 ZINC000396472950 1023032647 /nfs/dbraw/zinc/03/26/47/1023032647.db2.gz ZCXCCVXWIJHROG-LJQANCHMSA-N 2 0 336.523 4.160 20 0 EIADRP CN1CC[C@H]([NH2+][C@@H]2CCCN(c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000584581446 1023038208 /nfs/dbraw/zinc/03/82/08/1023038208.db2.gz VNRAMWUDGAKDEF-XJUOHMSHSA-N 2 0 349.522 4.081 20 0 EIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000558486174 1023081963 /nfs/dbraw/zinc/08/19/63/1023081963.db2.gz RWHPSNZWPSDWOL-OMCKNOPTSA-N 2 0 338.442 4.154 20 0 EIADRP CC[NH2+]CC1CC[NH+](Cc2nc(C)c(-c3ccc(Cl)cc3)o2)CC1 ZINC000430579035 1023091200 /nfs/dbraw/zinc/09/12/00/1023091200.db2.gz QDASZJXZUYXTTF-UHFFFAOYSA-N 2 0 347.890 4.125 20 0 EIADRP Cc1ccccc1SC[C@@H](C)C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC001167457586 1023098639 /nfs/dbraw/zinc/09/86/39/1023098639.db2.gz FXWIEXUNKHSYHR-HKUYNNGSSA-N 2 0 332.557 4.141 20 0 EIADRP CCC[C@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000473307874 1033106304 /nfs/dbraw/zinc/10/63/04/1033106304.db2.gz DVVWSWSNVBESKL-PXNSSMCTSA-N 2 0 345.531 4.024 20 0 EIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc2c(c1)CCC2 ZINC000537936482 1023277533 /nfs/dbraw/zinc/27/75/33/1023277533.db2.gz UFFVRLCUOBVDRG-KRWDZBQOSA-N 2 0 335.495 4.138 20 0 EIADRP C[C@@H](Cc1ccsc1)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000584760792 1023291717 /nfs/dbraw/zinc/29/17/17/1023291717.db2.gz GBWNMDLBEAGIFK-ROUUACIJSA-N 2 0 342.552 4.364 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCCc3c(Br)cccc32)cc1 ZINC000581549045 1023351622 /nfs/dbraw/zinc/35/16/22/1023351622.db2.gz NASDSOZPBSCXRB-SFHVURJKSA-N 2 0 345.284 4.075 20 0 EIADRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](C(c2ccccc2)c2ccccc2)C1 ZINC000549140104 1023368954 /nfs/dbraw/zinc/36/89/54/1023368954.db2.gz ZFSBLKWZJDUZFA-HXUWFJFHSA-N 2 0 334.507 4.440 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+]Cc1ccc(-c2ccccc2Br)cc1 ZINC000415018884 1023392495 /nfs/dbraw/zinc/39/24/95/1023392495.db2.gz HGIQJPFTGCMSMW-AWEZNQCLSA-N 2 0 347.300 4.333 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3c2CCCN3)CC[N@@H+]1Cc1ccccc1 ZINC000415046478 1023409465 /nfs/dbraw/zinc/40/94/65/1023409465.db2.gz ZTYLDQFIAXMZEM-NQIIRXRSSA-N 2 0 349.522 4.187 20 0 EIADRP Cc1cc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)ccc1Br ZINC000415045423 1023409487 /nfs/dbraw/zinc/40/94/87/1023409487.db2.gz BRBKCBKHHAUXCU-GOSISDBHSA-N 2 0 347.300 4.327 20 0 EIADRP [NH3+]CC1CCC([NH2+]Cc2cccc(COCc3ccccc3)c2)CC1 ZINC000415080192 1023430137 /nfs/dbraw/zinc/43/01/37/1023430137.db2.gz LHBCZHUZZFZRNT-UHFFFAOYSA-N 2 0 338.495 4.011 20 0 EIADRP c1ccc([C@@H]2C[C@@H](NCc3ccccc3OC3CCC3)CC[NH2+]2)cc1 ZINC000415090443 1023432332 /nfs/dbraw/zinc/43/23/32/1023432332.db2.gz OUKHZILLHDSRJB-FPOVZHCZSA-N 2 0 336.479 4.201 20 0 EIADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+]Cc1cccc(COCc2ccccc2)c1 ZINC000415082735 1023433178 /nfs/dbraw/zinc/43/31/78/1023433178.db2.gz OSJVMIPGIYEDCR-XMSQKQJNSA-N 2 0 338.495 4.024 20 0 EIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]C3CCC([NH3+])CC3)s2)cc1 ZINC000415105360 1023446183 /nfs/dbraw/zinc/44/61/83/1023446183.db2.gz LZVUEUUOHFMRNN-UWTIGNOOSA-N 2 0 345.512 4.048 20 0 EIADRP CC[NH+](CC)C[C@@H]1CC[N@H+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500076996 1023484243 /nfs/dbraw/zinc/48/42/43/1023484243.db2.gz VVPQDPXBAIKMFR-CVEARBPZSA-N 2 0 342.449 4.473 20 0 EIADRP CC[N@H+](C)C[C@@H]1CC[NH+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500075193 1023485122 /nfs/dbraw/zinc/48/51/22/1023485122.db2.gz OOSYAWYCRPPOLI-CABCVRRESA-N 2 0 328.422 4.083 20 0 EIADRP Cc1ccc(OC2CC[NH+](CC[C@H]3CCCC[N@H+]3C)CC2)cc1C ZINC000472752453 1023502523 /nfs/dbraw/zinc/50/25/23/1023502523.db2.gz PRBCORPVTCIALI-LJQANCHMSA-N 2 0 330.516 4.021 20 0 EIADRP c1cc(-c2nc(C[NH+]3CCC([C@@H]4CCC[NH2+]C4)CC3)cs2)cs1 ZINC000656785547 1023529651 /nfs/dbraw/zinc/52/96/51/1023529651.db2.gz LUWULKAZFBIFEG-OAHLLOKOSA-N 2 0 347.553 4.083 20 0 EIADRP c1cc(-c2nc(C[N@@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)cs2)cs1 ZINC000656786979 1023536369 /nfs/dbraw/zinc/53/63/69/1023536369.db2.gz YVOKIOBOSAQASP-HNNXBMFYSA-N 2 0 347.553 4.083 20 0 EIADRP CO[C@@H]1CCC[C@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)C1 ZINC000684374286 1023566713 /nfs/dbraw/zinc/56/67/13/1023566713.db2.gz NLOFBTMYSMEBLK-LEWJYISDSA-N 2 0 330.516 4.110 20 0 EIADRP CO[C@H]1CCC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)C1 ZINC000684378556 1023585993 /nfs/dbraw/zinc/58/59/93/1023585993.db2.gz MJOCKHSHCOBULE-SFTDATJTSA-N 2 0 330.516 4.110 20 0 EIADRP CCC1(C[NH2+][C@@H]2CCC[C@@H](OC)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000684388551 1023616102 /nfs/dbraw/zinc/61/61/02/1023616102.db2.gz UPXBXRQFFHQCAA-NHCUHLMSSA-N 2 0 344.543 4.226 20 0 EIADRP Cc1ccc(-c2nc(C[NH+]3CCC([C@@H]4CCC[NH2+]4)CC3)cs2)cc1 ZINC000261753501 1023618008 /nfs/dbraw/zinc/61/80/08/1023618008.db2.gz UZKLIBPNNNURDP-IBGZPJMESA-N 2 0 341.524 4.083 20 0 EIADRP C[C@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1cscn1 ZINC000581737912 1023658804 /nfs/dbraw/zinc/65/88/04/1023658804.db2.gz WEHQICVRNBCLHV-ZLPCBKJTSA-N 2 0 329.513 4.237 20 0 EIADRP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1cccc(Br)c1 ZINC000020143221 1023738493 /nfs/dbraw/zinc/73/84/93/1023738493.db2.gz BKJUICPMMFFCOG-LBPRGKRZSA-N 2 0 339.321 4.409 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC(c2c[nH]c3ccccc23)CC1 ZINC000472856027 1023742004 /nfs/dbraw/zinc/74/20/04/1023742004.db2.gz WQJBZRNCRAJVNU-SFHVURJKSA-N 2 0 325.500 4.222 20 0 EIADRP Cc1c([C@H](C)[NH2+]C[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)cnn1C(C)C ZINC000364467973 1023804257 /nfs/dbraw/zinc/80/42/57/1023804257.db2.gz WSROPOXYKFETSX-LRQRDZAKSA-N 2 0 340.515 4.116 20 0 EIADRP c1ccc(CN2CC[C@H]([NH2+]CCC[C@H]3CCCCO3)CC23CC3)cc1 ZINC000647201800 1023885183 /nfs/dbraw/zinc/88/51/83/1023885183.db2.gz ANVBJSKPENWUDH-LEWJYISDSA-N 2 0 342.527 4.123 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2CCc3ccc(F)c(Cl)c32)c1 ZINC000651750118 1023969951 /nfs/dbraw/zinc/96/99/51/1023969951.db2.gz WTQQSPCJSLJKNH-QGZVFWFLSA-N 2 0 332.850 4.318 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)CC1 ZINC000510654986 1024176719 /nfs/dbraw/zinc/17/67/19/1024176719.db2.gz DWZBBNVBUSLQGY-HNNXBMFYSA-N 2 0 342.449 4.491 20 0 EIADRP FCCC[C@H]1CCC[C@H]1[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000510672775 1024208361 /nfs/dbraw/zinc/20/83/61/1024208361.db2.gz WPFWQDFMGVHMEQ-NHCUHLMSSA-N 2 0 332.507 4.407 20 0 EIADRP FCCC[C@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000510672777 1024209327 /nfs/dbraw/zinc/20/93/27/1024209327.db2.gz WPFWQDFMGVHMEQ-RTWAWAEBSA-N 2 0 332.507 4.407 20 0 EIADRP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000510673082 1024210278 /nfs/dbraw/zinc/21/02/78/1024210278.db2.gz YMOKLAIZALSYGV-PCCBWWKXSA-N 2 0 332.507 4.059 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cc(O)cc(F)c2)CC1 ZINC000473130215 1024337310 /nfs/dbraw/zinc/33/73/10/1024337310.db2.gz ASEWDGVCSKIOGU-INIZCTEOSA-N 2 0 334.479 4.008 20 0 EIADRP CCSc1cccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000473138872 1024381554 /nfs/dbraw/zinc/38/15/54/1024381554.db2.gz HGCCRADDZDMVMT-FXAWDEMLSA-N 2 0 330.541 4.247 20 0 EIADRP C[C@@H](CCc1c(F)cccc1F)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000510752336 1024387239 /nfs/dbraw/zinc/38/72/39/1024387239.db2.gz JZZXIHFRTLMVLW-HNNXBMFYSA-N 2 0 332.438 4.137 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)c1 ZINC000341758966 1024617681 /nfs/dbraw/zinc/61/76/81/1024617681.db2.gz ROAYUYBMACRIBR-LJQANCHMSA-N 2 0 344.886 4.405 20 0 EIADRP Fc1cc2c(c(F)c1)CC[C@H]2[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000684556848 1024656431 /nfs/dbraw/zinc/65/64/31/1024656431.db2.gz CRAJJJLTJLUNBK-IIBYNOLFSA-N 2 0 342.433 4.064 20 0 EIADRP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@H]([C@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000652347858 1024688957 /nfs/dbraw/zinc/68/89/57/1024688957.db2.gz NGVKBXAPAJGLOC-GDAAHCPNSA-N 2 0 336.907 4.009 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@@H](C)C[C@@H]1c1ccccc1 ZINC000348835690 1024722149 /nfs/dbraw/zinc/72/21/49/1024722149.db2.gz AVRCSSOZFISROU-HRAATJIYSA-N 2 0 332.451 4.159 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000092381380 1024800267 /nfs/dbraw/zinc/80/02/67/1024800267.db2.gz GVAZWNSEWXYQIU-UHFFFAOYSA-N 2 0 346.849 4.105 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(c2cc[nH+]c3c(O)cccc23)C1 ZINC000684575013 1024828180 /nfs/dbraw/zinc/82/81/80/1024828180.db2.gz IZRMWAWKYAIKLM-DLBZAZTESA-N 2 0 339.483 4.031 20 0 EIADRP Cc1ccc(C[C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000548483355 1024830230 /nfs/dbraw/zinc/83/02/30/1024830230.db2.gz NPJZKVMHVJGIBO-XKGZKEIXSA-N 2 0 342.552 4.488 20 0 EIADRP CS[C@H](C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(C)(C)C ZINC000548486105 1024836376 /nfs/dbraw/zinc/83/63/76/1024836376.db2.gz NUSRTGGYACPLJY-BHIYHBOVSA-N 2 0 334.573 4.264 20 0 EIADRP CCOc1ccc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)cc1OCC ZINC000535811985 1024960390 /nfs/dbraw/zinc/96/03/90/1024960390.db2.gz RWOVSBMZZRFUOR-UHFFFAOYSA-N 2 0 348.531 4.036 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cccc(Cl)c1Cl ZINC000662279680 1025025261 /nfs/dbraw/zinc/02/52/61/1025025261.db2.gz AXGXEVUSRGAVJL-GFCCVEGCSA-N 2 0 335.278 4.490 20 0 EIADRP c1c(C2CC[NH+](CCCC3CCCC3)CC2)n[nH]c1C1CC[NH2+]CC1 ZINC000662326699 1025080340 /nfs/dbraw/zinc/08/03/40/1025080340.db2.gz AKCSRINTIWDPLY-UHFFFAOYSA-N 2 0 344.547 4.027 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cc2ccncc2s1 ZINC000663463802 1025392061 /nfs/dbraw/zinc/39/20/61/1025392061.db2.gz BRZVAFHGHKPBGD-GOEBONIOSA-N 2 0 329.513 4.069 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cccc(OC(F)F)c1 ZINC000663468247 1025408269 /nfs/dbraw/zinc/40/82/69/1025408269.db2.gz KXTMEOYPHLOFCH-GOEBONIOSA-N 2 0 338.442 4.061 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)CC(F)(F)F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000663478481 1025469386 /nfs/dbraw/zinc/46/93/86/1025469386.db2.gz RENAFAOTWRLTKD-RDJZCZTQSA-N 2 0 342.449 4.465 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC001167826148 1025620776 /nfs/dbraw/zinc/62/07/76/1025620776.db2.gz NCTXMMUODRSHKU-HXUWFJFHSA-N 3 0 345.575 4.093 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@@H](Sc2ccncc2)C1 ZINC001167826943 1025629156 /nfs/dbraw/zinc/62/91/56/1025629156.db2.gz SDMRAAGPEFDRGV-PKOBYXMFSA-N 2 0 335.561 4.149 20 0 EIADRP CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)[C@H](C)CCC[NH+](CC)CC ZINC001167835292 1025835373 /nfs/dbraw/zinc/83/53/73/1025835373.db2.gz RBOJGSXQGMSUTF-QUCCMNQESA-N 2 0 332.532 4.480 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@H](c2cccc(OC)c2)C1 ZINC001167839555 1025853157 /nfs/dbraw/zinc/85/31/57/1025853157.db2.gz ABJCKCYVLTVXBF-QUCCMNQESA-N 2 0 332.532 4.385 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@@H](Cc2cccc(OC)c2)C1 ZINC001167841621 1025886245 /nfs/dbraw/zinc/88/62/45/1025886245.db2.gz NEKYNVCMKZZVFX-FPOVZHCZSA-N 2 0 346.559 4.460 20 0 EIADRP C[C@H]1C[N@H+](CCC[NH2+][C@@H](c2ccccc2F)C2CCCC2)CCCO1 ZINC000432420124 1025898191 /nfs/dbraw/zinc/89/81/91/1025898191.db2.gz IYVIVNZMTWAMQW-LAUBAEHRSA-N 2 0 348.506 4.148 20 0 EIADRP CC(C)Oc1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167968600 1025904283 /nfs/dbraw/zinc/90/42/83/1025904283.db2.gz SSPCQFNOBUVGBA-SEJPIABJSA-N 2 0 342.527 4.011 20 0 EIADRP C[C@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1ccc(OC(F)F)cc1 ZINC000319789732 1025963599 /nfs/dbraw/zinc/96/35/99/1025963599.db2.gz HRIUYHHKZPACEA-HNNXBMFYSA-N 2 0 326.431 4.061 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H](CC(C)(C)C)c2ccccc2)CC1 ZINC000344081304 1025989374 /nfs/dbraw/zinc/98/93/74/1025989374.db2.gz XFXFIQCKNNAUKM-FQEVSTJZSA-N 2 0 332.532 4.254 20 0 EIADRP C[N@@H+]1CCC[C@@H](CNc2[nH+]ccc3[nH]ccc32)[C@H]1c1cccs1 ZINC000663660331 1026063605 /nfs/dbraw/zinc/06/36/05/1026063605.db2.gz MBTLFTLPVWLIHX-GUYCJALGSA-N 2 0 326.469 4.119 20 0 EIADRP COc1ccc2c(c1F)CC[C@@H]2[NH2+]CC1CC[NH+](CCC(C)C)CC1 ZINC000582085445 1026112600 /nfs/dbraw/zinc/11/26/00/1026112600.db2.gz IAZGPWSYDMXCSU-IBGZPJMESA-N 2 0 348.506 4.169 20 0 EIADRP [NH2+]=C(NC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1cccc2ccccc21 ZINC001167974311 1026173380 /nfs/dbraw/zinc/17/33/80/1026173380.db2.gz VMYUHZBTSLEPRT-YQQQUEKLSA-N 2 0 333.479 4.160 20 0 EIADRP CC(C)[C@H](C[N@H+](C)C1CC[NH+](C2CCOCC2)CC1)c1ccccc1 ZINC000375670147 1026207081 /nfs/dbraw/zinc/20/70/81/1026207081.db2.gz ZSOSOSQKNJGTKJ-QFIPXVFZSA-N 2 0 344.543 4.001 20 0 EIADRP CSc1ccc([C@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000319874418 1026288601 /nfs/dbraw/zinc/28/86/01/1026288601.db2.gz SXHFRPZEAVBUCT-HNNXBMFYSA-N 2 0 327.497 4.123 20 0 EIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]C1CCN([C@@H](C)c2ccccc2)CC1 ZINC000511095819 1026390066 /nfs/dbraw/zinc/39/00/66/1026390066.db2.gz XHRJHKSRFHVXPO-MSOLQXFVSA-N 2 0 338.495 4.138 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)cs2)cs1 ZINC000152425326 1026542810 /nfs/dbraw/zinc/54/28/10/1026542810.db2.gz JGYSWIYSQSFGFW-GXTWGEPZSA-N 2 0 347.553 4.315 20 0 EIADRP Cc1cccc2[nH]c(C[NH2+][C@H](C)[C@@H]3CCC[N@@H+](C4CCC4)C3)cc21 ZINC000657428869 1026629677 /nfs/dbraw/zinc/62/96/77/1026629677.db2.gz CQLSRBFZCNQMFZ-IAGOWNOFSA-N 2 0 325.500 4.219 20 0 EIADRP Cc1ccc2cc(C[NH2+][C@@H](C)[C@H]3CCC[N@@H+](C4CCC4)C3)[nH]c2c1 ZINC000657429846 1026640954 /nfs/dbraw/zinc/64/09/54/1026640954.db2.gz LMEDEXIBHHNPJC-WMZOPIPTSA-N 2 0 325.500 4.219 20 0 EIADRP C[C@@H](CNc1cc[nH+]c2cc(F)ccc12)[N@@H+]1CCc2sccc2C1 ZINC000500461719 1026772749 /nfs/dbraw/zinc/77/27/49/1026772749.db2.gz XQSOXTHJGRRBGR-ZDUSSCGKSA-N 2 0 341.455 4.294 20 0 EIADRP COc1cccc([C@H](CNc2cc[nH+]c3cc(F)ccc23)[NH+](C)C)c1 ZINC000500474299 1026778141 /nfs/dbraw/zinc/77/81/41/1026778141.db2.gz SFPKNXUPBJIGBF-FQEVSTJZSA-N 2 0 339.414 4.097 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)c2ccccc12 ZINC000507445088 1026796956 /nfs/dbraw/zinc/79/69/56/1026796956.db2.gz BAYYOCLSXLBIEZ-INIZCTEOSA-N 2 0 326.484 4.231 20 0 EIADRP CC1(C)CC([NH2+]CC2CC[NH+](C3CCOCC3)CC2)CC(C)(C)C1 ZINC000657534795 1026989779 /nfs/dbraw/zinc/98/97/79/1026989779.db2.gz DDOKZKIDOHUEOH-UHFFFAOYSA-N 2 0 336.564 4.072 20 0 EIADRP Cc1ccccc1-c1cnc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)o1 ZINC000075713463 1027058554 /nfs/dbraw/zinc/05/85/54/1027058554.db2.gz MSOHAXAMOJYCCC-UHFFFAOYSA-N 2 0 341.499 4.202 20 0 EIADRP Cc1ncsc1CC[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168035740 1027110961 /nfs/dbraw/zinc/11/09/61/1027110961.db2.gz USSNKFGBUAGNNF-HZPDHXFCSA-N 2 0 343.540 4.025 20 0 EIADRP CCOC1CCC([NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168036225 1027151635 /nfs/dbraw/zinc/15/16/35/1027151635.db2.gz UPKTYJQKFCTTPJ-NHUPUQRLSA-N 2 0 344.543 4.365 20 0 EIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H]3CCC[C@@H]3CCCF)cc2)CC1 ZINC000342824896 1027179652 /nfs/dbraw/zinc/17/96/52/1027179652.db2.gz KLDULINDHQEJIA-NQIIRXRSSA-N 2 0 348.506 4.168 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H]2C[C@@H](C)C[C@H](c3ccccc3)C2)CC1 ZINC000159237765 1027324914 /nfs/dbraw/zinc/32/49/14/1027324914.db2.gz BKCNMJJLCKMJFJ-RCZSKKKRSA-N 2 0 344.543 4.049 20 0 EIADRP CC(C)Oc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2)cc1Cl ZINC000564988433 1027445862 /nfs/dbraw/zinc/44/58/62/1027445862.db2.gz HBXLDFOCTNSWHE-AWEZNQCLSA-N 2 0 332.875 4.437 20 0 EIADRP C[C@@H](c1ccc(OC(F)F)cc1)[N@H+](C)CC[C@@H]1CCCC[NH+]1C ZINC000441331240 1027468005 /nfs/dbraw/zinc/46/80/05/1027468005.db2.gz NMXPITKARPHRJM-HOCLYGCPSA-N 2 0 326.431 4.155 20 0 EIADRP CC[NH+](CC)Cc1cccc(N2C(C)(C)CC([NH3+])CC2(C)C)c1F ZINC001167626638 1027485802 /nfs/dbraw/zinc/48/58/02/1027485802.db2.gz PZLMDSBYIKGSFL-UHFFFAOYSA-N 2 0 335.511 4.152 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(F)c(F)c1 ZINC000112524286 1027579405 /nfs/dbraw/zinc/57/94/05/1027579405.db2.gz MAYVXVCZWWKPNB-OAHLLOKOSA-N 2 0 330.422 4.411 20 0 EIADRP CC(C)OC1CCC([NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)CC1 ZINC000090772058 1027582123 /nfs/dbraw/zinc/58/21/23/1027582123.db2.gz YHNWNNLOVFKNPK-KJJOEJEFSA-N 2 0 336.564 4.355 20 0 EIADRP CC(C)OC1CCC([NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)CC1 ZINC000090771696 1027592369 /nfs/dbraw/zinc/59/23/69/1027592369.db2.gz HFGACSNZTCBQAX-OCDPCBSRSA-N 2 0 348.531 4.014 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1OC ZINC000474877570 1027723598 /nfs/dbraw/zinc/72/35/98/1027723598.db2.gz KKDCIOPJBOOVKF-CABCVRRESA-N 2 0 348.531 4.095 20 0 EIADRP CC(C)[C@H](C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000474881474 1027728307 /nfs/dbraw/zinc/72/83/07/1027728307.db2.gz RNVHAYUHFPOBBL-QFIPXVFZSA-N 2 0 337.511 4.327 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000520460119 1028046205 /nfs/dbraw/zinc/04/62/05/1028046205.db2.gz XUCYOUUHUYTUOZ-ZQDZILKHSA-N 2 0 326.937 4.213 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCCCC[C@@H]1c1ccncc1 ZINC000346188945 1028296255 /nfs/dbraw/zinc/29/62/55/1028296255.db2.gz YNRUWINBPZBRQB-OAQYLSRUSA-N 2 0 347.466 4.088 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCCCC[C@@H]1c1ccco1 ZINC000346205022 1028330671 /nfs/dbraw/zinc/33/06/71/1028330671.db2.gz QAKRBTJUXGIRQL-LJQANCHMSA-N 2 0 336.439 4.286 20 0 EIADRP Fc1cncc([C@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)C2CC2)c1 ZINC000281137836 1028407874 /nfs/dbraw/zinc/40/78/74/1028407874.db2.gz FQUVCGXBXJZRGI-OAQYLSRUSA-N 2 0 339.458 4.057 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)C1CCCCCC1 ZINC000346567267 1028499252 /nfs/dbraw/zinc/49/92/52/1028499252.db2.gz SQMIWYFITJNTJL-SFHVURJKSA-N 2 0 344.543 4.092 20 0 EIADRP CCc1nc(C)c([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)s1 ZINC000162901183 1028532093 /nfs/dbraw/zinc/53/20/93/1028532093.db2.gz HIDUUYLYVYRGQE-OAHLLOKOSA-N 2 0 343.540 4.461 20 0 EIADRP C[C@H](CC[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1)[NH+]1CCCCC1 ZINC000346883715 1028800220 /nfs/dbraw/zinc/80/02/20/1028800220.db2.gz YYGODXWHFVDQIZ-SVFBPWRDSA-N 2 0 330.516 4.008 20 0 EIADRP C[C@H](CC[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1)[NH+]1CCCCC1 ZINC000346883713 1028800745 /nfs/dbraw/zinc/80/07/45/1028800745.db2.gz YYGODXWHFVDQIZ-SFHLNBCPSA-N 2 0 330.516 4.008 20 0 EIADRP CC(C)C[C@H](C[N@@H+]1CCC[C@H]([C@@H]2C[C@H]([NH3+])CCO2)C1)c1ccccc1 ZINC000650707697 1028834276 /nfs/dbraw/zinc/83/42/76/1028834276.db2.gz LAIKJXQJALFBMG-CBPXPLCBSA-N 2 0 344.543 4.035 20 0 EIADRP Cc1nc(F)ccc1C[NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000278305460 1028858777 /nfs/dbraw/zinc/85/87/77/1028858777.db2.gz CRIBHVANQYUSRT-UHFFFAOYSA-N 2 0 341.474 4.051 20 0 EIADRP FC1(F)CCC([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)CC1 ZINC000657771849 1028891296 /nfs/dbraw/zinc/89/12/96/1028891296.db2.gz HHNHMSVAPPAUOG-GOSISDBHSA-N 2 0 348.481 4.456 20 0 EIADRP COCCC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccc(F)cc1 ZINC000281880159 1028906622 /nfs/dbraw/zinc/90/66/22/1028906622.db2.gz GDLNGWTXJXLZPT-PXNSSMCTSA-N 2 0 336.495 4.003 20 0 EIADRP Cc1ccccc1C1([NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)CCC1 ZINC000650740555 1029045064 /nfs/dbraw/zinc/04/50/64/1029045064.db2.gz MRBOPODWOUBXLX-RBBKRZOGSA-N 2 0 348.490 4.220 20 0 EIADRP C[C@H]([NH2+]CCCn1ccnc1)c1cccc(OCc2ccccc2)c1 ZINC000151108725 1029056740 /nfs/dbraw/zinc/05/67/40/1029056740.db2.gz HCTAEXWZNBJBGF-SFHVURJKSA-N 2 0 335.451 4.203 20 0 EIADRP Clc1ccc(OCCC[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000524594818 1029099879 /nfs/dbraw/zinc/09/98/79/1029099879.db2.gz WZKKRBNYAFSNNK-SFHVURJKSA-N 2 0 336.907 4.059 20 0 EIADRP Cc1nc(F)ccc1C[NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC000278396776 1029101413 /nfs/dbraw/zinc/10/14/13/1029101413.db2.gz NDTVDHNOTOLAGP-MRXNPFEDSA-N 2 0 341.474 4.051 20 0 EIADRP C[C@@H]([NH2+]CCCn1ccnc1)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000151131497 1029141373 /nfs/dbraw/zinc/14/13/73/1029141373.db2.gz JIHSUXGPHNCCPC-CHWSQXEVSA-N 2 0 342.270 4.026 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](C[C@@H]3CC[C@H]([NH3+])[C@@H](C)C3)C[C@@H]2C)CCO1 ZINC001168087487 1029185166 /nfs/dbraw/zinc/18/51/66/1029185166.db2.gz LYMXSDHTMGCEQE-DEPSAMCGSA-N 2 0 336.564 4.102 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H]1CCCOc2cc(Cl)ccc21 ZINC000650756428 1029193487 /nfs/dbraw/zinc/19/34/87/1029193487.db2.gz ABRLSFGMVLRGRF-SFHVURJKSA-N 2 0 330.859 4.063 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[NH2+]C)c1cc(Cl)ccc1OC ZINC000650758018 1029215616 /nfs/dbraw/zinc/21/56/16/1029215616.db2.gz GVUCBNPSWSZXMW-SFHVURJKSA-N 2 0 332.875 4.309 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1oc2ccc(OC)cc2c1C ZINC000650758095 1029217167 /nfs/dbraw/zinc/21/71/67/1029217167.db2.gz ITFQKIQYJNWFDV-OAHLLOKOSA-N 2 0 338.451 4.320 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CCC1CC[NH2+]CC1 ZINC000650763021 1029271533 /nfs/dbraw/zinc/27/15/33/1029271533.db2.gz OZFBGTYMDXGHHT-MRXNPFEDSA-N 2 0 327.516 4.203 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000475219443 1029452374 /nfs/dbraw/zinc/45/23/74/1029452374.db2.gz JQHFRWXYUAWFTH-CVEARBPZSA-N 2 0 345.556 4.500 20 0 EIADRP C[NH+](C)CCC1CC[NH+](CCOc2cc(Cl)cc(Cl)c2)CC1 ZINC000525120041 1029459158 /nfs/dbraw/zinc/45/91/58/1029459158.db2.gz ODLACBZZJBGFOJ-UHFFFAOYSA-N 2 0 345.314 4.036 20 0 EIADRP C[C@H](CCc1ccsc1)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475265289 1029475042 /nfs/dbraw/zinc/47/50/42/1029475042.db2.gz IAKYENKSBAKLTK-YLJYHZDGSA-N 2 0 328.525 4.181 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c[nH+]cn2c1)C1CCC(C(F)(F)F)CC1 ZINC000459656246 1029509250 /nfs/dbraw/zinc/50/92/50/1029509250.db2.gz GIIYHVJUTFMDHR-GRTSSRMGSA-N 2 0 325.378 4.181 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cc2ccccc2s1 ZINC000446817220 1029580130 /nfs/dbraw/zinc/58/01/30/1029580130.db2.gz GYDWWPGMKKJUJB-BRWVUGGUSA-N 2 0 346.540 4.441 20 0 EIADRP CCO[C@H](C[NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1)c1ccccc1 ZINC000446838154 1029599892 /nfs/dbraw/zinc/59/98/92/1029599892.db2.gz FONBMHIUMUCABB-STZQEDGTSA-N 2 0 344.543 4.397 20 0 EIADRP CCOC1CCC([NH2+]Cc2ccccc2C[NH+]2CCCCC2)CC1 ZINC000657828543 1029618924 /nfs/dbraw/zinc/61/89/24/1029618924.db2.gz VADRWQBWTDNZQL-UHFFFAOYSA-N 2 0 330.516 4.110 20 0 EIADRP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446887256 1029632185 /nfs/dbraw/zinc/63/21/85/1029632185.db2.gz QBMPHKODPAQSAQ-CYBMUJFWSA-N 2 0 341.326 4.388 20 0 EIADRP C[N@H+](CCCSc1ccccc1Cl)C[C@@H]1CCC[NH+](C)C1 ZINC000525488188 1029653442 /nfs/dbraw/zinc/65/34/42/1029653442.db2.gz FQMHIYUCKRRMEV-OAHLLOKOSA-N 2 0 326.937 4.096 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000447019360 1029671357 /nfs/dbraw/zinc/67/13/57/1029671357.db2.gz WVIYYAZRWKQWJO-ZDUSSCGKSA-N 2 0 342.405 4.110 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1cc2cnccc2o1 ZINC000657839673 1029732927 /nfs/dbraw/zinc/73/29/27/1029732927.db2.gz YJQALDRHKRUTQW-BBWFWOEESA-N 2 0 329.488 4.237 20 0 EIADRP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000657840120 1029755768 /nfs/dbraw/zinc/75/57/68/1029755768.db2.gz MGTNJZLLVVUNOZ-FGTMMUONSA-N 2 0 340.433 4.243 20 0 EIADRP C[NH+](C)Cc1ccc(NC(=O)c2ccc(Nc3cc[nH+]cc3)cc2)cc1 ZINC000081245452 1029784192 /nfs/dbraw/zinc/78/41/92/1029784192.db2.gz LZGUNELDVHBLFT-UHFFFAOYSA-N 2 0 346.434 4.139 20 0 EIADRP Cc1cc(N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C(C)C)c2cc(F)ccc2[nH+]1 ZINC000301667442 1029784193 /nfs/dbraw/zinc/78/41/93/1029784193.db2.gz MHBVKAWVZZYYBU-SJORKVTESA-N 2 0 327.447 4.134 20 0 EIADRP Cc1cc(N2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c2cc(F)ccc2[nH+]1 ZINC000301793064 1029809322 /nfs/dbraw/zinc/80/93/22/1029809322.db2.gz RQKBFVPMNMBWAL-QRWLVFNGSA-N 2 0 339.458 4.135 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000708525636 1029812811 /nfs/dbraw/zinc/81/28/11/1029812811.db2.gz WTWGNUQRWUBCHO-YJBOKZPZSA-N 2 0 346.877 4.337 20 0 EIADRP C[C@@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]CCCC[NH+](C)C ZINC000657859439 1029845611 /nfs/dbraw/zinc/84/56/11/1029845611.db2.gz URENBCNZIVNIHQ-LBPRGKRZSA-N 2 0 336.829 4.221 20 0 EIADRP c1cc2c(s1)CCC[C@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000089215569 1029846790 /nfs/dbraw/zinc/84/67/90/1029846790.db2.gz LKQKFUOWVUTGKK-GOSISDBHSA-N 2 0 327.497 4.027 20 0 EIADRP c1c[nH]c([C@H]2CCC[N@@H+](Cc3ccccc3OC3CCCC3)C2)n1 ZINC000092071549 1029898933 /nfs/dbraw/zinc/89/89/33/1029898933.db2.gz XQEBQJZKPZQFLU-KRWDZBQOSA-N 2 0 325.456 4.111 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1ccc(F)cn1 ZINC000092739139 1029931423 /nfs/dbraw/zinc/93/14/23/1029931423.db2.gz FAVFYQFERZQTQI-SJORKVTESA-N 2 0 341.474 4.303 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2ncc(-c3cccc(F)c3)o2)CC1 ZINC000475755629 1029971839 /nfs/dbraw/zinc/97/18/39/1029971839.db2.gz NZTUGWTWZVCNJL-UHFFFAOYSA-N 2 0 345.462 4.035 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCSc2ccccc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183183515 1029989769 /nfs/dbraw/zinc/98/97/69/1029989769.db2.gz UDTWLPJFSYPALN-TXPKVOOTSA-N 2 0 330.541 4.466 20 0 EIADRP CC[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1OC ZINC000183187505 1029992012 /nfs/dbraw/zinc/99/20/12/1029992012.db2.gz UNTAPTLJWLZMII-SQGPQFPESA-N 2 0 330.516 4.389 20 0 EIADRP Cc1nc2c(s1)[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C3CCC3)C1)CCC2 ZINC000183187736 1029994858 /nfs/dbraw/zinc/99/48/58/1029994858.db2.gz DHDHOQQKKDMISZ-YSVLISHTSA-N 2 0 333.545 4.072 20 0 EIADRP C[C@H](C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1)c1cccc(Cl)c1 ZINC000525874928 1030090274 /nfs/dbraw/zinc/09/02/74/1030090274.db2.gz RSMXODSGCRGHPK-WRWLIDTKSA-N 2 0 332.919 4.392 20 0 EIADRP C[C@H](C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1)c1cccc(Cl)c1 ZINC000525874927 1030092865 /nfs/dbraw/zinc/09/28/65/1030092865.db2.gz RSMXODSGCRGHPK-SYNHAJSKSA-N 2 0 332.919 4.392 20 0 EIADRP Clc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CCCO2 ZINC000447573620 1030160973 /nfs/dbraw/zinc/16/09/73/1030160973.db2.gz SMQVCEDNULAEOK-SFHVURJKSA-N 2 0 334.891 4.018 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@H]2Cc3ccccc32)CC1 ZINC000648447429 1030164009 /nfs/dbraw/zinc/16/40/09/1030164009.db2.gz OVCIRYOJEIMYLX-GHTZIAJQSA-N 2 0 334.507 4.012 20 0 EIADRP FC(F)c1ccc(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000525985506 1030170391 /nfs/dbraw/zinc/17/03/91/1030170391.db2.gz WVFGMOFIUXKSAD-IBGZPJMESA-N 2 0 344.449 4.278 20 0 EIADRP FC1(F)CCC([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000447577528 1030205297 /nfs/dbraw/zinc/20/52/97/1030205297.db2.gz AKLJDXZMSMXKRW-REPLKXPHSA-N 2 0 334.454 4.350 20 0 EIADRP C[N@@H+](Cc1ccc2occc2c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000685417749 1030294906 /nfs/dbraw/zinc/29/49/06/1030294906.db2.gz TTZRKMDFQSYANT-FQEVSTJZSA-N 2 0 334.463 4.387 20 0 EIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cnc2ccccc2c1 ZINC000685456700 1030334795 /nfs/dbraw/zinc/33/47/95/1030334795.db2.gz KPRNXAICDAIYIC-UHFFFAOYSA-N 2 0 333.479 4.319 20 0 EIADRP CCCC[NH+]1CCC([NH2+]CCCc2c(F)cccc2Cl)CC1 ZINC000447822797 1030348873 /nfs/dbraw/zinc/34/88/73/1030348873.db2.gz RNFYZZWDFOCNBV-UHFFFAOYSA-N 2 0 326.887 4.266 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@H]2CCCc3c4ccccc4[nH]c32)CC1 ZINC000392588514 1030353728 /nfs/dbraw/zinc/35/37/28/1030353728.db2.gz JTXPHHQJKFRTAW-FQEVSTJZSA-N 2 0 325.500 4.399 20 0 EIADRP C([C@@H]1CCC2(CCCC2)O1)[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000530410443 1030382671 /nfs/dbraw/zinc/38/26/71/1030382671.db2.gz SOSOOMKJSPFJDI-UXHICEINSA-N 2 0 334.548 4.066 20 0 EIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+][C@H]1CCCSCC1 ZINC000657907116 1030454228 /nfs/dbraw/zinc/45/42/28/1030454228.db2.gz GTJZGQOJIRYUSN-KVPLUYHFSA-N 2 0 332.557 4.018 20 0 EIADRP CC(C)[N@@H+](C)CC1CC[NH+](CC[C@@H](C)OCc2ccccc2)CC1 ZINC000530496358 1030473696 /nfs/dbraw/zinc/47/36/96/1030473696.db2.gz BHHZEMHVRFUNSA-LJQANCHMSA-N 2 0 332.532 4.034 20 0 EIADRP C[C@H](C[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(F)cc1 ZINC000527111374 1030499699 /nfs/dbraw/zinc/49/96/99/1030499699.db2.gz UAGPOEQRTIZNDO-UYAOXDASSA-N 2 0 340.486 4.083 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1 ZINC000527232753 1030587257 /nfs/dbraw/zinc/58/72/57/1030587257.db2.gz NULCXCHTZSDAFQ-MSOLQXFVSA-N 2 0 344.543 4.431 20 0 EIADRP Cc1c([C@H](C)NC2CC[NH+](C3CCCC3)CC2)cnn1C(C)(C)C ZINC000191328358 1030616774 /nfs/dbraw/zinc/61/67/74/1030616774.db2.gz ZZVPANPSRNECTO-HNNXBMFYSA-N 2 0 332.536 4.004 20 0 EIADRP Cc1c([C@@H](C)NC2CC[NH+](C3CCCCC3)CC2)cnn1C(C)C ZINC000191325725 1030617188 /nfs/dbraw/zinc/61/71/88/1030617188.db2.gz MBGSLERZSIJHSX-MRXNPFEDSA-N 2 0 332.536 4.220 20 0 EIADRP C[C@H]1C[C@@H]([N@H+](C)CCCOc2cccc3ccccc32)CCN1C ZINC000530666366 1030621631 /nfs/dbraw/zinc/62/16/31/1030621631.db2.gz UVVGMLFIWSWFHE-HKUYNNGSSA-N 2 0 326.484 4.023 20 0 EIADRP C[C@H](CC1CCOCC1)[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000685665253 1030662930 /nfs/dbraw/zinc/66/29/30/1030662930.db2.gz ZWTBYODIVNWVFH-DENIHFKCSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2[nH]ccc2c1 ZINC000398179863 1030730268 /nfs/dbraw/zinc/73/02/68/1030730268.db2.gz WUURNDQBGOEJMI-UWJYYQICSA-N 2 0 333.479 4.168 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)c2sccc21 ZINC000658069521 1030815841 /nfs/dbraw/zinc/81/58/41/1030815841.db2.gz GNFZVGVGUFBMSK-DNVCBOLYSA-N 2 0 348.556 4.167 20 0 EIADRP Clc1ccc2c(c1)C[C@@H]1[C@@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)[C@H]21 ZINC000527751446 1030843015 /nfs/dbraw/zinc/84/30/15/1030843015.db2.gz YBSMDJPBJNAFKS-PWRODBHTSA-N 2 0 344.930 4.365 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)[C@H]1CCCC[C@H]1C ZINC000658164162 1030860423 /nfs/dbraw/zinc/86/04/23/1030860423.db2.gz MUAAOPDCAGWDCV-LQWHRVPQSA-N 2 0 329.532 4.098 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccc1F ZINC000658166870 1030861743 /nfs/dbraw/zinc/86/17/43/1030861743.db2.gz QIPUZONAYIIFPI-OAQYLSRUSA-N 2 0 341.474 4.174 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)[C@H](C)C2 ZINC000658168499 1030866692 /nfs/dbraw/zinc/86/66/92/1030866692.db2.gz XNBGJWUZTURZRU-WZONZLPQSA-N 2 0 349.522 4.125 20 0 EIADRP c1ccc([C@@H](C[C@H]2CCOC2)[NH2+]CCCCC[NH+]2CCCCC2)cc1 ZINC000166595216 1030920564 /nfs/dbraw/zinc/92/05/64/1030920564.db2.gz VMAXPOIJGGTOKK-IFMALSPDSA-N 2 0 344.543 4.400 20 0 EIADRP Cc1ccncc1[C@@H](C)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658320003 1030981296 /nfs/dbraw/zinc/98/12/96/1030981296.db2.gz LPPXBLLDTCDEFJ-TZIWHRDSSA-N 2 0 349.522 4.343 20 0 EIADRP c1ccc2c(c1)[nH]c1c2CCC[C@H]1[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658353357 1031021746 /nfs/dbraw/zinc/02/17/46/1031021746.db2.gz MFLBCIYVFPBGRI-OAQYLSRUSA-N 2 0 337.511 4.257 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCSc2ccc(Cl)cc2)[C@@H](C)C1 ZINC001167686156 1031030543 /nfs/dbraw/zinc/03/05/43/1031030543.db2.gz OICXACFCFZZISX-WMLDXEAASA-N 2 0 326.937 4.094 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1c(C)nn(C(C)C)c1C ZINC000892465986 1031157316 /nfs/dbraw/zinc/15/73/16/1031157316.db2.gz JKYBZOJKRNJMMD-UHFFFAOYSA-N 2 0 342.531 4.212 20 0 EIADRP CN1CC[C@@H]([NH2+]Cc2cccc3cccnc32)C[C@H]1c1ccccc1 ZINC000340213239 1031188695 /nfs/dbraw/zinc/18/86/95/1031188695.db2.gz VDTBZFZNZFNWFT-RTWAWAEBSA-N 2 0 331.463 4.160 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCSCc1cccc2ccccc21 ZINC000532477060 1031206817 /nfs/dbraw/zinc/20/68/17/1031206817.db2.gz MPKQUSUOBDUGEJ-WWMYMODYSA-N 2 0 342.552 4.391 20 0 EIADRP C[C@@H](C[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccc(F)cc1 ZINC000532480455 1031217184 /nfs/dbraw/zinc/21/71/84/1031217184.db2.gz XMIIPMXKCAJVIN-DLBZAZTESA-N 2 0 344.474 4.220 20 0 EIADRP C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000532500224 1031236224 /nfs/dbraw/zinc/23/62/24/1031236224.db2.gz MTWAJEYWZKZGLJ-QKKBWIMNSA-N 2 0 344.449 4.440 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2c(C)cc(C)c(C(C)=O)c2C)C[C@H]1C ZINC000532589644 1031322039 /nfs/dbraw/zinc/32/20/39/1031322039.db2.gz ROVIOMMRJWFCJD-APWZRJJASA-N 2 0 330.516 4.119 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cc3cccnc3o2)CC1 ZINC000449038148 1031375695 /nfs/dbraw/zinc/37/56/95/1031375695.db2.gz RXBITQALKOWGSL-QGZVFWFLSA-N 2 0 341.499 4.304 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)CCc2ccco2)CC1 ZINC000449059245 1031388721 /nfs/dbraw/zinc/38/87/21/1031388721.db2.gz PDRWXWFVJPCYFN-RBUKOAKNSA-N 2 0 340.511 4.286 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3cc4cccnc4o3)cc2)C1 ZINC000449073829 1031428103 /nfs/dbraw/zinc/42/81/03/1031428103.db2.gz AHOLKTSNWRNMGV-QGZVFWFLSA-N 2 0 349.478 4.350 20 0 EIADRP c1cc(C[NH+]2CCCCCC2)ccc1C[NH2+][C@@H]1CCOC2(CCC2)C1 ZINC000449104536 1031444354 /nfs/dbraw/zinc/44/43/54/1031444354.db2.gz GFDARGBCIIWAIU-OAQYLSRUSA-N 2 0 342.527 4.254 20 0 EIADRP CCC[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(OC)cc1 ZINC000123603959 1031475383 /nfs/dbraw/zinc/47/53/83/1031475383.db2.gz IRVFMAMBEJKZMO-OAQYLSRUSA-N 2 0 326.484 4.388 20 0 EIADRP Cc1cc(C)c2c(c1)[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)CCCO2 ZINC000123697515 1031477561 /nfs/dbraw/zinc/47/75/61/1031477561.db2.gz CWHLPFZQLNVWRL-OAQYLSRUSA-N 2 0 338.495 4.369 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCOc3ccc(F)cc32)c1 ZINC000123913700 1031492633 /nfs/dbraw/zinc/49/26/33/1031492633.db2.gz FAZSWWPAVZOLEF-HXUWFJFHSA-N 2 0 342.458 4.281 20 0 EIADRP CC[C@@H](C[C@@H](C)CO)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449172915 1031495266 /nfs/dbraw/zinc/49/52/66/1031495266.db2.gz KGIFPHQPSITMEM-SJORKVTESA-N 2 0 326.569 4.052 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2CCCC(F)(F)C2)CC1 ZINC000449183955 1031524141 /nfs/dbraw/zinc/52/41/41/1031524141.db2.gz GPAAQCYIZGOOTA-QFBILLFUSA-N 2 0 336.470 4.250 20 0 EIADRP COc1cc2ccccc2cc1C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000449218556 1031552942 /nfs/dbraw/zinc/55/29/42/1031552942.db2.gz JMDBIUBNFUMMDY-UHFFFAOYSA-N 2 0 334.463 4.200 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1cc(F)cc(F)c1 ZINC000449232838 1031564159 /nfs/dbraw/zinc/56/41/59/1031564159.db2.gz JGOXTYFLVQFORB-PMPSAXMXSA-N 2 0 336.470 4.311 20 0 EIADRP C[C@@H](Cc1coc2ccccc12)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000449253699 1031569910 /nfs/dbraw/zinc/56/99/10/1031569910.db2.gz ULRHAEYMOANIKG-KRWDZBQOSA-N 2 0 349.478 4.265 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCO[C@H](C3CC3)C2)CC1 ZINC000449247436 1031584517 /nfs/dbraw/zinc/58/45/17/1031584517.db2.gz GFEXEYBFHUKCII-MOPGFXCFSA-N 2 0 336.564 4.213 20 0 EIADRP CC(C)[C@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)C(C)(C)O ZINC000449280292 1031592778 /nfs/dbraw/zinc/59/27/78/1031592778.db2.gz XASVRVZJDGEFSJ-KRWDZBQOSA-N 2 0 326.569 4.051 20 0 EIADRP CC[C@H]([NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C)c1ccncc1 ZINC000453153555 1031630775 /nfs/dbraw/zinc/63/07/75/1031630775.db2.gz VKGGJTCVKCEZRL-WFXMLNOXSA-N 2 0 337.511 4.279 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]CC3CC[NH+](C)CC3)cs2)cs1 ZINC000126279791 1031640106 /nfs/dbraw/zinc/64/01/06/1031640106.db2.gz ULYWIGUFPQCLGU-GFCCVEGCSA-N 2 0 335.542 4.172 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)c1cc[nH]c(=O)c1 ZINC000449339382 1031657321 /nfs/dbraw/zinc/65/73/21/1031657321.db2.gz JSVIRENZLVHZIF-OAHLLOKOSA-N 2 0 333.520 4.117 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)c2sccc21 ZINC000453162597 1031663714 /nfs/dbraw/zinc/66/37/14/1031663714.db2.gz PBWLPFYIQKBPFZ-GRGSLBFTSA-N 2 0 348.556 4.044 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)c2sccc21 ZINC000453162595 1031665551 /nfs/dbraw/zinc/66/55/51/1031665551.db2.gz PBWLPFYIQKBPFZ-FCLVOEFKSA-N 2 0 348.556 4.044 20 0 EIADRP CC[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000453184459 1031688654 /nfs/dbraw/zinc/68/86/54/1031688654.db2.gz ZZHTURGNDMOUHT-CBQOVEMMSA-N 2 0 337.511 4.423 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000453256133 1031779637 /nfs/dbraw/zinc/77/96/37/1031779637.db2.gz QQBARDLRMJOYEQ-UNMCSNQZSA-N 2 0 337.511 4.425 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000453256131 1031779875 /nfs/dbraw/zinc/77/98/75/1031779875.db2.gz QQBARDLRMJOYEQ-IRLDBZIGSA-N 2 0 337.511 4.425 20 0 EIADRP Cc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000453387505 1031896201 /nfs/dbraw/zinc/89/62/01/1031896201.db2.gz FGGQTRAFOPNNIL-ROUUACIJSA-N 2 0 326.484 4.347 20 0 EIADRP CCC[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000531972393 1031909330 /nfs/dbraw/zinc/90/93/30/1031909330.db2.gz OBLIUZGOOVTXOM-RHSMWYFYSA-N 2 0 328.422 4.478 20 0 EIADRP Cc1cccc([C@@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)c1 ZINC000453408961 1031945309 /nfs/dbraw/zinc/94/53/09/1031945309.db2.gz WDWORXQOQJFWLT-QZTJIDSGSA-N 2 0 326.484 4.347 20 0 EIADRP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]CCCC[N@H+](C)C2CC2)c1 ZINC000453397467 1031966261 /nfs/dbraw/zinc/96/62/61/1031966261.db2.gz JLUHOZONFVCWPQ-CQSZACIVSA-N 2 0 326.431 4.121 20 0 EIADRP COc1ccc2cc([C@@H](C)[NH2+]CCCC[N@H+](C)C3CC3)ccc2c1 ZINC000453443333 1031970206 /nfs/dbraw/zinc/97/02/06/1031970206.db2.gz YRUODZHKAHDMOQ-MRXNPFEDSA-N 2 0 326.484 4.373 20 0 EIADRP CC(C)C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1cccs1 ZINC000459371778 1031978567 /nfs/dbraw/zinc/97/85/67/1031978567.db2.gz KEYJLCWPPMHRHI-GOSISDBHSA-N 2 0 329.513 4.489 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@](C)(Cc1ccccc1)C1CC1 ZINC000449782354 1032005621 /nfs/dbraw/zinc/00/56/21/1032005621.db2.gz ZCBKERZFSFTHKD-JOCHJYFZSA-N 2 0 346.478 4.077 20 0 EIADRP CC(C)(C)c1cccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC001168264685 1032026817 /nfs/dbraw/zinc/02/68/17/1032026817.db2.gz LTKYTYDHUCOSQM-NQIIRXRSSA-N 2 0 326.528 4.433 20 0 EIADRP C[C@H]([NH2+]CCc1c(F)cccc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000544424368 1032055019 /nfs/dbraw/zinc/05/50/19/1032055019.db2.gz LGDLBJZRLUBRJV-LSDHHAIUSA-N 2 0 338.898 4.264 20 0 EIADRP C[N@H+](CCCOc1ccc2ccccc2c1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000512569909 1033382645 /nfs/dbraw/zinc/38/26/45/1033382645.db2.gz RHURTFWHMZOXSR-WCRBZPEASA-N 2 0 338.495 4.166 20 0 EIADRP C[N@H+](Cc1ccc(-c2ccsc2)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000512583146 1033428651 /nfs/dbraw/zinc/42/86/51/1033428651.db2.gz QZWDVOAEEQVZFI-YOFSQIOKSA-N 2 0 326.509 4.472 20 0 EIADRP FC1(F)CCC([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000512632312 1033557038 /nfs/dbraw/zinc/55/70/38/1033557038.db2.gz YZSBOIQZBGAPKD-MISYRCLQSA-N 2 0 348.481 4.455 20 0 EIADRP c1cc2c(cc[nH+]c2N2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)[nH]1 ZINC000663937197 1033703551 /nfs/dbraw/zinc/70/35/51/1033703551.db2.gz YZSKRQLIDBIDIV-UHFFFAOYSA-N 2 0 346.478 4.055 20 0 EIADRP c1ccc(C[N@@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)C2CC2)nc1 ZINC000411448447 1033893891 /nfs/dbraw/zinc/89/38/91/1033893891.db2.gz RIRKXDBIEYLUSK-UHFFFAOYSA-N 2 0 335.495 4.232 20 0 EIADRP C[C@@H]1[N@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CCC12CCOCC2 ZINC000411527754 1033966028 /nfs/dbraw/zinc/96/60/28/1033966028.db2.gz QXXRKLWYTSWXMK-IBGZPJMESA-N 2 0 342.527 4.064 20 0 EIADRP c1cc(C[NH+]2CCCCC2)cc(C[NH+]2CCC(OC3CCC3)CC2)c1 ZINC000419301992 1034138403 /nfs/dbraw/zinc/13/84/03/1034138403.db2.gz LWWLSFVKIXZZKQ-UHFFFAOYSA-N 2 0 342.527 4.206 20 0 EIADRP c1ccc2nc(CC[NH2+]C3CC[NH+](C4CCCCC4)CC3)ccc2c1 ZINC000513057516 1034383316 /nfs/dbraw/zinc/38/33/16/1034383316.db2.gz MAHBCYJSJIBZHC-UHFFFAOYSA-N 2 0 337.511 4.164 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccc3c(c2)OCO3)c1 ZINC000163543265 1034480250 /nfs/dbraw/zinc/48/02/50/1034480250.db2.gz VXHNWWHIZSFGRX-MRXNPFEDSA-N 2 0 340.467 4.108 20 0 EIADRP c1ccc(C(CC[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c2ccccc2)cc1 ZINC000246525060 1034721694 /nfs/dbraw/zinc/72/16/94/1034721694.db2.gz KVWMXYLAHDLPIP-YADHBBJMSA-N 2 0 334.507 4.425 20 0 EIADRP C[N@H+](C/C=C\c1ccc(F)cc1)C1CCN(Cc2ccccc2)CC1 ZINC000513496995 1034987245 /nfs/dbraw/zinc/98/72/45/1034987245.db2.gz OUWZEPXQWUHAFW-YVMONPNESA-N 2 0 338.470 4.435 20 0 EIADRP C/C(=C/c1ccc(Cl)cc1)C[NH2+]C[C@@H]1CCCn2cc(C)nc21 ZINC000513526804 1035020879 /nfs/dbraw/zinc/02/08/79/1035020879.db2.gz QFNJNVYAEMNPIM-QXSWTLKVSA-N 2 0 329.875 4.415 20 0 EIADRP C[C@H](c1ccc(F)cc1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501043965 1035355652 /nfs/dbraw/zinc/35/56/52/1035355652.db2.gz FHXBUQYGVIIHDK-MRXNPFEDSA-N 2 0 327.447 4.130 20 0 EIADRP C[C@H](C[NH+]1CCC(C[NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000501116568 1035381538 /nfs/dbraw/zinc/38/15/38/1035381538.db2.gz KMEXOADIORTRBO-CQSZACIVSA-N 2 0 328.422 4.083 20 0 EIADRP Cc1cc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)ccc1Br ZINC000501166592 1035391431 /nfs/dbraw/zinc/39/14/31/1035391431.db2.gz YUGGELRNNXGZQT-UHFFFAOYSA-N 2 0 339.321 4.062 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000501384134 1035436170 /nfs/dbraw/zinc/43/61/70/1035436170.db2.gz WRWVEMQVKNAFDD-YOUFYPILSA-N 2 0 329.532 4.065 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000501408072 1035440603 /nfs/dbraw/zinc/44/06/03/1035440603.db2.gz TXJQPTJSMYJFAH-RVSUXWIQSA-N 2 0 338.417 4.325 20 0 EIADRP C[NH+]1CCC(C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000501470653 1035450196 /nfs/dbraw/zinc/45/01/96/1035450196.db2.gz XXBXBXUXEODEFG-UHFFFAOYSA-N 2 0 344.449 4.028 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)CC1 ZINC000501476018 1035453236 /nfs/dbraw/zinc/45/32/36/1035453236.db2.gz UDEKJNIWDGWMHY-IRLDBZIGSA-N 2 0 343.559 4.456 20 0 EIADRP CC[C@H]([NH2+]C1CC[NH+](C(C)C)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000513717751 1035482818 /nfs/dbraw/zinc/48/28/18/1035482818.db2.gz RMMFHLQOYNNGQP-KRWDZBQOSA-N 2 0 344.421 4.499 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(SC(F)F)cc2)C1 ZINC000151137085 1035509196 /nfs/dbraw/zinc/50/91/96/1035509196.db2.gz WJAHMMKECJIULY-KBPBESRZSA-N 2 0 328.472 4.384 20 0 EIADRP CC[C@H](c1ccc(Cl)cc1)[NH+]1CCC([C@@H]2OCCC[C@H]2[NH3+])CC1 ZINC000420374530 1035544403 /nfs/dbraw/zinc/54/44/03/1035544403.db2.gz HLEMUUBLFXBLHT-QRVBRYPASA-N 2 0 336.907 4.009 20 0 EIADRP CC[C@H](c1ccc(Cl)cc1)[NH+]1CCC([C@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420394525 1035567911 /nfs/dbraw/zinc/56/79/11/1035567911.db2.gz RURRJJRNZRHTMW-GUDVDZBRSA-N 2 0 336.907 4.009 20 0 EIADRP CC[C@H](Cc1ccc(Cl)cc1)[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000595051394 1035571188 /nfs/dbraw/zinc/57/11/88/1035571188.db2.gz OWCXXNVTKRYHTI-QGZVFWFLSA-N 2 0 340.964 4.078 20 0 EIADRP C[C@H](C[N@@H+]1CCC[C@@H]([NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000501951052 1035751559 /nfs/dbraw/zinc/75/15/59/1035751559.db2.gz OBQYKHKYSRXORP-RHSMWYFYSA-N 2 0 328.422 4.225 20 0 EIADRP C[N@@H+](Cc1ccc(-c2ccccc2Cl)o1)CC1CC[NH+](C)CC1 ZINC000513730290 1035844914 /nfs/dbraw/zinc/84/49/14/1035844914.db2.gz XJWBCPVHVAQBQZ-UHFFFAOYSA-N 2 0 332.875 4.374 20 0 EIADRP Cc1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000485467042 1035903634 /nfs/dbraw/zinc/90/36/34/1035903634.db2.gz OMMNZRQVOAJEMQ-UHFFFAOYSA-N 2 0 334.507 4.483 20 0 EIADRP C[N@@H+](Cc1cc(F)cc(Cl)c1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000485705324 1036182131 /nfs/dbraw/zinc/18/21/31/1036182131.db2.gz OHFLESZRSNUZLS-UHFFFAOYSA-N 2 0 347.865 4.223 20 0 EIADRP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421366655 1036312140 /nfs/dbraw/zinc/31/21/40/1036312140.db2.gz CZEKPCRYGXYGDQ-NVPAJSRCSA-N 2 0 328.422 4.099 20 0 EIADRP COCC[C@H]1CCC[C@H]1[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000502696677 1036509366 /nfs/dbraw/zinc/50/93/66/1036509366.db2.gz LIEJEAAXIPKRNQ-FGZHOGPDSA-N 2 0 344.543 4.357 20 0 EIADRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000502699173 1036521508 /nfs/dbraw/zinc/52/15/08/1036521508.db2.gz XMMPUJWYZLAFAR-BVYCBKJFSA-N 2 0 344.543 4.356 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000502723869 1036583261 /nfs/dbraw/zinc/58/32/61/1036583261.db2.gz RZINJQFLCBFOSQ-DXIQSLLYSA-N 2 0 344.543 4.356 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486479362 1036728031 /nfs/dbraw/zinc/72/80/31/1036728031.db2.gz VFVYEWZFCSNSIK-AWDZXFJFSA-N 2 0 334.507 4.290 20 0 EIADRP COc1ccc([C@H]([NH2+]C2CCC([NH+](C)C)CC2)c2ccccc2)cc1 ZINC000513758688 1036736414 /nfs/dbraw/zinc/73/64/14/1036736414.db2.gz BIXFOFPALASBBW-QETWGEEDSA-N 2 0 338.495 4.247 20 0 EIADRP COc1ccc([C@@H]([NH2+]Cc2cccc(C[NH+](C)C)c2)C(C)C)c(F)c1 ZINC000421819389 1036774535 /nfs/dbraw/zinc/77/45/35/1036774535.db2.gz GWCXKSSQVSSKSC-NRFANRHFSA-N 2 0 344.474 4.383 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccncc1Cl ZINC000421831188 1036788006 /nfs/dbraw/zinc/78/80/06/1036788006.db2.gz DJKAUIZMBRFTIW-KLAILNCOSA-N 2 0 335.923 4.429 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(Oc3cccnc3)cc2)CC1 ZINC000489801447 1036860476 /nfs/dbraw/zinc/86/04/76/1036860476.db2.gz ORYRBHAHWYTOOU-KRWDZBQOSA-N 2 0 339.483 4.399 20 0 EIADRP COc1ccc2cc(C[NH2+]CCCC[NH+]3CCC(C)CC3)ccc2c1 ZINC000589837054 1036880798 /nfs/dbraw/zinc/88/07/98/1036880798.db2.gz YXPHQWMQOZFMMO-UHFFFAOYSA-N 2 0 340.511 4.450 20 0 EIADRP CCCC[N@H+](CCCN1CC[NH+](C(C)C)CC1)[C@H](C)c1ccc(C)o1 ZINC000669688943 1036892226 /nfs/dbraw/zinc/89/22/26/1036892226.db2.gz GGASWIXUOBEAFH-HXUWFJFHSA-N 2 0 349.563 4.167 20 0 EIADRP CC[N@H+](CCO[C@@H]1CCCC[C@H]1C)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999653 1036917922 /nfs/dbraw/zinc/91/79/22/1036917922.db2.gz QIMFCIVCMWQDNE-WIYYLYMNSA-N 2 0 332.532 4.165 20 0 EIADRP CC[N@H+](CCCOc1ccccc1)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999348 1036918225 /nfs/dbraw/zinc/91/82/25/1036918225.db2.gz ANIMGZCWVNIFCC-UHFFFAOYSA-N 2 0 326.484 4.039 20 0 EIADRP CCOc1ccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cc1F ZINC000486990715 1036936780 /nfs/dbraw/zinc/93/67/80/1036936780.db2.gz QVLXUPLZURGQSY-UHFFFAOYSA-N 2 0 344.474 4.354 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000271842565 1037030213 /nfs/dbraw/zinc/03/02/13/1037030213.db2.gz HEFGNJANJCOYEI-OAHLLOKOSA-N 2 0 341.524 4.339 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]CC2=CC[N@H+](C)CC2)cc1 ZINC000271868078 1037041027 /nfs/dbraw/zinc/04/10/27/1037041027.db2.gz LWGUHTCFYQMMPJ-KRWDZBQOSA-N 2 0 336.479 4.275 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)CC1 ZINC000271867010 1037041373 /nfs/dbraw/zinc/04/13/73/1037041373.db2.gz LSMOULNSPCTIJP-QGZVFWFLSA-N 2 0 339.508 4.039 20 0 EIADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000271866949 1037042547 /nfs/dbraw/zinc/04/25/47/1037042547.db2.gz LPYDMWJUKRMALD-ZDUSSCGKSA-N 2 0 344.446 4.254 20 0 EIADRP FCCCCC[NH+]1CCCC2(CCC[N@@H+](CCCCCF)C2)C1 ZINC000572984161 1037087743 /nfs/dbraw/zinc/08/77/43/1037087743.db2.gz QZTUPDCSXWPKHG-UHFFFAOYSA-N 2 0 330.507 4.444 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cc(-c3ccc(F)cc3)no2)CC1 ZINC000590786388 1037167938 /nfs/dbraw/zinc/16/79/38/1037167938.db2.gz VDFCOONVIJRAKJ-UHFFFAOYSA-N 2 0 345.462 4.033 20 0 EIADRP Cc1nc(C)c(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)s1 ZINC000272419339 1037183364 /nfs/dbraw/zinc/18/33/64/1037183364.db2.gz NATYPDVVJZRJFA-LDLYASANSA-N 2 0 341.524 4.045 20 0 EIADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@@H](C)c1nc2ccccc2s1 ZINC000272625654 1037249567 /nfs/dbraw/zinc/24/95/67/1037249567.db2.gz ZGHKGNIQZYIPGX-HUUCEWRRSA-N 2 0 331.529 4.110 20 0 EIADRP CSc1ccc(C[NH+]2CCN(c3cc[nH+]c4ccccc43)CC2)cc1 ZINC000599922950 1037263321 /nfs/dbraw/zinc/26/33/21/1037263321.db2.gz XGQLKRYTQYUPJS-UHFFFAOYSA-N 2 0 349.503 4.279 20 0 EIADRP COc1ccc2cc(C[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)ccc2c1 ZINC000604770811 1037510284 /nfs/dbraw/zinc/51/02/84/1037510284.db2.gz JYBOZZVDAKZFIZ-HXUWFJFHSA-N 2 0 328.500 4.304 20 0 EIADRP CC(C)(C)[C@@H]1C[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)CS1 ZINC000488467717 1037614943 /nfs/dbraw/zinc/61/49/43/1037614943.db2.gz WYKVWFNQDWJZQI-MOPGFXCFSA-N 2 0 332.557 4.292 20 0 EIADRP Fc1ccc2c(c1)CC[C@@H]([NH2+]C1CC[NH+](C[C@H]3CC=CCC3)CC1)C2 ZINC001168420165 1037719272 /nfs/dbraw/zinc/71/92/72/1037719272.db2.gz JTBWVIILSAUBRS-HTAPYJJXSA-N 2 0 342.502 4.093 20 0 EIADRP COC[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(Cl)cc1 ZINC000488736167 1037731803 /nfs/dbraw/zinc/73/18/03/1037731803.db2.gz PKDSWMXZWNDWAP-LJQANCHMSA-N 2 0 338.923 4.273 20 0 EIADRP Cc1ccc(CCC[N@@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)cc1 ZINC000503410483 1037742963 /nfs/dbraw/zinc/74/29/63/1037742963.db2.gz BBAHWPBLWJNGMX-FQEVSTJZSA-N 2 0 337.511 4.340 20 0 EIADRP C[C@H]([NH2+]C(C)(C)CN[C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1)c1ccccc1 ZINC000422733043 1037809387 /nfs/dbraw/zinc/80/93/87/1037809387.db2.gz QLWLXHJNNKYTJB-ZIBCJSCZSA-N 2 0 343.559 4.016 20 0 EIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+][C@H](C)CCCC[NH3+])cc1 ZINC000422714176 1037810351 /nfs/dbraw/zinc/81/03/51/1037810351.db2.gz KTJNLWMAMIYZGC-IIBYNOLFSA-N 2 0 344.474 4.225 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@@H](C)C[C@H](C)[NH3+])ccc1OCc1ccccc1 ZINC000422717332 1037813003 /nfs/dbraw/zinc/81/30/03/1037813003.db2.gz KQLDEQYVZVUOHS-ULQDDVLXSA-N 2 0 342.483 4.051 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000422747400 1037824004 /nfs/dbraw/zinc/82/40/04/1037824004.db2.gz YLEUNGLZSPPJOR-DVOMOZLQSA-N 2 0 347.503 4.296 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](Cc1ccccc1)c1ccccc1 ZINC000422773958 1037830137 /nfs/dbraw/zinc/83/01/37/1037830137.db2.gz ZLXBJHIPXYZSQE-JPYJTQIMSA-N 2 0 345.490 4.483 20 0 EIADRP CCC(CC)(CN[C@@H](C)c1c[nH+]ccc1N)[NH2+][C@@H](C)c1ccccc1 ZINC000422773359 1037830867 /nfs/dbraw/zinc/83/08/67/1037830867.db2.gz YMRSGMWLXFLHJH-IRXDYDNUSA-N 2 0 340.515 4.054 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@H+](C)C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000414690886 1037833078 /nfs/dbraw/zinc/83/30/78/1037833078.db2.gz AXIFKXRPEDTUOG-XIRDDKMYSA-N 2 0 343.540 4.499 20 0 EIADRP CCC[C@H](CCc1ccccc1)[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422783684 1037833326 /nfs/dbraw/zinc/83/33/26/1037833326.db2.gz OQVBGFXHUUCMSH-VQIMIIECSA-N 2 0 325.500 4.301 20 0 EIADRP CCC[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1 ZINC000422765899 1037833899 /nfs/dbraw/zinc/83/38/99/1037833899.db2.gz PRRYTCUECHCNKI-VWPQPMDRSA-N 2 0 336.479 4.373 20 0 EIADRP C[C@H](OCCC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1)c1ccccc1 ZINC000422788269 1037834890 /nfs/dbraw/zinc/83/48/90/1037834890.db2.gz QXSPUWZPVAEKIW-ZIBCJSCZSA-N 2 0 330.516 4.055 20 0 EIADRP c1csc([C@H]([NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C2CC2)c1 ZINC000422796663 1037835979 /nfs/dbraw/zinc/83/59/79/1037835979.db2.gz KCJYFCAMMFELOX-PWIZWCRZSA-N 2 0 340.492 4.045 20 0 EIADRP CCc1ccc(C(C)(C)C[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)cc1 ZINC000422832311 1037842848 /nfs/dbraw/zinc/84/28/48/1037842848.db2.gz FPDWOPFJRICSAD-HNNXBMFYSA-N 2 0 325.500 4.040 20 0 EIADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccccc1COCc1ccccc1 ZINC000422862317 1037848061 /nfs/dbraw/zinc/84/80/61/1037848061.db2.gz NMSLPLTUKOUUBW-SIKLNZKXSA-N 2 0 338.495 4.011 20 0 EIADRP CC[NH+](CC)[C@H](CN[C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)c1ccsc1 ZINC000422868785 1037855399 /nfs/dbraw/zinc/85/53/99/1037855399.db2.gz WAUGUVVCDYFZMO-UAFMIMERSA-N 2 0 349.588 4.031 20 0 EIADRP COc1ccccc1Oc1ccc(C[NH2+]C2CCC(C[NH3+])CC2)cc1 ZINC000422913128 1037865602 /nfs/dbraw/zinc/86/56/02/1037865602.db2.gz XWCHKLCIBCEMQT-UHFFFAOYSA-N 2 0 340.467 4.095 20 0 EIADRP CC[C@H](C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)Oc1cccc(Cl)c1 ZINC000422927384 1037870603 /nfs/dbraw/zinc/87/06/03/1037870603.db2.gz GKJPMZSJTQCCLK-SUMWQHHRSA-N 2 0 347.890 4.010 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000422940965 1037876501 /nfs/dbraw/zinc/87/65/01/1037876501.db2.gz ULCPFYQNDVTPHL-JKIFEVAISA-N 2 0 329.513 4.157 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc(OC2CCCC2)cc1 ZINC000422948015 1037885644 /nfs/dbraw/zinc/88/56/44/1037885644.db2.gz RLMMWSBPDJUXMM-HNNXBMFYSA-N 2 0 339.483 4.021 20 0 EIADRP CC[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cccs1 ZINC000422949947 1037886587 /nfs/dbraw/zinc/88/65/87/1037886587.db2.gz VBLGWQYNYIYOFX-BXWFABGCSA-N 2 0 328.481 4.045 20 0 EIADRP COc1cc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)ccc1OCCC(C)C ZINC000422949603 1037887461 /nfs/dbraw/zinc/88/74/61/1037887461.db2.gz UMKTZHGIZRNVEE-UBLGTCEWSA-N 2 0 346.515 4.054 20 0 EIADRP CC[C@@H](Cc1ccc(Cl)cc1)[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422982772 1037895146 /nfs/dbraw/zinc/89/51/46/1037895146.db2.gz RGPSCLCPZWDWHV-GUYCJALGSA-N 2 0 331.891 4.174 20 0 EIADRP [NH3+]CC1CCC([NH2+]CCc2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000423018393 1037902064 /nfs/dbraw/zinc/90/20/64/1037902064.db2.gz YUJXWZKYIRZPDA-UHFFFAOYSA-N 2 0 349.931 4.113 20 0 EIADRP Cc1cc([C@@H]([NH2+][C@H](C)c2ccc(C[NH3+])nc2C)C2CC2)ccc1F ZINC000423015957 1037902710 /nfs/dbraw/zinc/90/27/10/1037902710.db2.gz RXHUBUWRLAXTHD-VLIAUNLRSA-N 2 0 327.447 4.098 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H]1CCCOc2cc(Cl)ccc21 ZINC000423019844 1037908300 /nfs/dbraw/zinc/90/83/00/1037908300.db2.gz XKHGJYMLOKTAIR-SCLBCKFNSA-N 2 0 345.874 4.067 20 0 EIADRP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423022686 1037909921 /nfs/dbraw/zinc/90/99/21/1037909921.db2.gz IEIHEQBJWKLZSN-JZAZDWQXSA-N 2 0 326.406 4.070 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC1(c2ccc(F)cc2Cl)CC1 ZINC000423025269 1037910152 /nfs/dbraw/zinc/91/01/52/1037910152.db2.gz NVQNHXBYXLOIMQ-GFCCVEGCSA-N 2 0 347.865 4.024 20 0 EIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@H](C)c1ccccc1C(F)(F)F ZINC000423022685 1037910583 /nfs/dbraw/zinc/91/05/83/1037910583.db2.gz IEIHEQBJWKLZSN-DRWKLNATSA-N 2 0 326.406 4.070 20 0 EIADRP Cc1cccc(C)c1[C@H](C)[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423041196 1037919584 /nfs/dbraw/zinc/91/95/84/1037919584.db2.gz WJSURXSWENLTEE-LQBOVUBWSA-N 2 0 336.479 4.210 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1CCCOc2c(Cl)cccc21 ZINC000423035793 1037920081 /nfs/dbraw/zinc/92/00/81/1037920081.db2.gz ZGZJIJROBQNUGC-UGSOOPFHSA-N 2 0 345.874 4.067 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000423056244 1037926093 /nfs/dbraw/zinc/92/60/93/1037926093.db2.gz XEDYSUKTZDRXLB-BZNIZROVSA-N 2 0 343.284 4.146 20 0 EIADRP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[NH2+]C1)c1cc(F)cc(Br)c1 ZINC000423064189 1037927729 /nfs/dbraw/zinc/92/77/29/1037927729.db2.gz QUYSIMHCKZXHCG-WQGACYEGSA-N 2 0 343.284 4.017 20 0 EIADRP [NH3+][C@@H]1C[C@@H]([NH2+]C2CC(F)(c3cccc(Cl)c3)C2)c2ccccc21 ZINC000423095219 1037952616 /nfs/dbraw/zinc/95/26/16/1037952616.db2.gz LQOVSEIZJIOQAA-NBLCHNQSSA-N 2 0 330.834 4.402 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423093517 1037953916 /nfs/dbraw/zinc/95/39/16/1037953916.db2.gz HWBFPTYWWUIVQD-DDUZABMNSA-N 2 0 329.875 4.099 20 0 EIADRP Clc1ccc(CCCC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)s1 ZINC000423100114 1037959099 /nfs/dbraw/zinc/95/90/99/1037959099.db2.gz GGORHEHPTGXDGH-ARFHVFGLSA-N 2 0 326.937 4.235 20 0 EIADRP COCCC[C@H](C[NH2+][C@H]1CCCCC[C@H]1[NH3+])c1ccc(Cl)cc1 ZINC000423100151 1037959314 /nfs/dbraw/zinc/95/93/14/1037959314.db2.gz GJSCORDWAFUPEZ-QRQLOZEOSA-N 2 0 338.923 4.100 20 0 EIADRP CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423101825 1037961509 /nfs/dbraw/zinc/96/15/09/1037961509.db2.gz DFRGJPBIGBFZBZ-RECXWPGBSA-N 2 0 336.479 4.072 20 0 EIADRP FC(F)(F)c1cccc([C@@H]2CCC[C@H]2[NH2+][C@H]2CCC[NH2+]CC2)c1 ZINC000423103144 1037963410 /nfs/dbraw/zinc/96/34/10/1037963410.db2.gz KSESKEJSJVRLSR-YESZJQIVSA-N 2 0 326.406 4.073 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+]C[C@@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000423123781 1037967450 /nfs/dbraw/zinc/96/74/50/1037967450.db2.gz FGQXWCFSMYHNJC-OXQOHEQNSA-N 2 0 346.902 4.315 20 0 EIADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000423126484 1037972916 /nfs/dbraw/zinc/97/29/16/1037972916.db2.gz IVPJBMLHGHSKPK-YRNRMSPPSA-N 2 0 346.902 4.313 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@H](C)Oc1ccc(C(C)C)cc1 ZINC000423105891 1037980761 /nfs/dbraw/zinc/98/07/61/1037980761.db2.gz JCNPTQBCQNICDJ-JKSUJKDBSA-N 2 0 341.499 4.090 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000423112098 1037988610 /nfs/dbraw/zinc/98/86/10/1037988610.db2.gz XBMHIUHDDQEUEK-SJJHQCBESA-N 2 0 326.406 4.201 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]CC1(c2ccc(Br)s2)CCC1 ZINC000423108730 1037989005 /nfs/dbraw/zinc/98/90/05/1037989005.db2.gz ROGFQYUBDDRSHL-LBPRGKRZSA-N 2 0 345.350 4.039 20 0 EIADRP [NH3+]CC1CCC([NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC000423108949 1037992089 /nfs/dbraw/zinc/99/20/89/1037992089.db2.gz RXMDKAFWGZBFEH-UHFFFAOYSA-N 2 0 335.904 4.071 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)cc1 ZINC000503942104 1038030230 /nfs/dbraw/zinc/03/02/30/1038030230.db2.gz BHYUYNNYJUSYNH-UHFFFAOYSA-N 2 0 338.495 4.184 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423209651 1038038502 /nfs/dbraw/zinc/03/85/02/1038038502.db2.gz JBSIBYPKCVVPDS-NVXWUHKLSA-N 2 0 341.524 4.085 20 0 EIADRP Cc1ccccc1COc1ccc([C@@H](C)[NH2+]C2CCC([NH3+])CC2)cc1 ZINC000423211840 1038040764 /nfs/dbraw/zinc/04/07/64/1038040764.db2.gz HKKUJFRMFKUCFD-MDMXATFFSA-N 2 0 338.495 4.495 20 0 EIADRP Clc1ccccc1C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccsc1 ZINC000423214529 1038058075 /nfs/dbraw/zinc/05/80/75/1038058075.db2.gz PBOWCSSJHVZKLA-KSSFIOAISA-N 2 0 334.916 4.275 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc2ccccc2c1OC(F)F ZINC000423218179 1038062538 /nfs/dbraw/zinc/06/25/38/1038062538.db2.gz VHGJKGMAGBFVBQ-ZIAGYGMSSA-N 2 0 334.410 4.091 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc2ccccc2c1OC(F)F ZINC000423216075 1038062750 /nfs/dbraw/zinc/06/27/50/1038062750.db2.gz NYYKJWSDNNZZFI-DZKIICNBSA-N 2 0 348.437 4.480 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1)[C@@H]1CCC[NH2+]C1 ZINC000423221723 1038064787 /nfs/dbraw/zinc/06/47/87/1038064787.db2.gz XULZJJLFIXHKMM-KMANFZQXSA-N 2 0 340.433 4.319 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1)[C@@H]1CCC[NH2+]C1 ZINC000423221721 1038067535 /nfs/dbraw/zinc/06/75/35/1038067535.db2.gz XULZJJLFIXHKMM-AAJLLMFJSA-N 2 0 340.433 4.319 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423260850 1038072083 /nfs/dbraw/zinc/07/20/83/1038072083.db2.gz QXNIENKYUAQWJZ-YJBOKZPZSA-N 2 0 343.540 4.083 20 0 EIADRP Fc1ccc([C@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2cnc3ccccc3c2)cc1 ZINC000423245461 1038075181 /nfs/dbraw/zinc/07/51/81/1038075181.db2.gz IYGYTGWBKMKOGE-ZHRRBRCNSA-N 2 0 349.453 4.053 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccsc1 ZINC000423243878 1038077771 /nfs/dbraw/zinc/07/77/71/1038077771.db2.gz GSOKLPGHRYLRNH-KBXCAEBGSA-N 2 0 334.916 4.275 20 0 EIADRP C[N@H+](CCCOc1cccc(C(C)(C)C)c1)C[C@H]1CCC[NH+](C)C1 ZINC000607358495 1038078453 /nfs/dbraw/zinc/07/84/53/1038078453.db2.gz PGUNULQIPFHEAM-SFHVURJKSA-N 2 0 332.532 4.027 20 0 EIADRP CC[C@@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000606467598 1038091862 /nfs/dbraw/zinc/09/18/62/1038091862.db2.gz WBPFHAHJBSYVAO-OAQYLSRUSA-N 2 0 344.474 4.050 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cc(Br)cs1 ZINC000423293464 1038096048 /nfs/dbraw/zinc/09/60/48/1038096048.db2.gz RKBDMDIJOQPFMN-WDEREUQCSA-N 2 0 339.302 4.381 20 0 EIADRP COCCC[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc(F)cc1 ZINC000423294313 1038119516 /nfs/dbraw/zinc/11/95/16/1038119516.db2.gz TZTMYEMHKIJTTG-MGPUTAFESA-N 2 0 330.447 4.103 20 0 EIADRP COc1cc([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)ccc1SC ZINC000423295902 1038123849 /nfs/dbraw/zinc/12/38/49/1038123849.db2.gz XSQAJXOUXNRECJ-UONOGXRCSA-N 2 0 330.497 4.288 20 0 EIADRP Fc1ccc([C@@H]([NH2+]CC2=CC[NH2+]CC2)c2ccccc2Cl)cc1 ZINC000423330497 1038141837 /nfs/dbraw/zinc/14/18/37/1038141837.db2.gz BZNVZGMLMOEZBA-LJQANCHMSA-N 2 0 330.834 4.078 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1cccs1 ZINC000423337267 1038151243 /nfs/dbraw/zinc/15/12/43/1038151243.db2.gz ALVAGFWUPREOFL-QGZVFWFLSA-N 2 0 332.900 4.195 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423340182 1038158291 /nfs/dbraw/zinc/15/82/91/1038158291.db2.gz VLPGAOILGKWTMT-DJJJIMSYSA-N 2 0 347.503 4.298 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H]2CC[C@H](C[NH3+])C2)CCC3)cc1 ZINC000574310511 1038165545 /nfs/dbraw/zinc/16/55/45/1038165545.db2.gz STVQCSMUMUECFI-BHYGNILZSA-N 2 0 341.524 4.213 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423361251 1038174795 /nfs/dbraw/zinc/17/47/95/1038174795.db2.gz AAPQQHJPILMACV-VCBZYWHSSA-N 2 0 328.431 4.267 20 0 EIADRP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423366605 1038185673 /nfs/dbraw/zinc/18/56/73/1038185673.db2.gz BUXJYIZZUXDHJP-CYBMUJFWSA-N 2 0 334.385 4.029 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[NH2+][C@H](C)C2)CCC3)cc1 ZINC000423379262 1038188711 /nfs/dbraw/zinc/18/87/11/1038188711.db2.gz MWODHEHMDOJCOR-DJIMGWMZSA-N 2 0 341.524 4.226 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC000423376835 1038205508 /nfs/dbraw/zinc/20/55/08/1038205508.db2.gz LHVAFRSKKRPQJL-OBJOEFQTSA-N 2 0 333.476 4.049 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC[NH2+]1 ZINC000423375477 1038206979 /nfs/dbraw/zinc/20/69/79/1038206979.db2.gz KPEZLNGROAWWSL-KCXAZCMYSA-N 2 0 345.487 4.057 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccc2c1CCCN2 ZINC000423422164 1038211690 /nfs/dbraw/zinc/21/16/90/1038211690.db2.gz YKFWFZVBRHMVBX-AVRDEDQJSA-N 2 0 349.522 4.045 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1nc(-c2ccccc2)cs1 ZINC000423423075 1038212431 /nfs/dbraw/zinc/21/24/31/1038212431.db2.gz LVVFLAPIXJFJNY-JYJNAYRXSA-N 2 0 329.513 4.226 20 0 EIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423423276 1038213042 /nfs/dbraw/zinc/21/30/42/1038213042.db2.gz BXQLANFQDMIYAO-DOPJRALCSA-N 2 0 340.433 4.004 20 0 EIADRP COCC1(C[NH2+][C@@H](c2cc3ccccc3o2)C(C)(C)C)CC[NH2+]CC1 ZINC000423406380 1038216210 /nfs/dbraw/zinc/21/62/10/1038216210.db2.gz KOEQHMVXAACBEP-IBGZPJMESA-N 2 0 344.499 4.126 20 0 EIADRP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423407286 1038217833 /nfs/dbraw/zinc/21/78/33/1038217833.db2.gz ZQCSGTRXWYMMCC-LBPRGKRZSA-N 2 0 329.513 4.203 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423417136 1038220998 /nfs/dbraw/zinc/22/09/98/1038220998.db2.gz DYBWVXRPLHZGDD-YYFQZIEXSA-N 2 0 326.937 4.248 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000423444784 1038225689 /nfs/dbraw/zinc/22/56/89/1038225689.db2.gz MCXAKZSBEREZHE-AVRDEDQJSA-N 2 0 349.522 4.045 20 0 EIADRP Cc1c([C@H](C)[NH2+][C@H](C)CCCC[NH3+])cnn1-c1cccc(Cl)c1 ZINC000423434512 1038237072 /nfs/dbraw/zinc/23/70/72/1038237072.db2.gz OBTWOTKAMDBYCR-KGLIPLIRSA-N 2 0 334.895 4.002 20 0 EIADRP CSC[C@H]([NH2+][C@H](C)CCCC[NH3+])c1ccc(C(F)(F)F)cc1 ZINC000423439059 1038239524 /nfs/dbraw/zinc/23/95/24/1038239524.db2.gz SDWSWXLTGWBAQJ-DOMZBBRYSA-N 2 0 334.451 4.217 20 0 EIADRP CCC[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccccn1 ZINC000423461463 1038240463 /nfs/dbraw/zinc/24/04/63/1038240463.db2.gz CNCNLTSYOATUAM-SXLOBPIMSA-N 2 0 341.474 4.045 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000423457770 1038240801 /nfs/dbraw/zinc/24/08/01/1038240801.db2.gz PNCYADIDMGDWJS-NQIIRXRSSA-N 3 0 349.538 4.096 20 0 EIADRP [NH3+][C@H]1CCC[C@H](C[NH2+]C(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000423464764 1038242748 /nfs/dbraw/zinc/24/27/48/1038242748.db2.gz HFQWHTSXVXCUEI-LIRRHRJNSA-N 2 0 330.422 4.161 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000423465707 1038243013 /nfs/dbraw/zinc/24/30/13/1038243013.db2.gz WTQFSMFAIBIOAD-WFASDCNBSA-N 2 0 333.476 4.044 20 0 EIADRP Clc1ccc([C@H](Cc2cccnc2)[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1 ZINC000423469152 1038245234 /nfs/dbraw/zinc/24/52/34/1038245234.db2.gz CKSLIMMYOBPEBR-PMACEKPBSA-N 2 0 343.902 4.141 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+][C@@H]1CCSc2ccc(F)cc21)c1ccccc1 ZINC000423499228 1038254084 /nfs/dbraw/zinc/25/40/84/1038254084.db2.gz IZZHRZVFEBWWQT-QZTJIDSGSA-N 2 0 330.472 4.432 20 0 EIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cnn(C2CCCC2)c1 ZINC000423499461 1038254110 /nfs/dbraw/zinc/25/41/10/1038254110.db2.gz AYPYWIDUSATFRY-OXQOHEQNSA-N 2 0 326.488 4.129 20 0 EIADRP COC[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(Cl)cc1 ZINC000423499401 1038254412 /nfs/dbraw/zinc/25/44/12/1038254412.db2.gz AVHGZUQEQWDIAM-RTBURBONSA-N 2 0 332.875 4.097 20 0 EIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000423501148 1038258471 /nfs/dbraw/zinc/25/84/71/1038258471.db2.gz LALOSUUYSPLCAC-KSSFIOAISA-N 2 0 334.410 4.419 20 0 EIADRP CC[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(Br)cc1 ZINC000423484935 1038259338 /nfs/dbraw/zinc/25/93/38/1038259338.db2.gz RJSCFFGKYUPBAJ-HOTGVXAUSA-N 2 0 325.294 4.022 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CC[C@@H]([NH2+]CCC[C@H]3CCC[NH2+]3)C2)cc1 ZINC000423487917 1038259638 /nfs/dbraw/zinc/25/96/38/1038259638.db2.gz UUERBYIQAJNGKH-KBAYOESNSA-N 2 0 340.433 4.463 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423486448 1038260337 /nfs/dbraw/zinc/26/03/37/1038260337.db2.gz STQODKMARJOLHZ-RHSMWYFYSA-N 2 0 329.513 4.301 20 0 EIADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1csc(-c2ccccc2F)n1 ZINC000423484311 1038260573 /nfs/dbraw/zinc/26/05/73/1038260573.db2.gz QQUFETQSNUWWRW-UONOGXRCSA-N 2 0 333.476 4.132 20 0 EIADRP Cc1c([C@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)cnn1-c1cccc(Cl)c1 ZINC000423487325 1038261984 /nfs/dbraw/zinc/26/19/84/1038261984.db2.gz UBRZHVKBOOIRPN-WMLDXEAASA-N 2 0 346.906 4.017 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423495638 1038264510 /nfs/dbraw/zinc/26/45/10/1038264510.db2.gz CFVLINSCAOBYAL-WWMYMODYSA-N 2 0 326.484 4.257 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CCC[NH2+]C1CC1 ZINC000423528478 1038266693 /nfs/dbraw/zinc/26/66/93/1038266693.db2.gz OIZFOMIRELLGOY-GFCCVEGCSA-N 2 0 333.476 4.050 20 0 EIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cnc2ccsc2c1 ZINC000423497696 1038267080 /nfs/dbraw/zinc/26/70/80/1038267080.db2.gz HHPFODQPAWOQHJ-WMLDXEAASA-N 2 0 325.481 4.427 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423512027 1038270131 /nfs/dbraw/zinc/27/01/31/1038270131.db2.gz UFQIKIJLTMIGEE-JTSKRJEESA-N 2 0 348.494 4.312 20 0 EIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000423512180 1038271364 /nfs/dbraw/zinc/27/13/64/1038271364.db2.gz UPGRADMULNRKGR-LAUBAEHRSA-N 2 0 334.467 4.003 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H](Cc2ccccc2Cl)c2cccs2)C1 ZINC000423512213 1038272067 /nfs/dbraw/zinc/27/20/67/1038272067.db2.gz QSOCQEBIQYRCOA-UNEWFSDZSA-N 2 0 334.916 4.402 20 0 EIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ncc(-c2ccccc2)n1C ZINC000423518983 1038275613 /nfs/dbraw/zinc/27/56/13/1038275613.db2.gz PNRYVSBWCDFMQB-PXNSSMCTSA-N 2 0 348.494 4.218 20 0 EIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423536192 1038286842 /nfs/dbraw/zinc/28/68/42/1038286842.db2.gz HAHWQTYPWUTDAO-IBGZPJMESA-N 2 0 326.509 4.240 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1cc(F)c(Cl)cc1Cl ZINC000423539187 1038287157 /nfs/dbraw/zinc/28/71/57/1038287157.db2.gz HUIBENQUHZHPIH-WHOHXGKFSA-N 2 0 331.262 4.171 20 0 EIADRP Fc1ccc(C([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c2ccc(F)cc2)cc1 ZINC000423540608 1038289975 /nfs/dbraw/zinc/28/99/75/1038289975.db2.gz KALRFJHKYJTQMZ-FUHIMQAGSA-N 2 0 342.433 4.032 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1 ZINC000423547976 1038292281 /nfs/dbraw/zinc/29/22/81/1038292281.db2.gz QRKSUKSPDWOVEH-GVMRPCBKSA-N 2 0 342.527 4.088 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)C(c1ccccc1)c1ccccc1 ZINC000423548008 1038292898 /nfs/dbraw/zinc/29/28/98/1038292898.db2.gz QSUDZLBSHGEFSZ-AGOPTVSRSA-N 2 0 334.507 4.185 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CSCc2ccccc21)c1cccc(C[NH+](C)C)c1 ZINC000924850095 1038328662 /nfs/dbraw/zinc/32/86/62/1038328662.db2.gz QURGSSKUBFBGLA-FOIQADDNSA-N 2 0 326.509 4.387 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000490070176 1038330546 /nfs/dbraw/zinc/33/05/46/1038330546.db2.gz WRCXGXISGHLADO-SJORKVTESA-N 2 0 347.572 4.076 20 0 EIADRP CC[N@@H+]1CC[C@H](CN[C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000490168564 1038367585 /nfs/dbraw/zinc/36/75/85/1038367585.db2.gz XJWDOVWJSQMGBJ-FOIQADDNSA-N 2 0 346.877 4.500 20 0 EIADRP C[C@H](c1ccccc1Br)[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000490296173 1038453597 /nfs/dbraw/zinc/45/35/97/1038453597.db2.gz DAIDTGWHCNMIOH-OLZOCXBDSA-N 2 0 334.261 4.113 20 0 EIADRP Cc1cc(N2CC[C@@H]([N@H+](C)Cc3ccccc3)C2)c2ccccc2[nH+]1 ZINC000608092969 1038603417 /nfs/dbraw/zinc/60/34/17/1038603417.db2.gz ZWOLCPMFBLRWKK-LJQANCHMSA-N 2 0 331.463 4.254 20 0 EIADRP CC(C)n1cncc1C[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000424155259 1038649764 /nfs/dbraw/zinc/64/97/64/1038649764.db2.gz MTRSONOKMQXMGW-UHFFFAOYSA-N 2 0 340.515 4.130 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)c(Cl)c1 ZINC000424257270 1038754989 /nfs/dbraw/zinc/75/49/89/1038754989.db2.gz KFUYCWNJNHSLFP-AWEZNQCLSA-N 2 0 332.875 4.261 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)c(Cl)c1 ZINC000424265503 1038759820 /nfs/dbraw/zinc/75/98/20/1038759820.db2.gz VTMHKJJZTITVTQ-CQSZACIVSA-N 2 0 332.875 4.261 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@H](Cc1ccncc1)c1cccs1 ZINC000424266222 1038762435 /nfs/dbraw/zinc/76/24/35/1038762435.db2.gz WPYQMWFMOSTQSA-PKOBYXMFSA-N 2 0 343.540 4.281 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@@H](Cc2ccncc2)c2cccs2)CC1 ZINC000424274180 1038780965 /nfs/dbraw/zinc/78/09/65/1038780965.db2.gz YHKAWVXTIVDURS-IBGZPJMESA-N 2 0 343.540 4.137 20 0 EIADRP CC(C)(C[NH2+][C@@H](Cc1ccncc1)c1cccs1)C[NH+]1CCCC1 ZINC000424280943 1038789335 /nfs/dbraw/zinc/78/93/35/1038789335.db2.gz MPLVFPGAFVMOKG-SFHVURJKSA-N 2 0 343.540 4.139 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](Cc2ccncc2)c2cccs2)CC1 ZINC000424313266 1038799568 /nfs/dbraw/zinc/79/95/68/1038799568.db2.gz NQWPABKEFWQICE-IBGZPJMESA-N 2 0 343.540 4.139 20 0 EIADRP c1ccc2c(c1)sc1c2CCC[C@H]1[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000480758673 1038801129 /nfs/dbraw/zinc/80/11/29/1038801129.db2.gz NRWBESLRUYPHRP-RDTXWAMCSA-N 2 0 326.509 4.353 20 0 EIADRP c1ccc(CC[C@@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000480763300 1038803787 /nfs/dbraw/zinc/80/37/87/1038803787.db2.gz MJCOBARYOHFAJA-NZQKXSOJSA-N 2 0 334.507 4.434 20 0 EIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](CC(C)C)c2ccccc2C)CC1 ZINC000480783084 1038805124 /nfs/dbraw/zinc/80/51/24/1038805124.db2.gz YNEGKIYWZAIORA-QFIPXVFZSA-N 2 0 345.575 4.090 20 0 EIADRP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000480772775 1038809466 /nfs/dbraw/zinc/80/94/66/1038809466.db2.gz GOTWPMAUYRBWQB-GDBMZVCRSA-N 2 0 338.948 4.285 20 0 EIADRP Clc1ccccc1CC[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC001168316394 1038822385 /nfs/dbraw/zinc/82/23/85/1038822385.db2.gz BITNCDVRVSQRIK-UHFFFAOYSA-N 2 0 334.935 4.471 20 0 EIADRP CCCCCC[C@@](CC)([NH2+]C1CCC([NH+](C)C)CC1)C(=O)OCC ZINC001168315925 1038825118 /nfs/dbraw/zinc/82/51/18/1038825118.db2.gz RBYMLZFCXWKFKK-AFMYVXGZSA-N 2 0 340.552 4.131 20 0 EIADRP Cc1cc(C)c(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c(C)n1 ZINC001168317598 1038827717 /nfs/dbraw/zinc/82/77/17/1038827717.db2.gz RZFTXMWUDZPAHP-UHFFFAOYSA-N 2 0 329.532 4.095 20 0 EIADRP Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000504893365 1038839610 /nfs/dbraw/zinc/83/96/10/1038839610.db2.gz DTTBYTDDZPZHRO-LAUBAEHRSA-N 2 0 338.495 4.274 20 0 EIADRP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000504926310 1038858089 /nfs/dbraw/zinc/85/80/89/1038858089.db2.gz HWNZODOSUZOXCJ-JONQDZQNSA-N 2 0 340.433 4.414 20 0 EIADRP CCC[C@H](CCc1ccccc1)[NH2+]C[C@H]1CCCn2cc(C)nc21 ZINC000462119603 1038939078 /nfs/dbraw/zinc/93/90/78/1038939078.db2.gz GEFXFVRDFNTKDC-WOJBJXKFSA-N 2 0 325.500 4.460 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(OC(F)F)c(Cl)c2)cc1 ZINC000414802842 1038967412 /nfs/dbraw/zinc/96/74/12/1038967412.db2.gz BWYDXRVSWRKLBI-LLVKDONJSA-N 2 0 340.801 4.251 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)Cc1ccccc1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000481044558 1038978825 /nfs/dbraw/zinc/97/88/25/1038978825.db2.gz WDKGSIHUBXYCAM-DLBZAZTESA-N 2 0 344.474 4.048 20 0 EIADRP COc1c(Cl)cc(Cl)cc1C[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414804450 1039001013 /nfs/dbraw/zinc/00/10/13/1039001013.db2.gz FAUXECBXGGUZJW-NSHDSACASA-N 2 0 339.266 4.312 20 0 EIADRP COc1ccc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1OCC(C)C ZINC000414809737 1039032804 /nfs/dbraw/zinc/03/28/04/1039032804.db2.gz MWVMWZOAINXSLI-MRXNPFEDSA-N 2 0 342.483 4.040 20 0 EIADRP c1ccc(CC(Cc2ccccc2)[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000378931083 1039039055 /nfs/dbraw/zinc/03/90/55/1039039055.db2.gz YIYROVRNYOVJIR-GGAORHGYSA-N 2 0 334.507 4.057 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)CC3 ZINC000414810798 1039056135 /nfs/dbraw/zinc/05/61/35/1039056135.db2.gz OKEFGHUZXDMJAS-CRAIPNDOSA-N 2 0 333.479 4.143 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)CC3 ZINC000414810799 1039057673 /nfs/dbraw/zinc/05/76/73/1039057673.db2.gz OKEFGHUZXDMJAS-MAUKXSAKSA-N 2 0 333.479 4.143 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H](C)c2cccc(CC(C)C)c2)CC1 ZINC000552045127 1039066563 /nfs/dbraw/zinc/06/65/63/1039066563.db2.gz YVBYIPJEXDEHAD-SFHVURJKSA-N 2 0 332.532 4.037 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(F)c(Cl)c2Cl)cc1 ZINC000414812301 1039074111 /nfs/dbraw/zinc/07/41/11/1039074111.db2.gz KSNRIVOZQYUKHA-JTQLQIEISA-N 2 0 327.230 4.442 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CCCCc2ccc(Cl)s2)[C@H]2CCC[C@@H]21 ZINC000552052888 1039106957 /nfs/dbraw/zinc/10/69/57/1039106957.db2.gz IUMLOVMOTVXYCR-PMPSAXMXSA-N 2 0 326.937 4.187 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000414822945 1039184621 /nfs/dbraw/zinc/18/46/21/1039184621.db2.gz NMQCTTKSLYKUFK-IJEWVQPXSA-N 2 0 328.422 4.004 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCO[C@@H]1c1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000477930900 1039220437 /nfs/dbraw/zinc/22/04/37/1039220437.db2.gz AVDLZNQMPKQTCD-NQSCKRDGSA-N 2 0 347.462 4.301 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000481298471 1039237638 /nfs/dbraw/zinc/23/76/38/1039237638.db2.gz INBDZTSAJOQWME-LAUBAEHRSA-N 2 0 344.449 4.180 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc(C)c1F ZINC000481290636 1039241202 /nfs/dbraw/zinc/24/12/02/1039241202.db2.gz AGQRORYZLWVGDR-QGZVFWFLSA-N 2 0 344.474 4.234 20 0 EIADRP CCOc1ccccc1[C@H](C)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000120963586 1039248155 /nfs/dbraw/zinc/24/81/55/1039248155.db2.gz DSLCUVKDLSCCBJ-HNNXBMFYSA-N 2 0 330.447 4.137 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](Cc2ccccc2)c2sccc2C)C1 ZINC000481314191 1039284254 /nfs/dbraw/zinc/28/42/54/1039284254.db2.gz BNPWDZBOPYSXCH-RBUKOAKNSA-N 2 0 328.525 4.272 20 0 EIADRP Cc1nc2c(s1)[C@H]([NH2+]C1CCC([NH+]3CCC(C)CC3)CC1)CCC2 ZINC000090775318 1039296446 /nfs/dbraw/zinc/29/64/46/1039296446.db2.gz YBBHXJMFXAXHPG-FAFZWHIHSA-N 2 0 347.572 4.462 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](CCc2ccccc2)Cc2ccccc2)C1 ZINC000481324775 1039296957 /nfs/dbraw/zinc/29/69/57/1039296957.db2.gz RXLGEGRTTKDYGV-DHIUTWEWSA-N 2 0 336.523 4.162 20 0 EIADRP CC[C@@H]([NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1)c1c(C)noc1C ZINC000090886818 1039318422 /nfs/dbraw/zinc/31/84/22/1039318422.db2.gz WAYLEPBLWRAWKC-AUUYWEPGSA-N 2 0 345.487 4.034 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cccc(OC3CCCC3)c2)C[C@@H]1C ZINC000537634897 1039342137 /nfs/dbraw/zinc/34/21/37/1039342137.db2.gz YIJWXQGPPRYHIS-PKOBYXMFSA-N 2 0 330.516 4.313 20 0 EIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](C[C@@H]3CCCC(F)(F)C3)C2)CC1 ZINC000513882637 1039343053 /nfs/dbraw/zinc/34/30/53/1039343053.db2.gz MYLNQFIQCCADMP-MSOLQXFVSA-N 2 0 328.491 4.256 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(Br)cc1F ZINC000552296740 1039367923 /nfs/dbraw/zinc/36/79/23/1039367923.db2.gz PMVCYNHNLCLDSR-XGNXJENSSA-N 2 0 343.284 4.112 20 0 EIADRP c1csc([C@H]([NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)C2CCCC2)c1 ZINC000091726561 1039389786 /nfs/dbraw/zinc/38/97/86/1039389786.db2.gz STOUOHJOIGLDEG-OXQOHEQNSA-N 2 0 348.556 4.070 20 0 EIADRP Cc1c([C@@H](C)[NH2+]C2CCC(C)([NH+]3CCC3)CC2)cnn1C(C)(C)C ZINC000927037155 1039401303 /nfs/dbraw/zinc/40/13/03/1039401303.db2.gz LLMPFIJOQOGTHB-XRTORIHISA-N 2 0 332.536 4.004 20 0 EIADRP Cc1ccc(C)c([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)c1 ZINC000122306558 1039661131 /nfs/dbraw/zinc/66/11/31/1039661131.db2.gz UELMAHVDWDWIRY-SFHVURJKSA-N 2 0 326.484 4.095 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(Cl)cc1 ZINC000122381629 1039677323 /nfs/dbraw/zinc/67/73/23/1039677323.db2.gz PBUZTLNIUUTOOM-OAHLLOKOSA-N 2 0 332.875 4.131 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CCc2cc(Cl)ccc21 ZINC000122387912 1039682053 /nfs/dbraw/zinc/68/20/53/1039682053.db2.gz UBMBNZDCWUBLMQ-LJQANCHMSA-N 2 0 344.886 4.058 20 0 EIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000481669057 1039703379 /nfs/dbraw/zinc/70/33/79/1039703379.db2.gz KDMHJYXILWLHCI-FVQBIDKESA-N 2 0 328.422 4.099 20 0 EIADRP Fc1cc(CNC2CC[NH+](CC3CC3)CC2)c(Cl)cc1Cl ZINC001168351208 1039719661 /nfs/dbraw/zinc/71/96/61/1039719661.db2.gz MHPFOLGIGJVSJH-UHFFFAOYSA-N 2 0 331.262 4.097 20 0 EIADRP CCOCCC1(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)CCCC1 ZINC000122480505 1039732329 /nfs/dbraw/zinc/73/23/29/1039732329.db2.gz JUBAHWPIDOMIQB-UHFFFAOYSA-N 2 0 336.564 4.360 20 0 EIADRP COc1ccc2cc(C[NH2+]C3CC(C)(C)[NH2+]C(C)(C)C3)ccc2c1 ZINC000061003173 1039781374 /nfs/dbraw/zinc/78/13/74/1039781374.db2.gz WNDQVKBEZVWYTA-UHFFFAOYSA-N 2 0 326.484 4.247 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2cccc(OC(F)F)c2)CC1 ZINC000122708364 1039781663 /nfs/dbraw/zinc/78/16/63/1039781663.db2.gz COBGNWBIFMNUST-AWEZNQCLSA-N 2 0 326.431 4.061 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)[C@H](C)c2nc3ccccc3s2)CC1 ZINC000122730760 1039782585 /nfs/dbraw/zinc/78/25/85/1039782585.db2.gz HALOPFXHFUSDES-HOTGVXAUSA-N 2 0 345.556 4.500 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@@H]1CCc2c1cc(Br)cc2Cl ZINC000534794911 1039789665 /nfs/dbraw/zinc/78/96/65/1039789665.db2.gz VAKWERGOKHGSPO-OAHLLOKOSA-N 2 0 345.712 4.021 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(SC)c(OC)c2)CC1 ZINC000122767692 1039792080 /nfs/dbraw/zinc/79/20/80/1039792080.db2.gz IDXGVWMRWCCBHL-OAHLLOKOSA-N 2 0 336.545 4.190 20 0 EIADRP Cc1nc(F)ccc1C[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000785417618 1039796958 /nfs/dbraw/zinc/79/69/58/1039796958.db2.gz FIPPGUYMJBVHTJ-UHFFFAOYSA-N 2 0 341.474 4.051 20 0 EIADRP Fc1ccc([C@H]([NH2+]CCCCC[NH+]2CCCC2)c2cccnc2)cc1 ZINC000550882954 1039810111 /nfs/dbraw/zinc/81/01/11/1039810111.db2.gz UDVPIZLAZNWBJJ-NRFANRHFSA-N 2 0 341.474 4.166 20 0 EIADRP C[C@H](COc1cccc(F)c1)[NH2+][C@H]1CCN(C)[C@H](c2ccccc2)C1 ZINC000551008627 1039861768 /nfs/dbraw/zinc/86/17/68/1039861768.db2.gz YLIHBXHXVGQXAU-PBEJRMEISA-N 2 0 342.458 4.018 20 0 EIADRP Cc1cccc(C)c1OCC[NH2+][C@H]1CCN(C)[C@H](c2ccccc2)C1 ZINC000551013214 1039876490 /nfs/dbraw/zinc/87/64/90/1039876490.db2.gz GVXIAUWJKFJCRC-SFTDATJTSA-N 2 0 338.495 4.107 20 0 EIADRP Cc1ccc(OCCC[NH2+][C@H]2CCN(C)[C@H](c3ccccc3)C2)cc1 ZINC000551029569 1039886346 /nfs/dbraw/zinc/88/63/46/1039886346.db2.gz KCUJOOBLRJDYPF-UNMCSNQZSA-N 2 0 338.495 4.189 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(CC(C)C)cc2)CC1 ZINC000481909783 1039896492 /nfs/dbraw/zinc/89/64/92/1039896492.db2.gz PFMOXEYTTHUZDY-SFHVURJKSA-N 2 0 332.532 4.037 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000481957864 1039913094 /nfs/dbraw/zinc/91/30/94/1039913094.db2.gz QRDGMHQVEHYTQC-INIZCTEOSA-N 2 0 347.503 4.258 20 0 EIADRP CSc1ccc(CC[NH2+][C@H]2CCN(C)[C@H](c3ccccc3)C2)cc1 ZINC000551174777 1040017229 /nfs/dbraw/zinc/01/72/29/1040017229.db2.gz DAIKOORIQDXPQY-FPOVZHCZSA-N 2 0 340.536 4.376 20 0 EIADRP CCO[C@H](C[NH2+][C@H]1CCN(C)[C@H](c2ccccc2)C1)c1ccccc1 ZINC000551174997 1040018745 /nfs/dbraw/zinc/01/87/45/1040018745.db2.gz DXBBAXBMINPPBH-FDFHNCONSA-N 2 0 338.495 4.189 20 0 EIADRP COC1CCC(C)(C[NH2+][C@H]2CCN(C)[C@H](c3ccccc3)C2)CC1 ZINC000551175566 1040018969 /nfs/dbraw/zinc/01/89/69/1040018969.db2.gz MTYKFPLPLPEVBW-QEMIJWRASA-N 2 0 330.516 4.007 20 0 EIADRP Cc1cccc(N2CC[NH+](CCCC[NH2+]C3CCCCCC3)CC2)c1 ZINC000551242162 1040090654 /nfs/dbraw/zinc/09/06/54/1040090654.db2.gz SMSIZUPKJXJNQJ-UHFFFAOYSA-N 2 0 343.559 4.210 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000551267688 1040127964 /nfs/dbraw/zinc/12/79/64/1040127964.db2.gz SLEAXSPUKYIQAD-IRXDYDNUSA-N 2 0 339.527 4.298 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1ccc(OC(F)F)cc1 ZINC000482328903 1040181524 /nfs/dbraw/zinc/18/15/24/1040181524.db2.gz IVLIDVYIAYJZSV-QAPCUYQASA-N 2 0 340.458 4.449 20 0 EIADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000482350872 1040190286 /nfs/dbraw/zinc/19/02/86/1040190286.db2.gz WDJXAFBENABCLX-AWEZNQCLSA-N 2 0 344.421 4.010 20 0 EIADRP COc1ccc2oc([C@H](C)[NH2+]CCC3CC[NH+](C)CC3)c(C)c2c1 ZINC000482344697 1040191595 /nfs/dbraw/zinc/19/15/95/1040191595.db2.gz KBJLHWBYMQMDKY-HNNXBMFYSA-N 2 0 330.472 4.132 20 0 EIADRP C(C1CCCC1)[NH+]1CCC(NC2CC[NH+](C3CCCCC3)CC2)CC1 ZINC000514745741 1040211797 /nfs/dbraw/zinc/21/17/97/1040211797.db2.gz BJCRHKHCSVVRSR-UHFFFAOYSA-N 2 0 347.591 4.028 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cccs1 ZINC000482443012 1040251687 /nfs/dbraw/zinc/25/16/87/1040251687.db2.gz FCYNTBQBECHXDS-RBUKOAKNSA-N 2 0 328.525 4.353 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)s1 ZINC000482462790 1040272281 /nfs/dbraw/zinc/27/22/81/1040272281.db2.gz XMIQLEIDEPGICQ-HKUYNNGSSA-N 2 0 328.525 4.272 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000482539712 1040337004 /nfs/dbraw/zinc/33/70/04/1040337004.db2.gz RXRQBGLUWPNEMU-HNNXBMFYSA-N 2 0 343.540 4.035 20 0 EIADRP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]CC1CC[NH+](C)CC1 ZINC000482552728 1040338230 /nfs/dbraw/zinc/33/82/30/1040338230.db2.gz KAPKFYPMVOKHRR-INIZCTEOSA-N 2 0 326.937 4.142 20 0 EIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@H](C)c1ccc(C2CCCCC2)cc1 ZINC000482630970 1040397922 /nfs/dbraw/zinc/39/79/22/1040397922.db2.gz QZTUAYIBYVYIDI-RTBURBONSA-N 2 0 343.559 4.021 20 0 EIADRP CC(C)(CC[NH+]1CCCCCC1)[NH2+]CC1=Cc2ccccc2OC1 ZINC000479600022 1040500437 /nfs/dbraw/zinc/50/04/37/1040500437.db2.gz INIVCZWRJVZERT-UHFFFAOYSA-N 2 0 328.500 4.097 20 0 EIADRP Fc1cccc([C@H]2C[C@H]([NH2+]Cc3cc(-n4ccnc4)cs3)C2)c1 ZINC000435737103 1040591703 /nfs/dbraw/zinc/59/17/03/1040591703.db2.gz DNWADNAYVNHIAS-KOMQPUFPSA-N 2 0 327.428 4.109 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCC[N@@H+]2C2CCCCC2)C1 ZINC000435742446 1040596833 /nfs/dbraw/zinc/59/68/33/1040596833.db2.gz NMMVJGFXELBHPM-BFYDXBDKSA-N 2 0 332.454 4.494 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(CC)cc2)[C@H](C)C1 ZINC000479876915 1040740828 /nfs/dbraw/zinc/74/08/28/1040740828.db2.gz VJCIZYFQVPBEGG-OPYAIIAOSA-N 2 0 332.532 4.037 20 0 EIADRP COc1cc(C)c([C@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)cc1OC ZINC000483186475 1040764564 /nfs/dbraw/zinc/76/45/64/1040764564.db2.gz UWQQKGYNCZKONE-KXBFYZLASA-N 2 0 336.520 4.029 20 0 EIADRP CCCC[NH+]1CCC(Nc2cc[nH+]c3cc(F)c(OC)cc23)CC1 ZINC000479939146 1040807088 /nfs/dbraw/zinc/80/70/88/1040807088.db2.gz HDJJLNSMJPHMIG-UHFFFAOYSA-N 2 0 331.435 4.059 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2ccc(F)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000539816872 1040809286 /nfs/dbraw/zinc/80/92/86/1040809286.db2.gz BKSUWNBVUFUJND-LRDDRELGSA-N 2 0 332.385 4.007 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2ccccc2C(F)(F)F)CC[NH+](C)CC1 ZINC000515492983 1040813046 /nfs/dbraw/zinc/81/30/46/1040813046.db2.gz GMTGEMICRLLNRU-ZDUSSCGKSA-N 2 0 346.462 4.183 20 0 EIADRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(OC)c3ccccc23)C1 ZINC000539821754 1040813955 /nfs/dbraw/zinc/81/39/55/1040813955.db2.gz LECWWBFJUZDFKT-QGZVFWFLSA-N 2 0 326.484 4.012 20 0 EIADRP Cc1ccc(C[C@@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)s1 ZINC000483309716 1040814569 /nfs/dbraw/zinc/81/45/69/1040814569.db2.gz UONVPHHMTDPIKQ-WBVHZDCISA-N 2 0 346.540 4.279 20 0 EIADRP COc1ccc2ccccc2c1C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000539819514 1040814946 /nfs/dbraw/zinc/81/49/46/1040814946.db2.gz FCOQCJCCNNMUAG-LJQANCHMSA-N 2 0 338.495 4.299 20 0 EIADRP CSc1ccc(C[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000539830614 1040824785 /nfs/dbraw/zinc/82/47/85/1040824785.db2.gz IOSGFQKDSVALQG-FQEVSTJZSA-N 2 0 340.536 4.362 20 0 EIADRP Fc1ccc2c(c1)CC[C@@H]([NH+]1CCC3(CCC[N@@H+]3CC3CC3)CC1)C2 ZINC001168432274 1040840426 /nfs/dbraw/zinc/84/04/26/1040840426.db2.gz MSHDRKPRMQCGKK-OAQYLSRUSA-N 2 0 342.502 4.023 20 0 EIADRP Fc1ccc2c(c1)CC[C@H]([NH+]1CCC3(CCC[N@@H+]3CC3CC3)CC1)C2 ZINC001168432273 1040840667 /nfs/dbraw/zinc/84/06/67/1040840667.db2.gz MSHDRKPRMQCGKK-NRFANRHFSA-N 2 0 342.502 4.023 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccc(F)c(F)c1 ZINC000537842542 1040848170 /nfs/dbraw/zinc/84/81/70/1040848170.db2.gz ZQXYWUAQMOKNFJ-UHFFFAOYSA-N 2 0 345.437 4.098 20 0 EIADRP C([NH2+]C1CCC2(CCCO2)CC1)C1([NH+]2CCCCC2)CCCCC1 ZINC000515571832 1040863558 /nfs/dbraw/zinc/86/35/58/1040863558.db2.gz PLXOTYGVUUSDGC-UHFFFAOYSA-N 2 0 334.548 4.257 20 0 EIADRP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1 ZINC000483472224 1040869599 /nfs/dbraw/zinc/86/95/99/1040869599.db2.gz JXRLRQRQQOEODL-FRFSOERESA-N 2 0 342.405 4.062 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](CCCOc3cccc4ccccc43)CC[C@@H]21 ZINC000483485339 1040874294 /nfs/dbraw/zinc/87/42/94/1040874294.db2.gz RQPXRQZARCKAHI-FPOVZHCZSA-N 2 0 338.495 4.025 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CCc1ccc(Oc2ccc(F)cc2)cc1 ZINC000537938876 1040899906 /nfs/dbraw/zinc/89/99/06/1040899906.db2.gz UUEVICWWFTXIIJ-HRAATJIYSA-N 2 0 342.458 4.090 20 0 EIADRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)CC1 ZINC000462762166 1040901336 /nfs/dbraw/zinc/90/13/36/1040901336.db2.gz PKEUYCRBNADUIM-UHFFFAOYSA-N 2 0 330.447 4.297 20 0 EIADRP COc1ccccc1[C@H](C)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000537938693 1040902896 /nfs/dbraw/zinc/90/28/96/1040902896.db2.gz LHYBFXXATBWUON-VIQWUECVSA-N 2 0 330.516 4.389 20 0 EIADRP C[C@H]([NH2+]CC1C[C@H]2CC[C@@H](C1)S2)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000903160615 1040927114 /nfs/dbraw/zinc/92/71/14/1040927114.db2.gz RZMHVBILXVLOSN-RGSBRZDASA-N 2 0 344.568 4.161 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CC2(c3ccc(Cl)cc3Cl)CCC2)CC[N@@H+]1C ZINC000537964480 1040938391 /nfs/dbraw/zinc/93/83/91/1040938391.db2.gz RYNOQPCATQMHGK-DZGCQCFKSA-N 2 0 341.326 4.487 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]([C@@H]3CCOC3)C2)cc1 ZINC000462791417 1040941592 /nfs/dbraw/zinc/94/15/92/1040941592.db2.gz PBIFTTZOTRKBHA-YPAWHYETSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@H](CC[NH2+][C@H](C)c1ccc2c(c1)COC2)[N@H+](C)Cc1ccccc1 ZINC000483672075 1040961509 /nfs/dbraw/zinc/96/15/09/1040961509.db2.gz PPUYZLPVPHLNLJ-QZTJIDSGSA-N 2 0 338.495 4.278 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(COc3ccccc3)cc2)[C@H](C)C1 ZINC000537989800 1040963735 /nfs/dbraw/zinc/96/37/35/1040963735.db2.gz FCLMZIYQTIDAFK-XMSQKQJNSA-N 2 0 338.495 4.086 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cc3c(cccc3F)[nH]2)c1 ZINC000436229208 1040977813 /nfs/dbraw/zinc/97/78/13/1040977813.db2.gz DLSFTVJJOSKCIR-UHFFFAOYSA-N 2 0 339.458 4.437 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)c1ccccn1 ZINC000898523032 1040978750 /nfs/dbraw/zinc/97/87/50/1040978750.db2.gz XLSSUQWYBOFJTM-NRDMVMEKSA-N 2 0 335.495 4.033 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCCc4c(O)cccc43)CC2)CC1 ZINC000462814167 1040982603 /nfs/dbraw/zinc/98/26/03/1040982603.db2.gz OLBAVBPVXHJVGD-WIXQSORDSA-N 2 0 342.527 4.402 20 0 EIADRP CC[C@H]([NH2+]CCC1CC[NH+](CC)CC1)c1ccccc1OC(F)F ZINC000483752120 1040999630 /nfs/dbraw/zinc/99/96/30/1040999630.db2.gz XIJJKBDACNUMEG-KRWDZBQOSA-N 2 0 340.458 4.451 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CC[C@H](c3ccccc3)C2)ccc1F ZINC000436255590 1041010942 /nfs/dbraw/zinc/01/09/42/1041010942.db2.gz YAXLLKDGJQGNLH-ICSRJNTNSA-N 2 0 326.459 4.313 20 0 EIADRP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000480170116 1041029976 /nfs/dbraw/zinc/02/99/76/1041029976.db2.gz XVXNOWSEXRVFKO-OPAMFIHVSA-N 2 0 338.470 4.445 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H]2CCCC[C@@H]2c2ccc(OC)c(F)c2)CC1 ZINC000480170796 1041033280 /nfs/dbraw/zinc/03/32/80/1041033280.db2.gz RGWYZKOYTTZNRC-QUCCMNQESA-N 2 0 348.506 4.325 20 0 EIADRP C[C@H]([NH2+]CC1(c2ccccc2)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000480192820 1041050810 /nfs/dbraw/zinc/05/08/10/1041050810.db2.gz FYHNIASELBCUOI-SFHVURJKSA-N 2 0 338.495 4.009 20 0 EIADRP C[N@@H+]1CCC[C@H](CNc2cc[nH+]c3ccccc23)[C@@H]1c1cccs1 ZINC000462880165 1041062733 /nfs/dbraw/zinc/06/27/33/1041062733.db2.gz AYCYIJGZNYDHIW-FOIQADDNSA-N 2 0 337.492 4.213 20 0 EIADRP CCOc1ccc(C[NH2+][C@H](C)c2cccc(C[NH+](C)C)c2)cc1OC ZINC000924654655 1041088517 /nfs/dbraw/zinc/08/85/17/1041088517.db2.gz DVUBSUDTUKFKQT-MRXNPFEDSA-N 2 0 342.483 4.006 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1ccc(OCC(F)(F)F)cc1 ZINC000538163078 1041106208 /nfs/dbraw/zinc/10/62/08/1041106208.db2.gz PVHRFOXCJHKESP-GOEBONIOSA-N 2 0 344.421 4.153 20 0 EIADRP CCc1ccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)nc1 ZINC000515805898 1041127795 /nfs/dbraw/zinc/12/77/95/1041127795.db2.gz KSFNTXBXSBHECB-UHFFFAOYSA-N 2 0 349.522 4.132 20 0 EIADRP C[C@H]([NH2+][C@@H](c1cccs1)C1CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000480274214 1041153051 /nfs/dbraw/zinc/15/30/51/1041153051.db2.gz MJNBBJHFPRIZTM-MGPUTAFESA-N 2 0 344.524 4.490 20 0 EIADRP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000540136649 1041178586 /nfs/dbraw/zinc/17/85/86/1041178586.db2.gz WLJCNAZRDZENAS-DYESRHJHSA-N 2 0 335.495 4.445 20 0 EIADRP C[NH+](C)CC1CCC([NH2+]Cc2ccc(-c3cccc(F)c3F)o2)CC1 ZINC000480285390 1041178926 /nfs/dbraw/zinc/17/89/26/1041178926.db2.gz DUISIVWFCBVJCY-UHFFFAOYSA-N 2 0 348.437 4.435 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000484305278 1041191927 /nfs/dbraw/zinc/19/19/27/1041191927.db2.gz VFIIDBSKJHHGPW-GXTWGEPZSA-N 2 0 333.303 4.001 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cccc(Cl)c1Cl ZINC000484292345 1041196297 /nfs/dbraw/zinc/19/62/97/1041196297.db2.gz CVCIYOQSEOWRJX-OLZOCXBDSA-N 2 0 333.303 4.001 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1cccc(O)c1 ZINC000194884250 1041257221 /nfs/dbraw/zinc/25/72/21/1041257221.db2.gz ZKEWYKXWASWEMD-GOSISDBHSA-N 2 0 338.495 4.475 20 0 EIADRP CC(C)[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000538406112 1041302942 /nfs/dbraw/zinc/30/29/42/1041302942.db2.gz PPKJVDBDNSBFPI-QGZVFWFLSA-N 2 0 326.406 4.254 20 0 EIADRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3scnc3C)cc2)C1 ZINC000667677213 1041318213 /nfs/dbraw/zinc/31/82/13/1041318213.db2.gz LXTXTLJCVUNOJX-GOSISDBHSA-N 2 0 343.540 4.282 20 0 EIADRP FC(F)(F)CCC(CCC(F)(F)F)[NH2+][C@H]1CCN(CC2CC2)C1 ZINC000925009115 1041319749 /nfs/dbraw/zinc/31/97/49/1041319749.db2.gz ABJBCLNTUXPILO-ZDUSSCGKSA-N 2 0 346.359 4.114 20 0 EIADRP COc1ccc(Cl)cc1[C@@H](CC(C)C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000538408209 1041325546 /nfs/dbraw/zinc/32/55/46/1041325546.db2.gz SZHHEKBJFVZTOO-GOSISDBHSA-N 2 0 336.907 4.287 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCc2c1cccc2OC ZINC000480473251 1041326695 /nfs/dbraw/zinc/32/66/95/1041326695.db2.gz SNFDFLZJMDHDLU-NRFANRHFSA-N 2 0 338.495 4.314 20 0 EIADRP Cc1c(C)n(C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c2ccc(C[NH3+])cc12 ZINC001167961053 1041411406 /nfs/dbraw/zinc/41/14/06/1041411406.db2.gz DQWPXVWITHVMRX-YOFSQIOKSA-N 2 0 337.511 4.295 20 0 EIADRP CCc1nc2c(s1)[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)CCC2 ZINC000480612199 1041423913 /nfs/dbraw/zinc/42/39/13/1041423913.db2.gz OCCNKNBYHXUHJF-JKSUJKDBSA-N 2 0 335.561 4.185 20 0 EIADRP COc1cc(C)c([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1OC ZINC000480615271 1041424980 /nfs/dbraw/zinc/42/49/80/1041424980.db2.gz RJIVUKVWIWPNBP-MSOLQXFVSA-N 2 0 348.531 4.317 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1cc(F)c(F)c(F)c1 ZINC000480630603 1041434483 /nfs/dbraw/zinc/43/44/83/1041434483.db2.gz KOSYQUUAICONBP-KBPBESRZSA-N 2 0 328.422 4.409 20 0 EIADRP CCc1nc2c(s1)[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)CCC2 ZINC000480635081 1041448709 /nfs/dbraw/zinc/44/87/09/1041448709.db2.gz VNQCFUSMPGBVKH-CVEARBPZSA-N 2 0 335.561 4.327 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)C(F)(F)F ZINC000480668809 1041461534 /nfs/dbraw/zinc/46/15/34/1041461534.db2.gz WOZCBRVWDMKCSV-LAVFITLUSA-N 2 0 340.433 4.075 20 0 EIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2(Cc3ccccc3)CC2)CC1 ZINC000480689174 1041472853 /nfs/dbraw/zinc/47/28/53/1041472853.db2.gz MBMGMIIJJJBMKF-RXVVDRJESA-N 2 0 326.528 4.394 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CCc2c(F)cccc2F)CCN1Cc1ccccc1 ZINC000401998635 1041473919 /nfs/dbraw/zinc/47/39/19/1041473919.db2.gz DGDVMFGZWCGHSV-SJLPKXTDSA-N 2 0 344.449 4.150 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CCc2c(F)cccc2F)CCN1Cc1ccccc1 ZINC000401998636 1041474233 /nfs/dbraw/zinc/47/42/33/1041474233.db2.gz DGDVMFGZWCGHSV-WMZOPIPTSA-N 2 0 344.449 4.150 20 0 EIADRP C[C@@H]([NH2+]C1(Cc2ccccc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000480692502 1041475927 /nfs/dbraw/zinc/47/59/27/1041475927.db2.gz ASDBOOZMTQCQNQ-DENIHFKCSA-N 2 0 334.507 4.262 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C)c(Br)c2)C[C@@H]1C ZINC000538718942 1041489176 /nfs/dbraw/zinc/48/91/76/1041489176.db2.gz YBRDCWWMOVARIR-GOEBONIOSA-N 2 0 339.321 4.062 20 0 EIADRP C[N@H+](C[C@@H]1C[C@@H]1c1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000538731488 1041502455 /nfs/dbraw/zinc/50/24/55/1041502455.db2.gz PGEYQDXHYOLBLN-ACIOBRDBSA-N 2 0 334.507 4.244 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc(-c4ccc(F)cc4)o3)CC[C@H]21 ZINC000538799218 1041541326 /nfs/dbraw/zinc/54/13/26/1041541326.db2.gz URBUTZRBHMMBOC-VQIMIIECSA-N 2 0 328.431 4.002 20 0 EIADRP CC(C)([NH2+]C1CC[NH+](CC2CC2)CC1)c1cccc(C(F)(F)F)c1 ZINC001168359643 1041551067 /nfs/dbraw/zinc/55/10/67/1041551067.db2.gz DIJCFFLCHZJIBS-UHFFFAOYSA-N 2 0 340.433 4.405 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000540607289 1041559556 /nfs/dbraw/zinc/55/95/56/1041559556.db2.gz MCPBMULMMGNOMV-QAPCUYQASA-N 2 0 339.310 4.481 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2oc3ccccc3c2C)CC[NH+](C)CC1 ZINC000516516478 1041613659 /nfs/dbraw/zinc/61/36/59/1041613659.db2.gz FCARRUHNXHUTJW-HNNXBMFYSA-N 2 0 332.513 4.219 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccc(C(F)(F)F)cc3)CC2)[C@H](C)C1 ZINC000437073872 1041624554 /nfs/dbraw/zinc/62/45/54/1041624554.db2.gz HOMIJMQEDIWFMD-RHSMWYFYSA-N 2 0 340.433 4.057 20 0 EIADRP C[C@@H]([NH2+]CCc1ccc(F)cc1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000516802128 1041763676 /nfs/dbraw/zinc/76/36/76/1041763676.db2.gz LSPNPISOOLLEDR-APWZRJJASA-N 2 0 344.449 4.008 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000491305586 1041788055 /nfs/dbraw/zinc/78/80/55/1041788055.db2.gz MNUKMGYFWFBNRI-MSOLQXFVSA-N 2 0 341.543 4.434 20 0 EIADRP CC[C@@H]([NH2+]CC1(SC)CC[NH+](C)CC1)c1ccc(Cl)s1 ZINC000516939740 1041817142 /nfs/dbraw/zinc/81/71/42/1041817142.db2.gz DKWWOGWXDXEGBM-GFCCVEGCSA-N 2 0 332.966 4.270 20 0 EIADRP c1ccc(OCCCCC[NH+]2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000437578384 1041845930 /nfs/dbraw/zinc/84/59/30/1041845930.db2.gz JSGGSISGOITEDH-UHFFFAOYSA-N 2 0 330.516 4.044 20 0 EIADRP C[C@H](Cc1ccsc1)[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000541234372 1041859508 /nfs/dbraw/zinc/85/95/08/1041859508.db2.gz DXGODMGBKMCXES-XLIONFOSSA-N 2 0 328.525 4.133 20 0 EIADRP C[C@]1(c2ccccc2)CC[C@@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000437779843 1041898062 /nfs/dbraw/zinc/89/80/62/1041898062.db2.gz CKZDCUHKZCIBPI-GGAORHGYSA-N 2 0 349.522 4.398 20 0 EIADRP C[C@H](NCc1cccc(OC(C)(C)C)n1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541603185 1042038991 /nfs/dbraw/zinc/03/89/91/1042038991.db2.gz ORGLHWFQCXOBAK-DLBZAZTESA-N 2 0 345.531 4.002 20 0 EIADRP C[C@H](C[NH2+][C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1)C[NH+](C)C ZINC000425945560 1042046116 /nfs/dbraw/zinc/04/61/16/1042046116.db2.gz RHVBOGOIZNXPCT-KMFMINBZSA-N 2 0 328.422 4.129 20 0 EIADRP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000467370872 1042223419 /nfs/dbraw/zinc/22/34/19/1042223419.db2.gz RNWJINWIBRVBBF-CQSZACIVSA-N 2 0 340.433 4.100 20 0 EIADRP CC1([NH2+]C/C=C/c2ccc(OCc3ccccc3)cc2)CC[NH2+]CC1 ZINC000414938379 1042290240 /nfs/dbraw/zinc/29/02/40/1042290240.db2.gz IOOCWCJGMSSDDH-VMPITWQZSA-N 2 0 336.479 4.011 20 0 EIADRP Clc1ccc2c(c1)[C@H]([N@@H+]1CC[C@H]3[C@@H](CCCN3C3CC3)C1)CC2 ZINC000542212123 1042338875 /nfs/dbraw/zinc/33/88/75/1042338875.db2.gz FQGRZSJWVBXBRT-RYGJVYDSSA-N 2 0 330.903 4.276 20 0 EIADRP Clc1ccc2c(c1)[C@H]([N@@H+]1CC[C@@H]3[C@H](CCCN3C3CC3)C1)CC2 ZINC000542212121 1042339631 /nfs/dbraw/zinc/33/96/31/1042339631.db2.gz FQGRZSJWVBXBRT-CDHQVMDDSA-N 2 0 330.903 4.276 20 0 EIADRP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000467378202 1042405621 /nfs/dbraw/zinc/40/56/21/1042405621.db2.gz RBYQSKPGMGXXND-CQSZACIVSA-N 2 0 340.433 4.100 20 0 EIADRP C[NH+]1CCC(CC[NH2+]Cc2ccc(-c3ccc(F)cc3)s2)CC1 ZINC000518274604 1042446958 /nfs/dbraw/zinc/44/69/58/1042446958.db2.gz MDOBMUCXXFYYLP-UHFFFAOYSA-N 2 0 332.488 4.376 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@@H]2CCCc3ccc(C)cc32)[C@H](C)C1 ZINC000426289007 1042513928 /nfs/dbraw/zinc/51/39/28/1042513928.db2.gz FJHMJMMQTCHPLV-STZQEDGTSA-N 2 0 344.543 4.099 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccncc1 ZINC000173931268 1042630362 /nfs/dbraw/zinc/63/03/62/1042630362.db2.gz VJZAOXZMVVYRPW-OTWHNJEPSA-N 2 0 337.511 4.410 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ccccc2OC(F)(F)F)C1 ZINC000518765546 1042675883 /nfs/dbraw/zinc/67/58/83/1042675883.db2.gz LFNANLHZTACJHK-OAHLLOKOSA-N 2 0 344.421 4.187 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000415004118 1042738509 /nfs/dbraw/zinc/73/85/09/1042738509.db2.gz NUHCPKVLIWDWEP-LGYWMIHWSA-N 2 0 330.516 4.217 20 0 EIADRP C[C@@H](CCc1ccsc1)[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000415005040 1042788153 /nfs/dbraw/zinc/78/81/53/1042788153.db2.gz OPBYEGCRVAZYDH-ZAAXVRCTSA-N 2 0 346.515 4.191 20 0 EIADRP C[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311145900 1042853619 /nfs/dbraw/zinc/85/36/19/1042853619.db2.gz ZLARZIMBKPEGNL-NBCNXNJRSA-N 2 0 338.470 4.313 20 0 EIADRP c1ccc2c(c1)[nH]c1c2C[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)C1 ZINC000442708577 1042944717 /nfs/dbraw/zinc/94/47/17/1042944717.db2.gz JPXIKLSCAWVXHH-LJQANCHMSA-N 2 0 345.490 4.021 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2cc(Br)cs2)CC1 ZINC000493898288 1042979084 /nfs/dbraw/zinc/97/90/84/1042979084.db2.gz VPELJEWVSRJMHN-LBPRGKRZSA-N 2 0 345.350 4.283 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCc2ccccc2F)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168006334 1043001179 /nfs/dbraw/zinc/00/11/79/1043001179.db2.gz NGLQBQVYLWRGFF-RMFSNUHRSA-N 2 0 340.486 4.399 20 0 EIADRP C[C@H]([NH2+]Cc1ccnc2ccccc12)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000388842126 1043062354 /nfs/dbraw/zinc/06/23/54/1043062354.db2.gz YFOLSSDRRPBLHW-RXVVDRJESA-N 2 0 345.490 4.235 20 0 EIADRP Oc1cc(F)cc(CNCc2ccccc2C[NH+]2CCCCCC2)c1 ZINC000185532252 1043195002 /nfs/dbraw/zinc/19/50/02/1043195002.db2.gz IXQABIFOVBSBSW-UHFFFAOYSA-N 2 0 342.458 4.197 20 0 EIADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CCCC1 ZINC000665246947 1043221918 /nfs/dbraw/zinc/22/19/18/1043221918.db2.gz RTWIRAJQVYAVTO-JKSUJKDBSA-N 2 0 326.406 4.203 20 0 EIADRP c1ccc2ncc(C[NH2+]Cc3cccc(C[NH+]4CCCC4)c3)cc2c1 ZINC000727465477 1043225688 /nfs/dbraw/zinc/22/56/88/1043225688.db2.gz KBEPFYKFBDVUDF-UHFFFAOYSA-N 2 0 331.463 4.120 20 0 EIADRP [NH3+]C1(C[NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CCCC1 ZINC000665247085 1043230402 /nfs/dbraw/zinc/23/04/02/1043230402.db2.gz VMUXGPNZTJSSIV-GDBMZVCRSA-N 2 0 326.406 4.203 20 0 EIADRP COc1ccsc1[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000186125858 1043248088 /nfs/dbraw/zinc/24/80/88/1043248088.db2.gz UFJRAWZGZOQQHO-MRXNPFEDSA-N 2 0 344.524 4.320 20 0 EIADRP C[C@@H](NC1CC[NH+](C2CCCCC2)CC1)[C@@H](c1ccccc1)[NH+](C)C ZINC000186320950 1043268450 /nfs/dbraw/zinc/26/84/50/1043268450.db2.gz HEWLSXITCBHJEJ-GCJKJVERSA-N 2 0 343.559 4.065 20 0 EIADRP C[C@@H]1CC(Nc2ccc(CC[NH3+])cc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168012382 1043424601 /nfs/dbraw/zinc/42/46/01/1043424601.db2.gz ZHGCVKMRMZVSOY-QZTJIDSGSA-N 2 0 337.511 4.041 20 0 EIADRP C[C@H]1CC([NH2+]CC2(C)CC(F)(F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168012807 1043454514 /nfs/dbraw/zinc/45/45/14/1043454514.db2.gz FKQZBWLYAGEQPB-HOTGVXAUSA-N 2 0 336.470 4.453 20 0 EIADRP Cc1cscc1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000494448262 1043489924 /nfs/dbraw/zinc/48/99/24/1043489924.db2.gz FJLVDSWIAOSEGE-OWZKRDHZSA-N 2 0 326.509 4.342 20 0 EIADRP FC(F)(F)c1ccc(CCC[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)cc1 ZINC000674233766 1043496586 /nfs/dbraw/zinc/49/65/86/1043496586.db2.gz QUSXJNCRXILHBT-HNNXBMFYSA-N 2 0 337.389 4.241 20 0 EIADRP FC(F)(F)c1ccc(CCC[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)cc1 ZINC000674233769 1043497809 /nfs/dbraw/zinc/49/78/09/1043497809.db2.gz QUSXJNCRXILHBT-OAHLLOKOSA-N 2 0 337.389 4.241 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)[C@H](C)C2 ZINC000665273489 1043508994 /nfs/dbraw/zinc/50/89/94/1043508994.db2.gz XYEDBKUSCRSIGP-AAEGSUEWSA-N 2 0 348.490 4.074 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)[C@@H](C)C1 ZINC000674305332 1043573257 /nfs/dbraw/zinc/57/32/57/1043573257.db2.gz HLJLUXFJGCJIAM-MAUKXSAKSA-N 2 0 342.449 4.300 20 0 EIADRP C[N@H+](CCCc1ccsc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000543032334 1043594679 /nfs/dbraw/zinc/59/46/79/1043594679.db2.gz LOJLKKYJYBNCPO-HXUWFJFHSA-N 2 0 328.525 4.135 20 0 EIADRP CC[C@H]1C[N@H+](CCCCn2ccnc2C)CC[C@H]1c1ccccc1 ZINC000442394525 1043670651 /nfs/dbraw/zinc/67/06/51/1043670651.db2.gz SHOSLCGPXOTZGE-PZJWPPBQSA-N 2 0 325.500 4.487 20 0 EIADRP C[NH+](C/C=C\C[N@H+](C)CCc1cccs1)CCc1cccs1 ZINC000255659443 1043698187 /nfs/dbraw/zinc/69/81/87/1043698187.db2.gz UZKAQPHOBVPZJB-ARJAWSKDSA-N 2 0 334.554 4.015 20 0 EIADRP C[C@@H]([NH2+]Cc1cc2ccccc2[nH]1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000681390519 1043731343 /nfs/dbraw/zinc/73/13/43/1043731343.db2.gz NDKONQWKLCBASK-XLIONFOSSA-N 2 0 333.479 4.168 20 0 EIADRP C[C@@H]([NH2+]Cc1cc2ccccc2[nH]1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000681390521 1043731474 /nfs/dbraw/zinc/73/14/74/1043731474.db2.gz NDKONQWKLCBASK-YLJYHZDGSA-N 2 0 333.479 4.168 20 0 EIADRP CC(C)[C@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1ccc2[nH]c(=O)oc2c1 ZINC000542487826 1043799097 /nfs/dbraw/zinc/79/90/97/1043799097.db2.gz HPTICCGNSLVHSQ-KXBFYZLASA-N 2 0 345.487 4.085 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)c1 ZINC000731676592 1043814552 /nfs/dbraw/zinc/81/45/52/1043814552.db2.gz BQZJAEJTNZBWEV-UHFFFAOYSA-N 2 0 338.495 4.142 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CCSc2ccc(OC)cc21 ZINC000191483910 1043818475 /nfs/dbraw/zinc/81/84/75/1043818475.db2.gz ARLGZFZMFBABBY-YJBOKZPZSA-N 2 0 336.545 4.332 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442829244 1043858364 /nfs/dbraw/zinc/85/83/64/1043858364.db2.gz UJKWAAVFNUKVRJ-AEFFLSMTSA-N 2 0 338.417 4.193 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442829245 1043859649 /nfs/dbraw/zinc/85/96/49/1043859649.db2.gz UJKWAAVFNUKVRJ-FUHWJXTLSA-N 2 0 338.417 4.193 20 0 EIADRP CC(C)(C)C[NH+]1CCC(C[NH2+][C@H]2Cc3cccc(Cl)c3C2)CC1 ZINC001168707348 1043896766 /nfs/dbraw/zinc/89/67/66/1043896766.db2.gz LNVBUNMBFWMZRB-KRWDZBQOSA-N 2 0 334.935 4.155 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccc1F ZINC000658166868 1043942634 /nfs/dbraw/zinc/94/26/34/1043942634.db2.gz QIPUZONAYIIFPI-NRFANRHFSA-N 2 0 341.474 4.174 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cnn(C(C)C)c2)CC1)CC(C)C ZINC000521942355 1044093978 /nfs/dbraw/zinc/09/39/78/1044093978.db2.gz ISSSOSYYRRAHLK-UHFFFAOYSA-N 2 0 334.552 4.044 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCC[C@H]([C@@H]4CCOC4)C3)CC2)CC1 ZINC000466346387 1044300037 /nfs/dbraw/zinc/30/00/37/1044300037.db2.gz LDKMNBPLQBYEON-FEEKASPWSA-N 2 0 348.575 4.214 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCC[C@H]([C@H]4CCOC4)C3)CC2)CC1 ZINC000466346385 1044301076 /nfs/dbraw/zinc/30/10/76/1044301076.db2.gz LDKMNBPLQBYEON-AKBOATIKSA-N 2 0 348.575 4.214 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCC34CCCC4)CC2)cc1 ZINC000474051112 1044308288 /nfs/dbraw/zinc/30/82/88/1044308288.db2.gz JHBXSXRVKSXOHM-OAQYLSRUSA-N 2 0 342.527 4.220 20 0 EIADRP c1coc([C@@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccccc2)c1 ZINC000326894897 1044324072 /nfs/dbraw/zinc/32/40/72/1044324072.db2.gz JEWCWBHSKWDJKL-NRFANRHFSA-N 2 0 333.435 4.023 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000474066571 1044336084 /nfs/dbraw/zinc/33/60/84/1044336084.db2.gz NSXQWRBQFZNWRB-OAQYLSRUSA-N 2 0 338.495 4.269 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000348008046 1044361354 /nfs/dbraw/zinc/36/13/54/1044361354.db2.gz OESZMOOTNXPZQK-JXFKEZNVSA-N 2 0 342.531 4.198 20 0 EIADRP C[C@@H]1CC(n2cnc3ccc(C[NH3+])cc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168020128 1044368720 /nfs/dbraw/zinc/36/87/20/1044368720.db2.gz KQOIHXPYFPWLHH-IAGOWNOFSA-N 2 0 348.494 4.109 20 0 EIADRP C[C@@H]([NH2+][C@@H](c1cccs1)c1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC000675732678 1044450178 /nfs/dbraw/zinc/45/01/78/1044450178.db2.gz DJANSWWUFZUNJK-AUUYWEPGSA-N 2 0 332.488 4.297 20 0 EIADRP C[C@@H](C[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)Cc1ccccc1 ZINC000542518627 1044450246 /nfs/dbraw/zinc/45/02/46/1044450246.db2.gz YAQCJYSMFXEDPK-OFNKIYASSA-N 2 0 336.523 4.019 20 0 EIADRP Cc1nc(-c2ccc([C@@H](C)[NH2+][C@H](C)C3CC[NH+](C)CC3)cc2)cs1 ZINC000675735439 1044454145 /nfs/dbraw/zinc/45/41/45/1044454145.db2.gz JIAPCDIHHNTABZ-HUUCEWRRSA-N 2 0 343.540 4.499 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@@H](C[C@H]1CCOC1)c1ccc(F)cc1 ZINC000494880546 1044467991 /nfs/dbraw/zinc/46/79/91/1044467991.db2.gz SNLZLVMODBMLOP-OPYAIIAOSA-N 2 0 348.506 4.148 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)c1cccc(C(F)(F)F)c1)C1CC[NH+](C)CC1 ZINC000675807001 1044507563 /nfs/dbraw/zinc/50/75/63/1044507563.db2.gz DGQJIZAYJMXMRC-AWEZNQCLSA-N 2 0 342.449 4.303 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](c2ccc(F)cc2)c2cccnc2)CC1 ZINC000543402731 1044525485 /nfs/dbraw/zinc/52/54/85/1044525485.db2.gz NARGIGBEIFUSKD-NRFANRHFSA-N 2 0 341.474 4.022 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000494967772 1044565305 /nfs/dbraw/zinc/56/53/05/1044565305.db2.gz IVXJYVSJIXJWSD-HXUWFJFHSA-N 2 0 344.861 4.420 20 0 EIADRP C[C@@H]1CC([NH2+]Cc2ccc3ncoc3c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168024416 1044615443 /nfs/dbraw/zinc/61/54/43/1044615443.db2.gz GHGCMILFAAYWFE-IAGOWNOFSA-N 2 0 349.478 4.359 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2C)[C@H](C)C1 ZINC000443658960 1044646725 /nfs/dbraw/zinc/64/67/25/1044646725.db2.gz OMWAELMAUFEAQA-RHSMWYFYSA-N 2 0 328.422 4.176 20 0 EIADRP C[C@@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)C1CCSCC1 ZINC000250104774 1044672851 /nfs/dbraw/zinc/67/28/51/1044672851.db2.gz RXKYLTVZANMGKX-IIMDRIAPSA-N 2 0 346.584 4.264 20 0 EIADRP C[N@H+](CCCCc1cccc(C(F)(F)F)c1)C[C@H]1CCC[NH+](C)C1 ZINC000474152102 1044697992 /nfs/dbraw/zinc/69/79/92/1044697992.db2.gz GSYWQTNZGLYWGS-QGZVFWFLSA-N 2 0 342.449 4.302 20 0 EIADRP C[C@@H]1CC([NH2+]CCCC(F)(F)F)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168026916 1044723512 /nfs/dbraw/zinc/72/35/12/1044723512.db2.gz MFIUOLWXAVQICU-HUUCEWRRSA-N 2 0 328.422 4.360 20 0 EIADRP c1ccc([C@@H]2CC[N@H+]2Cc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000676413570 1044736019 /nfs/dbraw/zinc/73/60/19/1044736019.db2.gz DDUUUPNWQMLPSV-QFIPXVFZSA-N 2 0 336.479 4.108 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](CCCOC)c2ccc(F)cc2)CC1 ZINC000282365464 1044861606 /nfs/dbraw/zinc/86/16/06/1044861606.db2.gz PYUWIACXUOBKFK-HXUWFJFHSA-N 2 0 336.495 4.005 20 0 EIADRP CCc1cccc(Cl)c1C[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000474356180 1044880663 /nfs/dbraw/zinc/88/06/63/1044880663.db2.gz NBSCGXFVLUWUTL-UHFFFAOYSA-N 2 0 334.866 4.393 20 0 EIADRP c1coc(-c2ncc(C[NH2+]C3CCC([NH+]4CCCCC4)CC3)s2)c1 ZINC000785480847 1044919212 /nfs/dbraw/zinc/91/92/12/1044919212.db2.gz DEZMAXMSAVMEFK-UHFFFAOYSA-N 2 0 345.512 4.290 20 0 EIADRP CC(C)(C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cccc(C(F)(F)F)c1 ZINC000166463882 1044973368 /nfs/dbraw/zinc/97/33/68/1044973368.db2.gz RPAJFLJHLSUMIE-IAGOWNOFSA-N 2 0 340.433 4.199 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCN(Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000922836939 1044982390 /nfs/dbraw/zinc/98/23/90/1044982390.db2.gz FIBCOBMCMXYNCX-NEWSRXKRSA-N 2 0 330.541 4.057 20 0 EIADRP CC(C)[N@H+](C)CCC[NH2+]C1CC(c2cccc(Br)c2)C1 ZINC000232653163 1044983752 /nfs/dbraw/zinc/98/37/52/1044983752.db2.gz LSZCVYMRXBXVFP-UHFFFAOYSA-N 2 0 339.321 4.015 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2cc3ccnc(Cl)c3s2)CC1 ZINC000922846607 1044995339 /nfs/dbraw/zinc/99/53/39/1044995339.db2.gz ORQCTBUFMFKCSK-UHFFFAOYSA-N 2 0 349.931 4.446 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CCN1CCCC[C@H]1C ZINC000474479562 1045020617 /nfs/dbraw/zinc/02/06/17/1045020617.db2.gz YFBHHQZIWDXNKF-OAGGEKHMSA-N 2 0 331.529 4.252 20 0 EIADRP C[C@H](NCc1scnc1C1CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000487567672 1045227184 /nfs/dbraw/zinc/22/71/84/1045227184.db2.gz YJPUMVZNOLODDQ-MAUKXSAKSA-N 2 0 341.524 4.021 20 0 EIADRP C[C@@H](NCc1scnc1C1CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000487567670 1045228577 /nfs/dbraw/zinc/22/85/77/1045228577.db2.gz YJPUMVZNOLODDQ-CRAIPNDOSA-N 2 0 341.524 4.021 20 0 EIADRP Clc1ccc2c(c1Cl)CC[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000161655744 1045307852 /nfs/dbraw/zinc/30/78/52/1045307852.db2.gz XJMPTKVKZHEKCW-OZVIIMIRSA-N 2 0 325.283 4.197 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccccc1F ZINC000495763697 1045327463 /nfs/dbraw/zinc/32/74/63/1045327463.db2.gz HJBVIVKIFCCPAM-OAHLLOKOSA-N 2 0 332.488 4.450 20 0 EIADRP Clc1ccc2cccnc2c1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000054317117 1045569796 /nfs/dbraw/zinc/56/97/96/1045569796.db2.gz UAIAABZUBKJBHZ-UHFFFAOYSA-N 2 0 343.902 4.196 20 0 EIADRP CC[C@@H]([NH2+]C1CC[NH+](CC(C)C)CC1)c1ccc2c(c1)CCCO2 ZINC000768092408 1045708293 /nfs/dbraw/zinc/70/82/93/1045708293.db2.gz XXSKXAMCQUAHQE-HXUWFJFHSA-N 2 0 330.516 4.173 20 0 EIADRP CC[C@H]([NH2+]CCC1CC[NH+](CC)CC1)c1ccc2c(c1)CCCO2 ZINC000768102974 1045716695 /nfs/dbraw/zinc/71/66/95/1045716695.db2.gz RYSMNVZCTGLBDP-FQEVSTJZSA-N 2 0 330.516 4.174 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccccc2C(F)(F)F)cc1 ZINC000768230541 1045761295 /nfs/dbraw/zinc/76/12/95/1045761295.db2.gz RGBPOUXGFCHVAV-UHFFFAOYSA-N 2 0 336.401 4.399 20 0 EIADRP CC(C)[C@@H](C[NH2+][C@@H](CC(C)(C)C)c1ccccc1)N1CC[NH+](C)CC1 ZINC000326429348 1045809065 /nfs/dbraw/zinc/80/90/65/1045809065.db2.gz VTYJDEZPQXGTRD-LEWJYISDSA-N 2 0 345.575 4.026 20 0 EIADRP FC(F)C1CC([NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)C1 ZINC000768686537 1045833047 /nfs/dbraw/zinc/83/30/47/1045833047.db2.gz NCZTVUOKXANLDS-UHFFFAOYSA-N 2 0 342.861 4.185 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CCCCCCOc2ccc(Cl)cc2)CC[N@@H+]1C ZINC000769418086 1045954409 /nfs/dbraw/zinc/95/44/09/1045954409.db2.gz TXKYLQFKIWMIBN-WMZOPIPTSA-N 2 0 338.923 4.352 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000161612944 1046007494 /nfs/dbraw/zinc/00/74/94/1046007494.db2.gz BTFUURMQZUDJHZ-KEYYUXOJSA-N 2 0 340.433 4.055 20 0 EIADRP Cc1oc(-c2cccs2)nc1C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123398720 1046012342 /nfs/dbraw/zinc/01/23/42/1046012342.db2.gz ZNFXETVTOPYYHI-UHFFFAOYSA-N 2 0 347.528 4.265 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(Br)cc2)CC1 ZINC000037150102 1046012984 /nfs/dbraw/zinc/01/29/84/1046012984.db2.gz OTAGMMKMWMZPQG-CQSZACIVSA-N 2 0 339.321 4.364 20 0 EIADRP CCc1noc(C)c1[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000769872777 1046101851 /nfs/dbraw/zinc/10/18/51/1046101851.db2.gz FCSULZONZMWBCS-MRXNPFEDSA-N 2 0 341.499 4.108 20 0 EIADRP CCc1noc(C)c1[C@@H](C)[NH2+]Cc1cccc(C[NH+](CC)CC)c1 ZINC000769877359 1046105047 /nfs/dbraw/zinc/10/50/47/1046105047.db2.gz VYXURISKUVDSLO-OAHLLOKOSA-N 2 0 329.488 4.238 20 0 EIADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(SCC(F)F)cc1 ZINC000125293135 1046298380 /nfs/dbraw/zinc/29/83/80/1046298380.db2.gz MOYLMQURDLGAGI-AWEZNQCLSA-N 2 0 342.499 4.426 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(O)cc2)C1 ZINC000237708307 1046355215 /nfs/dbraw/zinc/35/52/15/1046355215.db2.gz QAPMKXJFXUSVHM-ROUUACIJSA-N 2 0 338.495 4.160 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(Cl)cc1 ZINC000162584164 1046365390 /nfs/dbraw/zinc/36/53/90/1046365390.db2.gz GRYWMYYJDILCCK-HNNXBMFYSA-N 2 0 332.875 4.131 20 0 EIADRP C[C@@H](Cc1ccccc1Cl)[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000916834720 1046377454 /nfs/dbraw/zinc/37/74/54/1046377454.db2.gz VVOSHQQTAGVBBI-INIZCTEOSA-N 2 0 346.902 4.001 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508715813 1046381583 /nfs/dbraw/zinc/38/15/83/1046381583.db2.gz XZKKVGXJZCHKKW-FHMICOROSA-N 2 0 346.518 4.073 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)CC1 ZINC000126204195 1046463522 /nfs/dbraw/zinc/46/35/22/1046463522.db2.gz TVTSNWJIXOCREL-KRWDZBQOSA-N 2 0 341.524 4.119 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(OC)c3ccccc23)[C@H](C)C1 ZINC000536682578 1046646161 /nfs/dbraw/zinc/64/61/61/1046646161.db2.gz YTJIHQCDTSXIMP-UZLBHIALSA-N 2 0 326.484 4.011 20 0 EIADRP CN(CC[C@H]1CCCC[N@@H+]1C)Cc1cnc(-c2ccccc2)s1 ZINC000536677826 1046665023 /nfs/dbraw/zinc/66/50/23/1046665023.db2.gz MDEYLBSEHWWCDG-QGZVFWFLSA-N 2 0 329.513 4.116 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(OC(F)F)c(Cl)c2)[C@H](C)C1 ZINC000536678537 1046665452 /nfs/dbraw/zinc/66/54/52/1046665452.db2.gz CASQGRBTSJJWQA-IUODEOHRSA-N 2 0 346.849 4.104 20 0 EIADRP c1ccc(COCCCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000127433302 1046672189 /nfs/dbraw/zinc/67/21/89/1046672189.db2.gz RRSJIPVOLJZSES-UHFFFAOYSA-N 2 0 344.543 4.370 20 0 EIADRP C[C@@H](C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000536703788 1046704836 /nfs/dbraw/zinc/70/48/36/1046704836.db2.gz YQTJWQSGBYNGLK-IBGZPJMESA-N 2 0 337.511 4.424 20 0 EIADRP COc1cccc([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC000536830233 1046807603 /nfs/dbraw/zinc/80/76/03/1046807603.db2.gz BGGWPOAJHBOZGQ-QHGAOEGBSA-N 2 0 330.516 4.389 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc2ccccc2c1 ZINC000536859342 1046826501 /nfs/dbraw/zinc/82/65/01/1046826501.db2.gz RZNWUVUMFNCUKQ-OTWHNJEPSA-N 2 0 340.511 4.380 20 0 EIADRP CC(C)C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccs1 ZINC000536858765 1046826911 /nfs/dbraw/zinc/82/69/11/1046826911.db2.gz RROCLULKLLAEJZ-KSZLIROESA-N 2 0 338.561 4.314 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+]CCc2cccc(Cl)c2Cl)CC1 ZINC000536880459 1046842488 /nfs/dbraw/zinc/84/24/88/1046842488.db2.gz BCTFRNNZNYPUDG-UHFFFAOYSA-N 2 0 329.315 4.388 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c[nH+]cn2c1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000459659924 1046842615 /nfs/dbraw/zinc/84/26/15/1046842615.db2.gz NJHTVNKJICCQBQ-TUKIKUTGSA-N 2 0 331.872 4.331 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c[nH+]cn2c1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000459659922 1046843116 /nfs/dbraw/zinc/84/31/16/1046843116.db2.gz NJHTVNKJICCQBQ-BYCMXARLSA-N 2 0 331.872 4.331 20 0 EIADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000786834612 1046871671 /nfs/dbraw/zinc/87/16/71/1046871671.db2.gz GMYFXYMKGWSAFS-VWEINGBSSA-N 2 0 330.516 4.149 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)C(C)(C)C ZINC000537197946 1047019102 /nfs/dbraw/zinc/01/91/02/1047019102.db2.gz NMYYXLDYGNPYMW-MJGOQNOKSA-N 2 0 330.516 4.389 20 0 EIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000537302979 1047084225 /nfs/dbraw/zinc/08/42/25/1047084225.db2.gz AMRQRMIVZFBCGM-IBGZPJMESA-N 2 0 326.509 4.192 20 0 EIADRP Clc1cc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c2ccccc2n1 ZINC000154613214 1047280579 /nfs/dbraw/zinc/28/05/79/1047280579.db2.gz MHVDVVCLWMXDDZ-UHFFFAOYSA-N 2 0 343.902 4.196 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCCc3c4ccccc4[nH]c32)CC1 ZINC000325748553 1047319542 /nfs/dbraw/zinc/31/95/42/1047319542.db2.gz YDHGQQJKTGOJBR-IBGZPJMESA-N 2 0 325.500 4.398 20 0 EIADRP FC(F)(F)[C@H]1CCC[C@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)C1 ZINC000129221089 1047336283 /nfs/dbraw/zinc/33/62/83/1047336283.db2.gz ZUGZYLZXYNWOIS-ROUUACIJSA-N 2 0 340.433 4.493 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2cc3ccccc3s2)cc1 ZINC000122001217 1047339053 /nfs/dbraw/zinc/33/90/53/1047339053.db2.gz RUHFIFZDVXJOLY-UHFFFAOYSA-N 2 0 340.492 4.132 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]C2CC[NH+](CC3CCCC3)CC2)C1 ZINC000129558819 1047429960 /nfs/dbraw/zinc/42/99/60/1047429960.db2.gz XDIOEDIIAWMGDD-NVXWUHKLSA-N 2 0 332.454 4.352 20 0 EIADRP C[C@@H]1CC[C@H]([NH+]2CCC([NH3+])(Cc3ccccc3C(F)(F)F)CC2)C1 ZINC001170121538 1047482314 /nfs/dbraw/zinc/48/23/14/1047482314.db2.gz MXHWNUBAXLWJRZ-ZBFHGGJFSA-N 2 0 340.433 4.230 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)C[C@H](C)O1 ZINC000556155042 1047498273 /nfs/dbraw/zinc/49/82/73/1047498273.db2.gz QLBQZJBMKKFWHH-DCXXXQMHSA-N 2 0 330.516 4.107 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1ccncc1F ZINC000556235739 1047599687 /nfs/dbraw/zinc/59/96/87/1047599687.db2.gz GTDFTCVXINKQGG-SJORKVTESA-N 2 0 341.474 4.446 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@H](c3ccncc3)C3CC3)CC2)C1 ZINC000898322240 1047614713 /nfs/dbraw/zinc/61/47/13/1047614713.db2.gz IGTZEOQTCPNHHE-HBGVWJBISA-N 2 0 327.516 4.165 20 0 EIADRP C[C@H]([NH2+][C@H](c1ccncc1)C1CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000898322424 1047616569 /nfs/dbraw/zinc/61/65/69/1047616569.db2.gz KZRGPLZIMLCPAU-WTOYTKOKSA-N 2 0 335.495 4.033 20 0 EIADRP FC(F)(F)C1CCC(C[NH+]2CCC(Nc3ccccn3)CC2)CC1 ZINC000546735583 1047674544 /nfs/dbraw/zinc/67/45/44/1047674544.db2.gz BJSJBVXFZBMONW-UHFFFAOYSA-N 2 0 341.421 4.327 20 0 EIADRP c1cn(Cc2cccc(C[NH2+][C@H]3CC[C@H](c4ccccc4)C3)c2)cn1 ZINC000130453921 1047710172 /nfs/dbraw/zinc/71/01/72/1047710172.db2.gz ZDNLAJMFMULPFZ-VXKWHMMOSA-N 2 0 331.463 4.357 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+]C3CCC([NH+](C)C)CC3)cc2)cc1 ZINC001168299901 1047710474 /nfs/dbraw/zinc/71/04/74/1047710474.db2.gz PXDHNTAQJLKUGE-UHFFFAOYSA-N 2 0 338.495 4.325 20 0 EIADRP C[C@H]1CCCC[C@@H]1C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556404283 1047737196 /nfs/dbraw/zinc/73/71/96/1047737196.db2.gz PALZLCWOESVCNY-PKOBYXMFSA-N 2 0 330.516 4.076 20 0 EIADRP Cc1cccc(O[C@H](C)C[NH2+][C@H]2CCN(C)[C@H](c3ccccc3)C2)c1 ZINC000550666090 1047810511 /nfs/dbraw/zinc/81/05/11/1047810511.db2.gz UQPDQSWAOYQUKT-CBQOVEMMSA-N 2 0 338.495 4.187 20 0 EIADRP C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556606277 1047837244 /nfs/dbraw/zinc/83/72/44/1047837244.db2.gz VQTFJENFBVQBLA-LFUKPOHLSA-N 2 0 330.516 4.074 20 0 EIADRP Clc1ccc(Cl)c(C[NH2+]C2CCC3(C[NH2+]C3)CC2)c1Cl ZINC001246348564 1047921998 /nfs/dbraw/zinc/92/19/98/1047921998.db2.gz SCPKICLNVDOUDI-UHFFFAOYSA-N 2 0 333.690 4.269 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171065209 1047923061 /nfs/dbraw/zinc/92/30/61/1047923061.db2.gz VSRRETSMIMSDTJ-MRXNPFEDSA-N 2 0 341.326 4.313 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@@]3(C)CC3(Cl)Cl)CC2)C1 ZINC000824773956 1047926973 /nfs/dbraw/zinc/92/69/73/1047926973.db2.gz PJOOTBHUOGUAEB-VNQPRFMTSA-N 2 0 333.347 4.203 20 0 EIADRP CC1(C)[C@@H]2C[C@@H]([NH+]3CCC4(CC[N@H+](Cc5ccoc5)C4)CC3)C[C@@H]21 ZINC001170749440 1048039207 /nfs/dbraw/zinc/03/92/07/1048039207.db2.gz FCGIZISTRNXDQF-LDLYASANSA-N 2 0 328.500 4.002 20 0 EIADRP CC(C)(C)[C@@H]1OCCC[C@H]1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000131736725 1048127657 /nfs/dbraw/zinc/12/76/57/1048127657.db2.gz SLCYCWBSCSUGOZ-FXAWDEMLSA-N 2 0 336.564 4.214 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@H]21)c1ccc(C(F)(F)F)cc1 ZINC000556890741 1048131927 /nfs/dbraw/zinc/13/19/27/1048131927.db2.gz RQUCCLGEJLYEIC-RNJTYBCJSA-N 2 0 340.433 4.271 20 0 EIADRP Clc1ccc2c(c1)CC[C@H]([NH2+]C1CC[NH+](CC3CCC3)CC1)C2 ZINC001171109754 1048219563 /nfs/dbraw/zinc/21/95/63/1048219563.db2.gz MFKRSUXOSRCRCB-FQEVSTJZSA-N 2 0 332.919 4.051 20 0 EIADRP CCc1ccc(-c2nc(C[N@H+](C)C3CCC([NH3+])CC3)cs2)cc1 ZINC000844220471 1048225785 /nfs/dbraw/zinc/22/57/85/1048225785.db2.gz DRMXKHFREXUYLI-UHFFFAOYSA-N 2 0 329.513 4.074 20 0 EIADRP C(=C\c1ccccc1)\C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499136337 1048331421 /nfs/dbraw/zinc/33/14/21/1048331421.db2.gz QMSQLGKQPZZYMG-XBPVEPMDSA-N 2 0 332.491 4.485 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCOC2CCCCC2)C3)cc1 ZINC000499147823 1048355110 /nfs/dbraw/zinc/35/51/10/1048355110.db2.gz QTWSIFAEBHATIJ-MZADTFQBSA-N 2 0 342.527 4.121 20 0 EIADRP CCCCCC[C@H](CC)[NH2+]C1(C(=O)OC(C)(C)C)CCC([NH3+])CC1 ZINC001170579348 1048362028 /nfs/dbraw/zinc/36/20/28/1048362028.db2.gz RTMQMSBAZRUTBS-GNZRSQJKSA-N 2 0 340.552 4.307 20 0 EIADRP Oc1cccc2c1CC[C@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499153566 1048362469 /nfs/dbraw/zinc/36/24/69/1048362469.db2.gz RVFXRCBDDJZJFB-NXWNEQKCSA-N 2 0 348.490 4.165 20 0 EIADRP c1ccc(N2CCCCC2)c(C[NH2+]CCCCC[NH+]2CCCC2)c1 ZINC000815151039 1048370230 /nfs/dbraw/zinc/37/02/30/1048370230.db2.gz JJJKSBLXEFAVLO-UHFFFAOYSA-N 2 0 329.532 4.033 20 0 EIADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H]2CCc3cc(Cl)c(Cl)cc3C2)C1 ZINC001171139218 1048416813 /nfs/dbraw/zinc/41/68/13/1048416813.db2.gz JWYUFSRSEDCNHS-CJNGLKHVSA-N 2 0 341.326 4.172 20 0 EIADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCc3cc(Cl)c(Cl)cc3C2)C1 ZINC001171149490 1048482862 /nfs/dbraw/zinc/48/28/62/1048482862.db2.gz WOBJQIPDRAGXTI-HRCADAONSA-N 2 0 341.326 4.313 20 0 EIADRP COc1ccc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1Cl ZINC000809738164 1048510437 /nfs/dbraw/zinc/51/04/37/1048510437.db2.gz RTYOLRGORWNMFX-UHFFFAOYSA-N 2 0 332.875 4.042 20 0 EIADRP Cc1ccc(C[NH+]2C[C@H]3C[NH+](Cc4cccc5cc[nH]c54)C[C@@H]3C2)cc1 ZINC001144712434 1048813640 /nfs/dbraw/zinc/81/36/40/1048813640.db2.gz XLAYIONMLXJDRA-VXKWHMMOSA-N 2 0 345.490 4.040 20 0 EIADRP CC(C)n1c2ccccc2nc1[C@@H]1CCC[N@H+](CCCCCC[NH3+])C1 ZINC000846220940 1048844260 /nfs/dbraw/zinc/84/42/60/1048844260.db2.gz ZXBIOLDGFXECJA-GOSISDBHSA-N 2 0 342.531 4.316 20 0 EIADRP c1cc(-c2ncc(C[NH+]3CCC(C[NH+]4CCCC4)CC3)s2)cs1 ZINC000134210915 1048898041 /nfs/dbraw/zinc/89/80/41/1048898041.db2.gz OUKSKJAWDBKKOH-UHFFFAOYSA-N 2 0 347.553 4.179 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]Cc2ccc(CC[NH3+])cc2)cc1 ZINC000817947579 1049063294 /nfs/dbraw/zinc/06/32/94/1049063294.db2.gz BIVBKOLJMBUCSA-QGZVFWFLSA-N 2 0 326.484 4.218 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000817948963 1049063893 /nfs/dbraw/zinc/06/38/93/1049063893.db2.gz MWQUOKXARMXLLR-UHOFOFEASA-N 2 0 334.916 4.185 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccc(SC(F)F)cc1 ZINC000817950548 1049063992 /nfs/dbraw/zinc/06/39/92/1049063992.db2.gz ZRLVSWOVMBOLSL-CYBMUJFWSA-N 2 0 336.451 4.353 20 0 EIADRP COc1ccc2cc([C@@H](C)[NH2+]Cc3ccc(CC[NH3+])cc3)ccc2c1 ZINC000817946939 1049064028 /nfs/dbraw/zinc/06/40/28/1049064028.db2.gz IHOCENAFFAVKRR-MRXNPFEDSA-N 2 0 334.463 4.200 20 0 EIADRP Cc1cc2c(cc1C)[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)CCS2 ZINC000817949448 1049065228 /nfs/dbraw/zinc/06/52/28/1049065228.db2.gz QXPOPEABAKGWPE-LJQANCHMSA-N 2 0 326.509 4.131 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)ccc1SC(F)F ZINC000817957707 1049065653 /nfs/dbraw/zinc/06/56/53/1049065653.db2.gz OLHJUNIMQRUFIG-CHWSQXEVSA-N 2 0 344.471 4.050 20 0 EIADRP CC(C)c1ccc(C2(O)CCC([NH2+][C@@H]3CCCC[C@@H]3C[NH3+])CC2)cc1 ZINC000817961133 1049070369 /nfs/dbraw/zinc/07/03/69/1049070369.db2.gz UTADKXXEELJCAZ-NTYOPAKOSA-N 2 0 344.543 4.047 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(SC(F)F)cc1 ZINC000817967984 1049073240 /nfs/dbraw/zinc/07/32/40/1049073240.db2.gz DQVAOHXAJUYRAQ-GFCCVEGCSA-N 2 0 334.435 4.455 20 0 EIADRP FC(F)Sc1ccc2c(c1)CCC[C@H]2[NH2+]CCC1=CC[NH2+]CC1 ZINC000817985087 1049080395 /nfs/dbraw/zinc/08/03/95/1049080395.db2.gz GWFBFZWJOVLHGB-QGZVFWFLSA-N 2 0 338.467 4.278 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(SC(F)F)cc1 ZINC000817985557 1049080878 /nfs/dbraw/zinc/08/08/78/1049080878.db2.gz LZGZADYPRXRFBX-JSGCOSHPSA-N 2 0 326.456 4.327 20 0 EIADRP CC(C)(C)C[NH+]1CCC([NH2+][C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170911348 1049184801 /nfs/dbraw/zinc/18/48/01/1049184801.db2.gz WGVGCOLQWBCLLK-QGZVFWFLSA-N 2 0 334.935 4.297 20 0 EIADRP Fc1cc(F)c2c(c1)C[C@@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)CC2 ZINC001171353216 1049506347 /nfs/dbraw/zinc/50/63/47/1049506347.db2.gz FECBCHIXLRHQEL-IBGZPJMESA-N 2 0 348.481 4.066 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)c1ccc2c(c1)CCO2 ZINC000773079756 1049569825 /nfs/dbraw/zinc/56/98/25/1049569825.db2.gz YVNXBFMWAAPUND-XLIONFOSSA-N 2 0 330.516 4.030 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389389 1049601461 /nfs/dbraw/zinc/60/14/61/1049601461.db2.gz STKBZOJBHIFBSU-FHWLQOOXSA-N 2 0 348.481 4.161 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)cc3cccnc32)[C@H](C)C1 ZINC000081096714 1049625551 /nfs/dbraw/zinc/62/55/51/1049625551.db2.gz FJRCTWKZTARRIK-RDTXWAMCSA-N 2 0 331.891 4.050 20 0 EIADRP Fc1cccc2c1CC[C@H](N1CCC3(CCC[N@@H+]3CC3CC3)CC1)C2 ZINC001171421103 1049658784 /nfs/dbraw/zinc/65/87/84/1049658784.db2.gz CLHIRPOORNSGNI-IBGZPJMESA-N 2 0 342.502 4.023 20 0 EIADRP CCC(CC)[NH+]1CCC(C[NH2+][C@@H]2CCc3cccc(F)c3C2)CC1 ZINC001170970140 1049673758 /nfs/dbraw/zinc/67/37/58/1049673758.db2.gz KPQQGNHDNHRIEW-GOSISDBHSA-N 2 0 332.507 4.173 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1CCc2c(F)cccc2C1 ZINC001171439395 1049692763 /nfs/dbraw/zinc/69/27/63/1049692763.db2.gz YKEDZPQBCRVPBI-GBESFXJTSA-N 2 0 330.491 4.022 20 0 EIADRP FC1(F)CCC[C@@H]([NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)C1 ZINC000716629299 1049700960 /nfs/dbraw/zinc/70/09/60/1049700960.db2.gz YFYJBWDGYJSGDB-MANSERQUSA-N 2 0 334.454 4.207 20 0 EIADRP C[NH+](C)CC[C@@H]([NH2+][C@H]1CCc2cc(F)c(F)cc2C1)c1ccccc1 ZINC001171454970 1049710718 /nfs/dbraw/zinc/71/07/18/1049710718.db2.gz XXYISNKAVNGLTM-GHTZIAJQSA-N 2 0 344.449 4.105 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(Cl)cc3cccnc32)[C@@H](C)C1 ZINC000245416665 1049712827 /nfs/dbraw/zinc/71/28/27/1049712827.db2.gz FJRCTWKZTARRIK-KBXCAEBGSA-N 2 0 331.891 4.050 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)cc3cccnc32)[C@@H](C)C1 ZINC000245416666 1049713564 /nfs/dbraw/zinc/71/35/64/1049713564.db2.gz FJRCTWKZTARRIK-KSSFIOAISA-N 2 0 331.891 4.050 20 0 EIADRP CC(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cc(F)c(F)cc2C1 ZINC001171471825 1049728575 /nfs/dbraw/zinc/72/85/75/1049728575.db2.gz KPPKIBYUZYRJCC-KZNAEPCWSA-N 2 0 336.470 4.050 20 0 EIADRP CCC(CC)[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cccc(F)c2C1 ZINC001170975629 1049729900 /nfs/dbraw/zinc/72/99/00/1049729900.db2.gz YEASFUVOIWDTJE-WDSOQIARSA-N 2 0 332.507 4.444 20 0 EIADRP Cc1cccc2c1CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC001171551556 1049753283 /nfs/dbraw/zinc/75/32/83/1049753283.db2.gz QEMPQVNZFGECDU-JTHBVZDNSA-N 2 0 348.534 4.354 20 0 EIADRP Cc1cccc2c1CC[C@H]([NH2+]CC1CC[NH+](CC(C)(C)C)CC1)C2 ZINC001171558070 1049754957 /nfs/dbraw/zinc/75/49/57/1049754957.db2.gz CJWZCFNZVLBXMK-FQEVSTJZSA-N 2 0 328.544 4.200 20 0 EIADRP Cc1cccc2c1CC[C@@H]([NH2+]CC1CC[NH+](CC(C)(C)C)CC1)C2 ZINC001171558072 1049755300 /nfs/dbraw/zinc/75/53/00/1049755300.db2.gz CJWZCFNZVLBXMK-HXUWFJFHSA-N 2 0 328.544 4.200 20 0 EIADRP Cc1cccc2c1CC[C@@H]([N@H+](C)C[C@H]1CC[NH+](Cc3ccccc3)C1)C2 ZINC001171573512 1049760699 /nfs/dbraw/zinc/76/06/99/1049760699.db2.gz IYVKHQYLIGSPFI-FYYLOGMGSA-N 2 0 348.534 4.306 20 0 EIADRP C[NH+]1C(C)(C)CC([N@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1(C)C ZINC001171629710 1049761708 /nfs/dbraw/zinc/76/17/08/1049761708.db2.gz DFZGQXLDARXUDK-SAABIXHNSA-N 3 0 335.580 4.152 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CC2(Cc3cccc(F)c3)CC2)CC1(C)C ZINC001171630301 1049762250 /nfs/dbraw/zinc/76/22/50/1049762250.db2.gz LTYTYQXRQJVFIA-UHFFFAOYSA-N 2 0 332.507 4.389 20 0 EIADRP COc1ccc([C@@H]([NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)C2CC2)cc1 ZINC001171622869 1049767953 /nfs/dbraw/zinc/76/79/53/1049767953.db2.gz AUDRITFUUCMPNR-IBGZPJMESA-N 2 0 330.516 4.387 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@@H]2CCc3ccc(Cl)cc3C2)CC1(C)C ZINC001171624834 1049768385 /nfs/dbraw/zinc/76/83/85/1049768385.db2.gz ZIFPUZRZTOENIV-QGZVFWFLSA-N 2 0 334.935 4.438 20 0 EIADRP COc1ccccc1[C@H]1CCC[N@@H+]1C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171638505 1049778720 /nfs/dbraw/zinc/77/87/20/1049778720.db2.gz ZSUMWZIEKATDDF-GOSISDBHSA-N 2 0 330.516 4.484 20 0 EIADRP C[NH+]1C(C)(C)CC([N@@H+]2CCC[C@@H](Oc3ccccc3)C2)CC1(C)C ZINC001171636457 1049779823 /nfs/dbraw/zinc/77/98/23/1049779823.db2.gz DSRZTUKTEHUPDA-LJQANCHMSA-N 2 0 330.516 4.181 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171731437 1049786394 /nfs/dbraw/zinc/78/63/94/1049786394.db2.gz BCAYVCOJERKCFZ-KAGYGMCKSA-N 2 0 349.522 4.258 20 0 EIADRP Fc1cccc2c1C[C@@H]([NH2+]CC1CC[NH+](CC3CCCCC3)CC1)C2 ZINC001171785050 1049803490 /nfs/dbraw/zinc/80/34/90/1049803490.db2.gz JCVAUZJYASCTMP-FQEVSTJZSA-N 2 0 344.518 4.175 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccc2)[C@@H]2Cc3cccc(F)c3C2)CC1 ZINC001171785515 1049804056 /nfs/dbraw/zinc/80/40/56/1049804056.db2.gz OMWCBMGDLCJGSA-VAMGGRTRSA-N 2 0 338.470 4.065 20 0 EIADRP CC[NH+]1CCC(CC2CC[NH+]([C@H]3Cc4cccc(F)c4C3)CC2)CC1 ZINC001171808638 1049808446 /nfs/dbraw/zinc/80/84/46/1049808446.db2.gz BVKHFZVKVNSHOE-FQEVSTJZSA-N 2 0 344.518 4.127 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH+]1CCC([NH3+])(CC2CC2)CC1 ZINC001171964289 1049825181 /nfs/dbraw/zinc/82/51/81/1049825181.db2.gz LXPGIXCVDNERRR-AWEZNQCLSA-N 2 0 340.433 4.230 20 0 EIADRP CC1(C)C[C@H]([NH2+]CCc2ccccc2F)CC[N@@H+]1Cc1ccccc1 ZINC001171963296 1049825828 /nfs/dbraw/zinc/82/58/28/1049825828.db2.gz HMSDNDGKMLSGLU-HXUWFJFHSA-N 2 0 340.486 4.401 20 0 EIADRP CC1(C)C[C@H]([NH2+]CCc2cccc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC001171964750 1049826238 /nfs/dbraw/zinc/82/62/38/1049826238.db2.gz MUTNCYUCOWUOEA-OAQYLSRUSA-N 2 0 340.486 4.401 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CCc2cccc(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC001171964747 1049826582 /nfs/dbraw/zinc/82/65/82/1049826582.db2.gz MUTNCYUCOWUOEA-NRFANRHFSA-N 2 0 340.486 4.401 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C(C)(C)O1 ZINC000245720029 1049838650 /nfs/dbraw/zinc/83/86/50/1049838650.db2.gz OOQTYJZGAFMGEI-YRPNKDGESA-N 2 0 342.527 4.118 20 0 EIADRP CC1(C)C[C@@H]([NH+]2C[C@H]3[C@H](CC3(F)F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171981038 1049838799 /nfs/dbraw/zinc/83/87/99/1049838799.db2.gz JXSOCQXMPSMXJS-SQNIBIBYSA-N 2 0 334.454 4.017 20 0 EIADRP CSC1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172076133 1049844834 /nfs/dbraw/zinc/84/48/34/1049844834.db2.gz VOLVMSGAWZSJFY-ACDBMABISA-N 2 0 344.568 4.400 20 0 EIADRP CO[C@@H]1CCC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001172076427 1049844975 /nfs/dbraw/zinc/84/49/75/1049844975.db2.gz YMXXYPSAOGUMMB-CIAFKFPVSA-N 2 0 342.527 4.073 20 0 EIADRP Cc1cc2c(cn1)CN([C@H]1C[C@H]3CCC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC001172082885 1049847579 /nfs/dbraw/zinc/84/75/79/1049847579.db2.gz NAZSVDZTYCPTFQ-JKHIJQBDSA-N 2 0 347.506 4.291 20 0 EIADRP C[C@H]1OC2(CC[NH+]([C@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4C)CC2)c2ccccc21 ZINC001172133961 1049854593 /nfs/dbraw/zinc/85/45/93/1049854593.db2.gz UUGCNAIWIKHFIE-YRXWBPOGSA-N 2 0 340.511 4.084 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccc(C(=O)c3ccccc3)cc1)C2 ZINC001172101922 1049855925 /nfs/dbraw/zinc/85/59/25/1049855925.db2.gz IFZYVMNGYGQUCZ-KOUNCHBCSA-N 2 0 348.490 4.023 20 0 EIADRP CC(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2c(Cl)cccc2C1 ZINC001171031396 1049876194 /nfs/dbraw/zinc/87/61/94/1049876194.db2.gz WLVWRHLVJKGAMS-BZSNNMDCSA-N 2 0 334.935 4.425 20 0 EIADRP CC[C@@H](C)OCC[C@H](C)[NH2+]CC1CC[NH+](CC2CCCCC2)CC1 ZINC001172326354 1049880112 /nfs/dbraw/zinc/88/01/12/1049880112.db2.gz CRTCDMXQECZUGS-RBUKOAKNSA-N 2 0 338.580 4.462 20 0 EIADRP CC[C@@H](C)OCC[C@@H](C)[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1 ZINC001172353290 1049893235 /nfs/dbraw/zinc/89/32/35/1049893235.db2.gz MRBISUBCKLSHFM-WOJBJXKFSA-N 2 0 344.543 4.178 20 0 EIADRP CC[C@H](CC(C)C)[NH+]1CCC2(C[C@@H]([N@H+](C)Cc3ccco3)CO2)CC1 ZINC001172402923 1049899155 /nfs/dbraw/zinc/89/91/55/1049899155.db2.gz PSRIQKLDUMVNBS-RTBURBONSA-N 2 0 348.531 4.160 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1ccccn1 ZINC000246068727 1049901209 /nfs/dbraw/zinc/90/12/09/1049901209.db2.gz ZDBXKPMCAWAMNK-CEXWTWQISA-N 2 0 337.511 4.410 20 0 EIADRP CC(C)COCC[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172455590 1049915814 /nfs/dbraw/zinc/91/58/14/1049915814.db2.gz UJBSFTWZEPADIM-UVUJQTEASA-N 2 0 344.543 4.223 20 0 EIADRP c1ccc([C@@H]2CC[C@@H]([NH2+]CC3CC[NH+](Cc4ccccn4)CC3)C2)cc1 ZINC001172557366 1049932518 /nfs/dbraw/zinc/93/25/18/1049932518.db2.gz PEBRNVKXJKUXFT-FGZHOGPDSA-N 2 0 349.522 4.220 20 0 EIADRP CC1(C)CC([NH2+]C2CC[NH+](CC3CCCCC3)CC2)CC(C)(C)O1 ZINC001172652628 1049955853 /nfs/dbraw/zinc/95/58/53/1049955853.db2.gz BWDKMRVHDYCMDQ-UHFFFAOYSA-N 2 0 336.564 4.357 20 0 EIADRP CC[N@H+]([C@@H]1CCOC1)C1CC[NH+](C2CCC3(CCCC3)CC2)CC1 ZINC001172729939 1049969186 /nfs/dbraw/zinc/96/91/86/1049969186.db2.gz OHGNATILXHKHMS-HXUWFJFHSA-N 2 0 334.548 4.065 20 0 EIADRP Clc1ccc2c(c1)C[C@@H]([NH2+]CC1CC[NH+](C3CCCCC3)CC1)C2 ZINC001172709643 1049971382 /nfs/dbraw/zinc/97/13/82/1049971382.db2.gz CVGVVBJMTGKYDR-FQEVSTJZSA-N 2 0 346.946 4.442 20 0 EIADRP Clc1ccc2c(c1)C[C@@H]([NH2+]C1CC[NH+](CC3CCCCC3)CC1)C2 ZINC001172715250 1049972946 /nfs/dbraw/zinc/97/29/46/1049972946.db2.gz GRMNECHAXGCMBW-NRFANRHFSA-N 2 0 346.946 4.442 20 0 EIADRP Cc1nccn1-c1ccc(C[NH2+][C@@H]2C[C@@H](c3ccccc3)C2(C)C)cn1 ZINC000181012249 1049977510 /nfs/dbraw/zinc/97/75/10/1049977510.db2.gz ONYHJGJCUAZPLE-VQTJNVASSA-N 2 0 346.478 4.248 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3OC)cc2)C1 ZINC000246902580 1050005546 /nfs/dbraw/zinc/00/55/46/1050005546.db2.gz FWKAEEXJTUXSQM-MSOLQXFVSA-N 2 0 338.495 4.355 20 0 EIADRP COc1ccc(-c2csc(C[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@@H]3C)c2)cc1 ZINC000247090503 1050013272 /nfs/dbraw/zinc/01/32/72/1050013272.db2.gz NYURUBODSGXAKA-BXTJHSDWSA-N 2 0 344.524 4.242 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cc(C)sc2C)[C@@H](C)C1 ZINC000247087681 1050013736 /nfs/dbraw/zinc/01/37/36/1050013736.db2.gz PEQLWUNCNZJPFO-GMBSWORKSA-N 2 0 338.561 4.153 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1F ZINC000248404757 1050054476 /nfs/dbraw/zinc/05/44/76/1050054476.db2.gz QQSGFBNKVBVSOF-UXLLHSPISA-N 2 0 334.479 4.138 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@H]([NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000249163589 1050093659 /nfs/dbraw/zinc/09/36/59/1050093659.db2.gz ZXQGROWEKLXDSQ-KURKYZTESA-N 2 0 340.433 4.219 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)CCCS2 ZINC000249181285 1050094310 /nfs/dbraw/zinc/09/43/10/1050094310.db2.gz IIFXFDGMSHGQPO-LPHOPBHVSA-N 2 0 348.556 4.332 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1cccc(O)c1 ZINC000249588563 1050102631 /nfs/dbraw/zinc/10/26/31/1050102631.db2.gz OSRRLZCQGGDWCB-ZWKOTPCHSA-N 2 0 338.495 4.475 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc3ccccc3)C1)CC2 ZINC001172825425 1050166276 /nfs/dbraw/zinc/16/62/76/1050166276.db2.gz GXKYYGRURNLFIJ-ZJSXRUAMSA-N 2 0 348.534 4.354 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([N@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828153 1050166927 /nfs/dbraw/zinc/16/69/27/1050166927.db2.gz IPRRGCNJDTXLJH-CEMLEFRQSA-N 2 0 326.528 4.367 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([NH+]1CCC([N@H+](C)Cc3ccccc3)CC1)CC2 ZINC001172830117 1050169603 /nfs/dbraw/zinc/16/96/03/1050169603.db2.gz FXDFQFUCNCRAFF-DEOSSOPVSA-N 2 0 348.534 4.449 20 0 EIADRP CC(C)[NH+]1CCC(C[NH2+][C@@H](C)Cc2c(F)cccc2Cl)CC1 ZINC001172846776 1050186284 /nfs/dbraw/zinc/18/62/84/1050186284.db2.gz XPCUGYOAUQUGEJ-AWEZNQCLSA-N 2 0 326.887 4.120 20 0 EIADRP Cc1coc(C[NH2+]Cc2ccc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)c1 ZINC001177282844 1050187303 /nfs/dbraw/zinc/18/73/03/1050187303.db2.gz OCSPKTWVOLTSER-IAGOWNOFSA-N 2 0 326.484 4.356 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[NH2+]CC1CC[NH+](C2CCC2)CC1 ZINC001172857747 1050193214 /nfs/dbraw/zinc/19/32/14/1050193214.db2.gz HZEJTXAZFSTDAE-CQSZACIVSA-N 2 0 338.898 4.264 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC001172864124 1050202010 /nfs/dbraw/zinc/20/20/10/1050202010.db2.gz UQIGVTMKLUNWDP-AWEZNQCLSA-N 2 0 334.866 4.262 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC001172871043 1050210132 /nfs/dbraw/zinc/21/01/32/1050210132.db2.gz HLHKHJPXKCIEPW-OAHLLOKOSA-N 2 0 338.898 4.218 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H](C)CSc2ccc(Cl)cc2)CC1 ZINC001172874934 1050215336 /nfs/dbraw/zinc/21/53/36/1050215336.db2.gz JLCCAYVXLOVFOS-AWEZNQCLSA-N 2 0 326.937 4.142 20 0 EIADRP C[C@@H](CSc1ccc(Cl)cc1)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC001172876081 1050216007 /nfs/dbraw/zinc/21/60/07/1050216007.db2.gz VZSSATJYUCOIDV-GJZGRUSLSA-N 2 0 326.937 4.142 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1cccc(OCC[NH+](C)C)c1 ZINC000090963515 1050217859 /nfs/dbraw/zinc/21/78/59/1050217859.db2.gz FWBAEKGTXQLKPT-CABCVRRESA-N 2 0 348.437 4.317 20 0 EIADRP Cc1cc(Nc2ccc(C3CC[NH+](C)CC3)cc2)n(-c2cc[nH+]cc2)n1 ZINC001212689590 1050230013 /nfs/dbraw/zinc/23/00/13/1050230013.db2.gz CYCOCRLFGCTAOB-UHFFFAOYSA-N 2 0 347.466 4.129 20 0 EIADRP CO[C@H]1CCC[C@@H]([N@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001172922263 1050236870 /nfs/dbraw/zinc/23/68/70/1050236870.db2.gz GMXLSBDRIXULET-OKDVXBPUSA-N 2 0 342.527 4.072 20 0 EIADRP C1=CC[C@H](C[NH+]2CCC([NH2+]C3CCC4(CCOCC4)CC3)CC2)CC1 ZINC001173045668 1050270846 /nfs/dbraw/zinc/27/08/46/1050270846.db2.gz KVRGPQVDHSYNCN-IBGZPJMESA-N 2 0 346.559 4.136 20 0 EIADRP FC(F)(F)Cc1ccccc1C[NH2+]CCCCNc1ccccn1 ZINC001177655130 1050277499 /nfs/dbraw/zinc/27/74/99/1050277499.db2.gz BRSGOPZALILOHN-UHFFFAOYSA-N 2 0 337.389 4.168 20 0 EIADRP c1ccc2c(c1)ccnc2C[NH2+]CCCCCCC[NH+]1CCCC1 ZINC001177737359 1050289039 /nfs/dbraw/zinc/28/90/39/1050289039.db2.gz MIDDYRADHWPMDZ-UHFFFAOYSA-N 2 0 325.500 4.371 20 0 EIADRP CC[NH+](CC)C1CCC(n2cc(CC[NH3+])c3ccc(C)cc32)CC1 ZINC001173101396 1050301871 /nfs/dbraw/zinc/30/18/71/1050301871.db2.gz IIUZPARJIBDGFO-UHFFFAOYSA-N 2 0 327.516 4.276 20 0 EIADRP CCO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)C1 ZINC001177803799 1050304911 /nfs/dbraw/zinc/30/49/11/1050304911.db2.gz HKQKTKXNFPBOJV-FGZHOGPDSA-N 2 0 344.543 4.500 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](C)COc2c(C)cccc2C)CC1 ZINC001173104004 1050305382 /nfs/dbraw/zinc/30/53/82/1050305382.db2.gz ZRSKCANSNRRLBU-XEVCZEQESA-N 2 0 332.532 4.313 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCOc2ccc(SC)cc2)CC1 ZINC001173104769 1050305603 /nfs/dbraw/zinc/30/56/03/1050305603.db2.gz VGFLGJXBFTWPII-UHFFFAOYSA-N 2 0 336.545 4.030 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2CC[NH+](C[C@@H]3CC=CCC3)CC2)CC1 ZINC001173108860 1050307758 /nfs/dbraw/zinc/30/77/58/1050307758.db2.gz SNFCPLHHXANPQG-VRKFHHGPSA-N 2 0 347.591 4.050 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@H]2c2ccccc2OC)CC1 ZINC001173112660 1050309338 /nfs/dbraw/zinc/30/93/38/1050309338.db2.gz YVGOCGWRCCWNSL-QLOJAFMTSA-N 2 0 330.516 4.485 20 0 EIADRP c1cncc(-c2cccc(C[N@@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)c2)c1 ZINC000092066483 1050314196 /nfs/dbraw/zinc/31/41/96/1050314196.db2.gz VJURAIARAHDNKP-GGAORHGYSA-N 2 0 347.506 4.197 20 0 EIADRP c1ccc(OC2CCC([NH2+]C3CC[NH+](CC4CCC4)CC3)CC2)cc1 ZINC001173199044 1050343316 /nfs/dbraw/zinc/34/33/16/1050343316.db2.gz PVDZXQDMLDBKME-UHFFFAOYSA-N 2 0 342.527 4.231 20 0 EIADRP c1ccc(OC2CCC([NH2+]C3CC[NH+](C4CCCC4)CC3)CC2)cc1 ZINC001173200056 1050345211 /nfs/dbraw/zinc/34/52/11/1050345211.db2.gz KMCQLEVLCLKVCB-UHFFFAOYSA-N 2 0 342.527 4.373 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+][C@@H]3CCO[C@@H](C)C3)[C@@H](C)C2)CC[C@H]1[NH3+] ZINC001173170158 1050347299 /nfs/dbraw/zinc/34/72/99/1050347299.db2.gz LYMXSDHTMGCEQE-OETUHIFDSA-N 2 0 336.564 4.102 20 0 EIADRP CC[C@H]1CC[C@H]([N@H+](Cc2cccc(OC)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173271849 1050392266 /nfs/dbraw/zinc/39/22/66/1050392266.db2.gz RMIPXAIPMTYXTP-LEAZDLGRSA-N 2 0 330.516 4.346 20 0 EIADRP CCSC[C@H](C)[NH+]1CCC2(CC[C@@H]2[N@H+](C)Cc2ccco2)CC1 ZINC001173299051 1050400901 /nfs/dbraw/zinc/40/09/01/1050400901.db2.gz AIIGQEFRPFWKIF-WMZOPIPTSA-N 2 0 336.545 4.098 20 0 EIADRP CCSC[C@H](C)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001173306369 1050404242 /nfs/dbraw/zinc/40/42/42/1050404242.db2.gz TYUONFRNQPHAMP-SFHVURJKSA-N 2 0 332.557 4.116 20 0 EIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2ccc(F)cc2F)C[N@@H+]1Cc1ccccc1 ZINC001178207951 1050404566 /nfs/dbraw/zinc/40/45/66/1050404566.db2.gz JKLCUJDGELSWEZ-FUHWJXTLSA-N 2 0 344.449 4.355 20 0 EIADRP CC[C@H]1CC[C@@H]([NH+]2CCC3(CC([N@H+](C)Cc4ccncc4)C3)CC2)C1 ZINC001173278991 1050408451 /nfs/dbraw/zinc/40/84/51/1050408451.db2.gz NVMAZKALAOKVRT-AZUAARDMSA-N 2 0 341.543 4.337 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2ccoc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001178330262 1050437462 /nfs/dbraw/zinc/43/74/62/1050437462.db2.gz ALMSVPXXIXCOGO-DYESRHJHSA-N 2 0 334.463 4.433 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@H]3CCSc4ccccc43)C2)cc1 ZINC000253355641 1050454925 /nfs/dbraw/zinc/45/49/25/1050454925.db2.gz UIUPMCIFKFYCKM-QUCCMNQESA-N 2 0 338.520 4.335 20 0 EIADRP CC(C)Oc1ccc(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC001178457724 1050475554 /nfs/dbraw/zinc/47/55/54/1050475554.db2.gz CGLPVPRKQIHJMJ-MJGOQNOKSA-N 2 0 330.516 4.216 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001173550594 1050488345 /nfs/dbraw/zinc/48/83/45/1050488345.db2.gz MBDQHBDUDQOZBN-CQSZACIVSA-N 2 0 341.326 4.342 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccccn2)ccc1OC ZINC000182194223 1050539645 /nfs/dbraw/zinc/53/96/45/1050539645.db2.gz DSVNDUSNPXTJJO-SJORKVTESA-N 2 0 341.499 4.344 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)[C@H]1CCC[C@H](C)C1 ZINC001178962041 1050598789 /nfs/dbraw/zinc/59/87/89/1050598789.db2.gz ATJNVBXWFARBJJ-ZJOUEHCJSA-N 2 0 344.543 4.466 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc3nc(Cl)ccc3s2)C[C@@H]1C ZINC001204236525 1050614809 /nfs/dbraw/zinc/61/48/09/1050614809.db2.gz HVJZJFPMJRXJAF-QWHCGFSZSA-N 2 0 337.920 4.254 20 0 EIADRP CC[N@H+](CCC[NH2+][C@@H]1CCc2ccc(OC)cc2C1)C1CCCCC1 ZINC001179090990 1050630119 /nfs/dbraw/zinc/63/01/19/1050630119.db2.gz MVLUQULHJWRAJG-HXUWFJFHSA-N 2 0 344.543 4.187 20 0 EIADRP CC1(C)CCC[C@@H](C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C1 ZINC001179094885 1050631217 /nfs/dbraw/zinc/63/12/17/1050631217.db2.gz DIQFPJOPMADHCA-HXUWFJFHSA-N 2 0 329.532 4.100 20 0 EIADRP CO[C@H]1CCC[C@@H]([NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001179278725 1050671546 /nfs/dbraw/zinc/67/15/46/1050671546.db2.gz YHBCDTKZVXKOED-YADHBBJMSA-N 2 0 344.543 4.226 20 0 EIADRP Cc1cccc([C@@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)C(C)C)c1 ZINC001179325360 1050675138 /nfs/dbraw/zinc/67/51/38/1050675138.db2.gz VTMLIPAVFRJYLT-QFIPXVFZSA-N 2 0 340.511 4.422 20 0 EIADRP COc1cc(C[NH2+]C2CCC(C)([NH+]3CCCC3)CC2)ccc1SC ZINC001179610892 1050731935 /nfs/dbraw/zinc/73/19/35/1050731935.db2.gz BCXSRJZFNCMWRD-UHFFFAOYSA-N 2 0 348.556 4.304 20 0 EIADRP CC[NH+](CC)CCO[C@H]1CC[N@H+](C/C=C\c2cc(C)c(C)cc2C)C1 ZINC001180081737 1050877150 /nfs/dbraw/zinc/87/71/50/1050877150.db2.gz NLLAXUWXTMNCQD-BVGULUMVSA-N 2 0 344.543 4.058 20 0 EIADRP c1ccc2c(c1)CC[C@@H]2C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC001180125407 1050893197 /nfs/dbraw/zinc/89/31/97/1050893197.db2.gz YGVHUMMIZNNRJD-OAQYLSRUSA-N 2 0 326.528 4.304 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCCSC)cc1C[NH+]1CCCCC1 ZINC000182993547 1050926374 /nfs/dbraw/zinc/92/63/74/1050926374.db2.gz LOJJKYWDOSDGMM-INIZCTEOSA-N 2 0 336.545 4.085 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)C1CCCC1 ZINC001180301651 1050943962 /nfs/dbraw/zinc/94/39/62/1050943962.db2.gz OUDFYHZMGVUPNG-AGOPTVSRSA-N 2 0 326.528 4.455 20 0 EIADRP c1ccc(CC2(C[NH2+]C3CC[NH+](CC4CC4)CC3)CCCC2)cc1 ZINC001180339227 1050957830 /nfs/dbraw/zinc/95/78/30/1050957830.db2.gz NBRQXACCGFWRFD-UHFFFAOYSA-N 2 0 326.528 4.254 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2c(OC)cccc2OC)CC1 ZINC001180821159 1051084252 /nfs/dbraw/zinc/08/42/52/1051084252.db2.gz WHOXGXCKSMNJNW-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP C[C@H](CC[NH2+][C@@H](C)CCc1cncc2ccccc21)[NH+]1CCCCC1 ZINC001180809153 1051087360 /nfs/dbraw/zinc/08/73/60/1051087360.db2.gz BDMZYUYXTYLOER-RBUKOAKNSA-N 2 0 339.527 4.410 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2cc(F)ccc2OC)CC1 ZINC001180819685 1051091057 /nfs/dbraw/zinc/09/10/57/1051091057.db2.gz JNXGVERILUCTLF-UHFFFAOYSA-N 2 0 336.495 4.168 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](CCCSCc2ccccc2)CC1 ZINC001190348557 1051159613 /nfs/dbraw/zinc/15/96/13/1051159613.db2.gz MKNZUXAEJJSQTO-UHFFFAOYSA-N 2 0 334.573 4.364 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000775388774 1051187985 /nfs/dbraw/zinc/18/79/85/1051187985.db2.gz TVIZAXSSTPSNNB-DYVFJYSZSA-N 2 0 340.483 4.310 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccc(F)cc1F ZINC000153535501 1051190039 /nfs/dbraw/zinc/19/00/39/1051190039.db2.gz SJKMZIWNLFBRTP-LSDHHAIUSA-N 2 0 348.437 4.317 20 0 EIADRP C[C@@H](CCOCc1ccccc1)[NH2+]C[C@@H]1CCC[N@@H+]1C1CCCCC1 ZINC001181276820 1051196455 /nfs/dbraw/zinc/19/64/55/1051196455.db2.gz RQKBHDJMIWVGDA-UGKGYDQZSA-N 2 0 344.543 4.369 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCCS2)cc1C[NH+]1CCCCC1 ZINC000775395817 1051210985 /nfs/dbraw/zinc/21/09/85/1051210985.db2.gz MKFJRVKWBZSWRZ-LPHOPBHVSA-N 2 0 348.556 4.227 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@H]2CCO[C@@H](C)C2)ccc1OC ZINC000775398522 1051229138 /nfs/dbraw/zinc/22/91/38/1051229138.db2.gz AKWVPSSFMLKQPC-BZSNNMDCSA-N 2 0 348.531 4.003 20 0 EIADRP CCSc1cccc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c1 ZINC001181488183 1051237791 /nfs/dbraw/zinc/23/77/91/1051237791.db2.gz SAOJGASRSIKKQU-UHFFFAOYSA-N 2 0 328.525 4.492 20 0 EIADRP Cc1cccc(CCC[N@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC001190651646 1051245228 /nfs/dbraw/zinc/24/52/28/1051245228.db2.gz OVXCPYRRULLHRW-QFIPXVFZSA-N 2 0 328.544 4.372 20 0 EIADRP Clc1ccc([C@H]2CC[C@H]([NH2+]Cc3ccc4c[nH+]cn4c3)C2)cc1 ZINC001182249674 1051440280 /nfs/dbraw/zinc/44/02/80/1051440280.db2.gz FYTFTULKKNNNBO-WMZOPIPTSA-N 2 0 325.843 4.414 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2cc[nH]c2c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311009196 1051453597 /nfs/dbraw/zinc/45/35/97/1051453597.db2.gz WXUZODRPQNQOLU-UTKZUKDTSA-N 2 0 333.479 4.168 20 0 EIADRP COc1cc(C)ccc1[C@H](C)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311188771 1051470727 /nfs/dbraw/zinc/47/07/27/1051470727.db2.gz DJWVWNJTRNVTPU-ICSRJNTNSA-N 2 0 338.495 4.176 20 0 EIADRP CC1(C)C(C[NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)C1(C)C ZINC000716674267 1051500302 /nfs/dbraw/zinc/50/03/02/1051500302.db2.gz XAOUHSXPEYKUCH-OTWHNJEPSA-N 2 0 326.528 4.311 20 0 EIADRP COC(C)(C)[C@H](C)[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000671113284 1051658160 /nfs/dbraw/zinc/65/81/60/1051658160.db2.gz RMWGNOMPNDEXMS-IBGZPJMESA-N 2 0 346.559 4.124 20 0 EIADRP C[C@@H]1SCC[C@@H]1[NH2+]C[C@]1(C(C)(C)C)CC[N@H+](Cc2ccccc2)C1 ZINC001182726495 1051689030 /nfs/dbraw/zinc/68/90/30/1051689030.db2.gz UBWVZDNFWOZPGK-HFSMHLIXSA-N 2 0 346.584 4.408 20 0 EIADRP C[C@@]1(C[NH3+])CCCC[N@H+](CCCc2ccc(C(F)(F)F)cc2)C1 ZINC001206541392 1051709480 /nfs/dbraw/zinc/70/94/80/1051709480.db2.gz HAVZFMFMTAXHHW-KRWDZBQOSA-N 2 0 328.422 4.089 20 0 EIADRP CN(CCC[NH+]1CCC(CCC[NH+]2CCCC2)CC1)c1ccccc1 ZINC001192402042 1051724223 /nfs/dbraw/zinc/72/42/23/1051724223.db2.gz RMXXKKCXKWYJSX-UHFFFAOYSA-N 2 0 343.559 4.101 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC(NC[C@H]2CC[N@@H+]2C2CCCCC2)CC1 ZINC001182918238 1051746606 /nfs/dbraw/zinc/74/66/06/1051746606.db2.gz KMLSZNISQLRKIH-QIJUGHKUSA-N 2 0 347.591 4.026 20 0 EIADRP C[C@@H](CC(C)(C)c1ccccc1)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC001183093923 1051785312 /nfs/dbraw/zinc/78/53/12/1051785312.db2.gz HAORXWSGVHPCMQ-AZUAARDMSA-N 2 0 328.544 4.454 20 0 EIADRP C[C@H](CCc1c[nH]c2ccccc12)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC001183095482 1051787277 /nfs/dbraw/zinc/78/72/77/1051787277.db2.gz QFQVCZGBMOYIHX-IEBWSBKVSA-N 2 0 339.527 4.201 20 0 EIADRP C[C@@H](CCc1c[nH]c2ccccc12)[NH2+]C[C@@H]1CCN1C1CCCC1 ZINC001183238852 1051810129 /nfs/dbraw/zinc/81/01/29/1051810129.db2.gz QKKYXJHQKFFCQI-LPHOPBHVSA-N 2 0 325.500 4.096 20 0 EIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CCO[C@H]3c3ccccc3)CC2)C1 ZINC001183312254 1051825276 /nfs/dbraw/zinc/82/52/76/1051825276.db2.gz HDCXIZBFLRTFFU-MVWVFHAYSA-N 2 0 342.527 4.149 20 0 EIADRP C[N@H+](CC[C@@H]1C[C@H]1C1CC1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001192909092 1051830143 /nfs/dbraw/zinc/83/01/43/1051830143.db2.gz CGGWBGDBGTWDSF-CTNGQTDRSA-N 2 0 327.516 4.056 20 0 EIADRP CCc1ccccc1CC[N@@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001175972355 1051855076 /nfs/dbraw/zinc/85/50/76/1051855076.db2.gz AOJOUIMBHCXRFA-BJKOFHAPSA-N 2 0 348.534 4.245 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2)CC1 ZINC001184135355 1051952177 /nfs/dbraw/zinc/95/21/77/1051952177.db2.gz OYSOAFKRABOLOK-BJTVZRGDSA-N 2 0 326.528 4.394 20 0 EIADRP C[C@@H](Cc1coc2ccccc12)[NH2+]C1CCC(C)([NH+]2CCC2)CC1 ZINC001184135779 1051953355 /nfs/dbraw/zinc/95/33/55/1051953355.db2.gz WOFNNWITICYTQU-AFJQURTJSA-N 2 0 326.484 4.360 20 0 EIADRP CCOc1ccc(CC[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)cc1 ZINC001184142935 1051954426 /nfs/dbraw/zinc/95/44/26/1051954426.db2.gz NTWDKKNXMHLCIX-NQIIRXRSSA-N 2 0 344.543 4.261 20 0 EIADRP CCOc1ccc(CC[NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)cc1 ZINC001184142934 1051955039 /nfs/dbraw/zinc/95/50/39/1051955039.db2.gz NTWDKKNXMHLCIX-GHTZIAJQSA-N 2 0 344.543 4.261 20 0 EIADRP CCN1CCC([NH2+][C@H](C)c2ccc(SCC(F)(F)F)cc2)CC1 ZINC000159262955 1051964675 /nfs/dbraw/zinc/96/46/75/1051964675.db2.gz UKGVUDQIMQHDPF-CYBMUJFWSA-N 2 0 346.462 4.476 20 0 EIADRP CCc1ccc(CC[N@H+]2C[C@@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001176261399 1051987766 /nfs/dbraw/zinc/98/77/66/1051987766.db2.gz AAJRVHWDSYQMEN-RPWUZVMVSA-N 2 0 348.534 4.245 20 0 EIADRP Cc1nc2c(s1)[C@H]([NH2+]CC1CC[NH+](CCC(C)C)CC1)CCC2 ZINC000163592732 1051997455 /nfs/dbraw/zinc/99/74/55/1051997455.db2.gz QUYQKPNOUDBCOT-QGZVFWFLSA-N 2 0 335.561 4.177 20 0 EIADRP C[C@H](Cc1ccc(-c2ccccc2)cc1)[NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@@H]12 ZINC001184386273 1052001479 /nfs/dbraw/zinc/00/14/79/1052001479.db2.gz AMWFWTLGJPVKGC-ULLYJBBUSA-N 2 0 334.507 4.214 20 0 EIADRP CC(C)O[C@H]1C[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)C1(C)C ZINC001194458349 1052148073 /nfs/dbraw/zinc/14/80/73/1052148073.db2.gz RIRSWRTXQVVTGO-SFTDATJTSA-N 2 0 344.543 4.354 20 0 EIADRP CC(C)O[C@H]1C[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)C1(C)C ZINC001194458348 1052148792 /nfs/dbraw/zinc/14/87/92/1052148792.db2.gz RIRSWRTXQVVTGO-RTWAWAEBSA-N 2 0 344.543 4.354 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cc3ccccc3n2C)cc1 ZINC001177132240 1052233928 /nfs/dbraw/zinc/23/39/28/1052233928.db2.gz DDCHTPBLRGQKPV-UHFFFAOYSA-N 2 0 335.495 4.310 20 0 EIADRP Cc1nc(-c2ccc(CC[NH2+][C@@H]3CC[N@@H+](C)C(C)(C)C3)s2)cs1 ZINC000623344534 1052627004 /nfs/dbraw/zinc/62/70/04/1052627004.db2.gz RHPJWHUOUSMSEM-CQSZACIVSA-N 2 0 349.569 4.185 20 0 EIADRP COc1cc([C@@H](C)N[C@@H]2CC[N@H+](C)C(C)(C)C2)ccc1OCC(C)C ZINC000623348637 1052629299 /nfs/dbraw/zinc/62/92/99/1052629299.db2.gz FIHOIIMJFARUEN-SJLPKXTDSA-N 2 0 348.531 4.253 20 0 EIADRP C[C@@H](C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(C(F)(F)F)cc1 ZINC000623503875 1052668182 /nfs/dbraw/zinc/66/81/82/1052668182.db2.gz RFACSZBYBDEXGN-BBRMVZONSA-N 2 0 328.422 4.271 20 0 EIADRP C[C@H](C[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(C(F)(F)F)cc1 ZINC000623503876 1052668309 /nfs/dbraw/zinc/66/83/09/1052668309.db2.gz RFACSZBYBDEXGN-CJNGLKHVSA-N 2 0 328.422 4.271 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(Cl)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000178042552 1052696620 /nfs/dbraw/zinc/69/66/20/1052696620.db2.gz DXYPIHIIHDKVLZ-OAHLLOKOSA-N 2 0 332.875 4.131 20 0 EIADRP C[C@@H]1C[C@@H](N[C@@H](COc2ccccc2F)c2ccccc2)CC[N@@H+]1C ZINC000178115372 1052700724 /nfs/dbraw/zinc/70/07/24/1052700724.db2.gz XUHMXRLUOFNMBL-KPFFTGBYSA-N 2 0 342.458 4.018 20 0 EIADRP CO[C@H](C[NH2+][C@H](C)c1ccc(-n2ccnc2C)cc1)c1ccccc1 ZINC000178458202 1052705888 /nfs/dbraw/zinc/70/58/88/1052705888.db2.gz YHSQQJFIAILUPY-IIBYNOLFSA-N 2 0 335.451 4.219 20 0 EIADRP Cc1ccc(Br)cc1[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000623866014 1052825811 /nfs/dbraw/zinc/82/58/11/1052825811.db2.gz IJSORYRKXMLZGK-BPUTZDHNSA-N 2 0 337.305 4.035 20 0 EIADRP Cc1csc([C@H](C)NC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)n1 ZINC000623898807 1052831871 /nfs/dbraw/zinc/83/18/71/1052831871.db2.gz RKQNOGNWMVQUOP-OFQRWUPVSA-N 2 0 335.542 4.247 20 0 EIADRP Cc1ccc(Br)cc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000623996146 1052849163 /nfs/dbraw/zinc/84/91/63/1052849163.db2.gz VBDZNAGGGPLBGI-WWTUQBGBSA-N 2 0 337.305 4.033 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCCC[C@H]2Sc2ccc(F)cc2)C1 ZINC000624008966 1052855133 /nfs/dbraw/zinc/85/51/33/1052855133.db2.gz LWIFCDRUTWPOJY-QNDJGXFYSA-N 2 0 336.520 4.159 20 0 EIADRP Cc1ccc(C(C)(C)C[NH2+][C@@H](C)c2ccc(-n3ccnc3)cc2)nc1 ZINC000624113865 1052866697 /nfs/dbraw/zinc/86/66/97/1052866697.db2.gz OGBSZOPWAVIEDT-KRWDZBQOSA-N 2 0 334.467 4.204 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccc(F)cc1C(F)(F)F ZINC000624125008 1052868127 /nfs/dbraw/zinc/86/81/27/1052868127.db2.gz QUOXXPWTDWFLTH-STQMWFEESA-N 2 0 332.385 4.227 20 0 EIADRP Cc1cc(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c2ccccc2n1 ZINC000185694700 1053020547 /nfs/dbraw/zinc/02/05/47/1053020547.db2.gz MEMZAHOUNBGOPK-ZWKOTPCHSA-N 2 0 337.511 4.286 20 0 EIADRP C[C@@H]([NH2+]CCSc1ccccc1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185706708 1053021057 /nfs/dbraw/zinc/02/10/57/1053021057.db2.gz JJEFSPWWSXWCRU-CVEARBPZSA-N 2 0 336.520 4.160 20 0 EIADRP Cc1cc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(C)s1 ZINC000381862460 1053107274 /nfs/dbraw/zinc/10/72/74/1053107274.db2.gz JAUMRKJKSPTQCJ-APWZRJJASA-N 2 0 328.525 4.365 20 0 EIADRP C[C@H]([NH2+]Cc1cc(Cl)cs1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000382062854 1053137958 /nfs/dbraw/zinc/13/79/58/1053137958.db2.gz PYXCHVBJSWHZOZ-HOCLYGCPSA-N 2 0 334.916 4.402 20 0 EIADRP FC(F)Sc1ccc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1 ZINC000850419108 1053194828 /nfs/dbraw/zinc/19/48/28/1053194828.db2.gz BBQKJDBHYCHCBX-UHFFFAOYSA-N 2 0 340.483 4.213 20 0 EIADRP c1cc(C[NH+]2CCC(C[NH2+][C@@H]3CC[C@@H]4CCCC[C@@H]4C3)CC2)ccn1 ZINC000850516350 1053278547 /nfs/dbraw/zinc/27/85/47/1053278547.db2.gz BTOSQUNGOSPLGX-BHDDXSALSA-N 2 0 341.543 4.242 20 0 EIADRP Cc1ccc(F)cc1C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000383507519 1053346502 /nfs/dbraw/zinc/34/65/02/1053346502.db2.gz KMZPZKCAKOAWAU-MJGOQNOKSA-N 2 0 326.459 4.134 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cnn(-c2ccccc2)c1 ZINC000764960055 1053398316 /nfs/dbraw/zinc/39/83/16/1053398316.db2.gz CBYBRKQUXZKJQA-OALUTQOASA-N 2 0 340.515 4.035 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cnn(-c2ccccc2)c1 ZINC000764960057 1053399619 /nfs/dbraw/zinc/39/96/19/1053399619.db2.gz CBYBRKQUXZKJQA-RTBURBONSA-N 2 0 340.515 4.035 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)cs1 ZINC000339072188 1053476167 /nfs/dbraw/zinc/47/61/67/1053476167.db2.gz UQOGSYJIWKPCHE-ZOCIIQOWSA-N 2 0 341.524 4.396 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccc(Sc3ccccn3)o2)CC1 ZINC000865764993 1053587345 /nfs/dbraw/zinc/58/73/45/1053587345.db2.gz HPZDMLXOVFKXNL-UHFFFAOYSA-N 2 0 345.512 4.178 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H](C)CCc2cncc3ccccc32)CC1 ZINC000866218600 1053654913 /nfs/dbraw/zinc/65/49/13/1053654913.db2.gz SRAIDHZLSGLRCT-QGZVFWFLSA-N 2 0 325.500 4.020 20 0 EIADRP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)CCc2cccnc2)c1 ZINC000866245829 1053663086 /nfs/dbraw/zinc/66/30/86/1053663086.db2.gz BZVOZIGAEMGIFF-GOSISDBHSA-N 2 0 325.500 4.033 20 0 EIADRP C[C@H](CCc1cccnc1)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000866310360 1053687274 /nfs/dbraw/zinc/68/72/74/1053687274.db2.gz NAODOGQYYCUJOP-KMFTYDHNSA-N 2 0 329.532 4.035 20 0 EIADRP C[C@H](CCc1cncc2ccccc21)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000866350505 1053700326 /nfs/dbraw/zinc/70/03/26/1053700326.db2.gz DAFOIOHFLBQDRM-MDMXATFFSA-N 2 0 337.511 4.162 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cc2c(ccnc2Cl)o1 ZINC000866393960 1053713761 /nfs/dbraw/zinc/71/37/61/1053713761.db2.gz UAAHLQZHVMMPSQ-ZDUSSCGKSA-N 2 0 347.890 4.254 20 0 EIADRP FC(F)(F)c1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000386455769 1053731235 /nfs/dbraw/zinc/73/12/35/1053731235.db2.gz RYUZVZIOURDVMB-GOSISDBHSA-N 2 0 348.412 4.317 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+][C@@H](c2ccccc2)c2ccccn2)CC1 ZINC000866467848 1053740000 /nfs/dbraw/zinc/74/00/00/1053740000.db2.gz RUTSIVSOIHKBIB-QFIPXVFZSA-N 2 0 337.511 4.271 20 0 EIADRP C[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1cc(-c2ccccc2)n(C)n1 ZINC000866516913 1053764757 /nfs/dbraw/zinc/76/47/57/1053764757.db2.gz DUSOLXXBYXNYIY-SRWJYRBRSA-N 2 0 340.515 4.001 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@H](c2ccccc2)c2ccc(F)cn2)CC1 ZINC000866516849 1053765611 /nfs/dbraw/zinc/76/56/11/1053765611.db2.gz DDWJUJRUCKELBR-VEDCXYSMSA-N 2 0 341.474 4.163 20 0 EIADRP COc1ccc(C)cc1C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386612536 1053802303 /nfs/dbraw/zinc/80/23/03/1053802303.db2.gz KQHGRCAASPCOBQ-QUCCMNQESA-N 2 0 338.495 4.004 20 0 EIADRP [NH3+]CC[C@@H]1CN(c2ccc(F)c(C[NH+]3CCCC3)c2)c2ccccc21 ZINC001168548397 1053804417 /nfs/dbraw/zinc/80/44/17/1053804417.db2.gz MPRDDIFYKMPONN-MRXNPFEDSA-N 2 0 339.458 4.006 20 0 EIADRP Cc1ccccc1OCCC[N@H+]1CCC[C@H]1CC[NH+]1CCC(C)CC1 ZINC001196936794 1053808922 /nfs/dbraw/zinc/80/89/22/1053808922.db2.gz URXHYNOHPVLKGT-NRFANRHFSA-N 2 0 344.543 4.350 20 0 EIADRP CCC(C)(C)CC[N@@H+]1CC[C@@H](Oc2ccnc(C[NH+](C)C(C)C)c2)C1 ZINC000856599656 1054091921 /nfs/dbraw/zinc/09/19/21/1054091921.db2.gz MPWIMWCBAVISCC-HXUWFJFHSA-N 2 0 347.547 4.201 20 0 EIADRP CC1CC[NH+](CCC[NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)CC1 ZINC001199014175 1054328153 /nfs/dbraw/zinc/32/81/53/1054328153.db2.gz RAQRDXSMIKWRLS-UHFFFAOYSA-N 2 0 330.516 4.002 20 0 EIADRP Fc1ccc(/C=C/C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(F)c1 ZINC001199045852 1054331840 /nfs/dbraw/zinc/33/18/40/1054331840.db2.gz WBKGIAMURBSLIE-ONEGZZNKSA-N 2 0 342.433 4.364 20 0 EIADRP CCCOc1cccc(C[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)c1 ZINC001199320039 1054390954 /nfs/dbraw/zinc/39/09/54/1054390954.db2.gz HAGSUXFCMGHING-RTBURBONSA-N 2 0 332.532 4.323 20 0 EIADRP C[N@H+](CCCCCC[NH3+])Cc1nc(-c2c(F)cccc2F)cs1 ZINC000872155565 1054412914 /nfs/dbraw/zinc/41/29/14/1054412914.db2.gz QEFHZCSVXNHWKA-UHFFFAOYSA-N 2 0 339.455 4.039 20 0 EIADRP CC[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CCO1 ZINC001199630291 1054435047 /nfs/dbraw/zinc/43/50/47/1054435047.db2.gz VKTKJEHVTOKXOB-RBBKRZOGSA-N 2 0 344.543 4.498 20 0 EIADRP Clc1cccc2c1OCC[C@H]2[NH2+]Cc1cc(-n2ccnc2)cs1 ZINC001199751182 1054461841 /nfs/dbraw/zinc/46/18/41/1054461841.db2.gz LXIVJFGVRGEWAI-MRXNPFEDSA-N 2 0 345.855 4.201 20 0 EIADRP COc1cc2ccccc2cc1C[NH2+]Cc1ccccc1-n1ccnc1 ZINC001199751298 1054462022 /nfs/dbraw/zinc/46/20/22/1054462022.db2.gz OCPHTIOTTSTABS-UHFFFAOYSA-N 2 0 343.430 4.324 20 0 EIADRP C[C@@H](C[NH2+]Cc1ccccc1OCC[NH+](C)C)CC1CCCCC1 ZINC001199822434 1054480020 /nfs/dbraw/zinc/48/00/20/1054480020.db2.gz GFKPNEKWVLJFIM-GOSISDBHSA-N 2 0 332.532 4.323 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CC[C@H](C)[C@@H](C)C3)CC2)cc1 ZINC001199883527 1054491307 /nfs/dbraw/zinc/49/13/07/1054491307.db2.gz JTHYCUMYQDIHCM-BBTUJRGHSA-N 2 0 344.543 4.322 20 0 EIADRP CCO[C@@H]1C[C@H]([NH2+]C2CCC([NH+]3CCCCC3)CC2)C12CCCC2 ZINC000776164444 1054781194 /nfs/dbraw/zinc/78/11/94/1054781194.db2.gz ZXKMJEVKOAKWNB-GHBBCFCZSA-N 2 0 334.548 4.111 20 0 EIADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(SC(F)F)cc1 ZINC000125464513 1054798606 /nfs/dbraw/zinc/79/86/06/1054798606.db2.gz XIWXPPVWWQLEET-CYBMUJFWSA-N 2 0 328.472 4.384 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2cccc(F)c2)C[N@@H+]1Cc1ccccc1 ZINC001201492556 1054818355 /nfs/dbraw/zinc/81/83/55/1054818355.db2.gz RJRIQKQDHLBWOC-XLIONFOSSA-N 2 0 326.459 4.216 20 0 EIADRP CC[C@H](C)C[NH+]1CCC(OC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001201517156 1054841022 /nfs/dbraw/zinc/84/10/22/1054841022.db2.gz MQZCEUZNCGJLIZ-IBGZPJMESA-N 2 0 344.543 4.178 20 0 EIADRP CCCC[C@@H](CC)C[NH+]1CCC2(CCC[N@@H+]2Cc2cnn(C)c2)CC1 ZINC001201559547 1054848752 /nfs/dbraw/zinc/84/87/52/1054848752.db2.gz LFXAUYRXHMMPPZ-LJQANCHMSA-N 2 0 346.563 4.067 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CCO[C@H](c2ccc(OC)cc2)C1 ZINC001168593008 1054947290 /nfs/dbraw/zinc/94/72/90/1054947290.db2.gz BPMFXOSESGFWAZ-CUWPLCDZSA-N 2 0 348.531 4.015 20 0 EIADRP Nc1c(Cl)cccc1C[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000876901402 1054981523 /nfs/dbraw/zinc/98/15/23/1054981523.db2.gz CTVRBQCJDPICJF-UHFFFAOYSA-N 2 0 343.902 4.198 20 0 EIADRP COc1ccc(C2(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)CCCCC2)cc1 ZINC000166311092 1055045294 /nfs/dbraw/zinc/04/52/94/1055045294.db2.gz IODYYAFGDVXJHP-VQTJNVASSA-N 2 0 342.527 4.114 20 0 EIADRP FC(F)(F)CCC[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001202444050 1055176394 /nfs/dbraw/zinc/17/63/94/1055176394.db2.gz COAPXRUNKSPPMH-ROUUACIJSA-N 2 0 340.433 4.173 20 0 EIADRP FC(F)n1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)c2ccccc21 ZINC000863547723 1055227889 /nfs/dbraw/zinc/22/78/89/1055227889.db2.gz RTPONCALGPQUEE-FGTMMUONSA-N 2 0 347.453 4.437 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000655805483 1055662233 /nfs/dbraw/zinc/66/22/33/1055662233.db2.gz OGTOPNYFPMCFJI-KPOBHBOGSA-N 2 0 346.877 4.498 20 0 EIADRP C[C@H](Cc1ccsc1)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000542776145 1055973500 /nfs/dbraw/zinc/97/35/00/1055973500.db2.gz VDNLQTFQORFZME-HLIPFELVSA-N 2 0 328.525 4.179 20 0 EIADRP C[C@H](Cc1ccsc1)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000542776146 1055974161 /nfs/dbraw/zinc/97/41/61/1055974161.db2.gz VDNLQTFQORFZME-MBOZVWFJSA-N 2 0 328.525 4.179 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)C2CCC(C(F)(F)F)CC2)C1 ZINC000474710957 1055997197 /nfs/dbraw/zinc/99/71/97/1055997197.db2.gz JZUPHWQZICZLLK-NJINODPHSA-N 2 0 334.470 4.454 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)C2CCC(C(F)(F)F)CC2)CC1 ZINC000474730739 1056014442 /nfs/dbraw/zinc/01/44/42/1056014442.db2.gz PUVLBDYMKKJOKX-OOHWJJMZSA-N 2 0 334.470 4.455 20 0 EIADRP Cc1n[nH]cc1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000180143884 1058380520 /nfs/dbraw/zinc/38/05/20/1058380520.db2.gz FXFACPCRCAEDRM-ULQDDVLXSA-N 2 0 340.515 4.047 20 0 EIADRP C[N@H+](Cc1cccc2cnccc21)C1CCN(Cc2ccccc2)CC1 ZINC000183264639 1059967852 /nfs/dbraw/zinc/96/78/52/1059967852.db2.gz FEFJMJSOKSOKML-UHFFFAOYSA-N 2 0 345.490 4.331 20 0 EIADRP Cc1nc(C)c([C@@H](C)[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)s1 ZINC000379737954 1060258587 /nfs/dbraw/zinc/25/85/87/1060258587.db2.gz CRMVDNLARQSITM-FOIQADDNSA-N 2 0 343.540 4.323 20 0 EIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]C[C@@H](C)CC(C)C)CC1 ZINC001168813921 1060416715 /nfs/dbraw/zinc/41/67/15/1060416715.db2.gz UEBDFBMEYNUMEX-ROUUACIJSA-N 2 0 349.538 4.300 20 0 EIADRP c1ccc2c(c1)CCSC[C@@H]2[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000766511248 1060427683 /nfs/dbraw/zinc/42/76/83/1060427683.db2.gz BXQGTXCFGINOOR-GRERDSQWSA-N 2 0 344.568 4.404 20 0 EIADRP CC(C)[PH+](CC[NH2+][C@H]1C[C@H](C)N(C(=O)OC(C)(C)C)C1)C(C)C ZINC001168840867 1060453143 /nfs/dbraw/zinc/45/31/43/1060453143.db2.gz WGEDFIZHXMPYHB-HOTGVXAUSA-N 2 0 344.480 4.273 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]C1CCC([NH+]3CCCCC3)CC1)CC2 ZINC000766513979 1060459890 /nfs/dbraw/zinc/45/98/90/1060459890.db2.gz UTXNFUOBSZFEJI-WIXQSORDSA-N 2 0 328.500 4.069 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]C1CCC([NH+]3CCCCC3)CC1)CC2 ZINC000766513975 1060462125 /nfs/dbraw/zinc/46/21/25/1060462125.db2.gz UTXNFUOBSZFEJI-NGICGMGXSA-N 2 0 328.500 4.069 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)cc1OC ZINC000766512029 1060483807 /nfs/dbraw/zinc/48/38/07/1060483807.db2.gz HYIZVDKKHSYCBZ-IVMQYODDSA-N 2 0 346.515 4.152 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1(c3cccc(Br)c3)CCC1)C2 ZINC001169099763 1060636374 /nfs/dbraw/zinc/63/63/74/1060636374.db2.gz VGTIXYAQLYVBTH-OSYLJGHBSA-N 2 0 349.316 4.043 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1CCCc3ccc(Br)cc31)C2 ZINC001169082347 1060641556 /nfs/dbraw/zinc/64/15/56/1060641556.db2.gz YRWLNMBMBHGLDI-KYHPRHEASA-N 2 0 349.316 4.041 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@H]1CCCc3ccc(Br)cc31)C2 ZINC001169082341 1060642318 /nfs/dbraw/zinc/64/23/18/1060642318.db2.gz YRWLNMBMBHGLDI-CUSZFKRNSA-N 2 0 349.316 4.041 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC(CCCc3ccccc3)CC1)C2 ZINC001169126746 1060651870 /nfs/dbraw/zinc/65/18/70/1060651870.db2.gz XEPJKAOEGWTFOW-ZBYYUNFXSA-N 2 0 326.528 4.347 20 0 EIADRP C[C@@H](c1cccc(Br)c1)[N@H+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169162478 1060672915 /nfs/dbraw/zinc/67/29/15/1060672915.db2.gz TZKBJVHQKJIXTQ-SJWGOKEGSA-N 2 0 337.305 4.067 20 0 EIADRP CCN1CCC([NH2+][C@@H]2CC[C@H](C[C@@H]3CC[C@H]([NH3+])[C@@H](C)C3)C[C@@H]2C)CC1 ZINC001169233950 1060704859 /nfs/dbraw/zinc/70/48/59/1060704859.db2.gz YRCMSQTYZSKORT-CQXMTJGFSA-N 2 0 349.607 4.019 20 0 EIADRP C[C@H]1C[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)CCC[C@@H]1C[NH3+] ZINC001206013212 1060862682 /nfs/dbraw/zinc/86/26/82/1060862682.db2.gz QIVIPSVBQFYZPO-WDEREUQCSA-N 2 0 335.706 4.454 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)c(C)o1 ZINC000767363774 1061212244 /nfs/dbraw/zinc/21/22/44/1061212244.db2.gz WYKIAYUJHDXIEN-MRXNPFEDSA-N 2 0 326.484 4.418 20 0 EIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000298246606 519781543 /nfs/dbraw/zinc/78/15/43/519781543.db2.gz CZDIKVSLOYNNEH-QGZVFWFLSA-N 2 0 339.483 4.188 20 0 EIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]CCc1c[nH]c2ccccc12 ZINC000532188303 1032076994 /nfs/dbraw/zinc/07/69/94/1032076994.db2.gz CTDPQNUXXFUXKW-XMSQKQJNSA-N 2 0 347.506 4.211 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2c(F)cccc2F)CCCC1 ZINC000532219073 1032096742 /nfs/dbraw/zinc/09/67/42/1032096742.db2.gz KVGJJKXGTVTGDY-RKVPGOIHSA-N 2 0 336.470 4.095 20 0 EIADRP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)cc1 ZINC000532225970 1032104463 /nfs/dbraw/zinc/10/44/63/1032104463.db2.gz GIPOACTXIFXJGR-PZJWPPBQSA-N 2 0 344.543 4.284 20 0 EIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000532226267 1032105255 /nfs/dbraw/zinc/10/52/55/1032105255.db2.gz RQZGUQQWKHFPKP-RTBURBONSA-N 2 0 328.525 4.272 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)C1CCOCC1 ZINC000532228395 1032105881 /nfs/dbraw/zinc/10/58/81/1032105881.db2.gz QYNXWTAKCHUTRQ-QFIPXVFZSA-N 2 0 344.543 4.357 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc3c(c2)CC(C)(C)O3)C1 ZINC000729678960 1032128673 /nfs/dbraw/zinc/12/86/73/1032128673.db2.gz YIUYZORGKRSIDT-KRWDZBQOSA-N 2 0 330.516 4.002 20 0 EIADRP [NH3+]CC1CCC([NH2+]C2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CC1 ZINC000643458621 1032268200 /nfs/dbraw/zinc/26/82/00/1032268200.db2.gz OWMGCEUMKKWXTC-BFUDSRACSA-N 2 0 346.359 4.003 20 0 EIADRP CC(C)Oc1ccc2[nH+]ccc(N3CCC([NH+]4CCCC4)CC3)c2c1 ZINC000450259157 1032375766 /nfs/dbraw/zinc/37/57/66/1032375766.db2.gz DWETXRYXEHNEBT-UHFFFAOYSA-N 2 0 339.483 4.087 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)cc1 ZINC000120743180 1032412701 /nfs/dbraw/zinc/41/27/01/1032412701.db2.gz NETRYIDIIARNPJ-RBBKRZOGSA-N 2 0 338.495 4.006 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)CCCO2 ZINC000120915886 1032475925 /nfs/dbraw/zinc/47/59/25/1032475925.db2.gz PLKYMAGOKJRZJQ-HXUWFJFHSA-N 2 0 342.458 4.199 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1cc(Cl)c(N)c(Cl)c1 ZINC000760166305 1032511085 /nfs/dbraw/zinc/51/10/85/1032511085.db2.gz DKPOGMRHOMNDOC-CYZMBNFOSA-N 2 0 330.303 4.099 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000579726809 1018827570 /nfs/dbraw/zinc/82/75/70/1018827570.db2.gz WKMAUYIJQFCDTL-MSOLQXFVSA-N 2 0 340.433 4.273 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CS1 ZINC000683108323 1018835236 /nfs/dbraw/zinc/83/52/36/1018835236.db2.gz BPQXJIZNJGCTKU-UFYCRDLUSA-N 2 0 332.557 4.018 20 0 EIADRP Cc1cccc([C@@H](N[C@H]2CC[NH2+]C3(CCC3)C2)c2cccc(F)c2)c1 ZINC000643547867 1018930863 /nfs/dbraw/zinc/93/08/63/1018930863.db2.gz KAQYGXRDKYOTQC-LEWJYISDSA-N 2 0 338.470 4.488 20 0 EIADRP CCOc1cc(CN2CCC[C@H]([NH+](C)C)CC2)ccc1OCC(C)C ZINC000432793221 1032812834 /nfs/dbraw/zinc/81/28/34/1032812834.db2.gz NQZLYHDOOJPNTF-IBGZPJMESA-N 2 0 348.531 4.036 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(OC)ccc2Cl)CC1 ZINC001167077736 1019568757 /nfs/dbraw/zinc/56/87/57/1019568757.db2.gz MZHXIBLRXBZXLP-UHFFFAOYSA-N 2 0 338.923 4.293 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)Cc2cccc(OC(F)(F)F)c2)CC1 ZINC001204432850 1019838412 /nfs/dbraw/zinc/83/84/12/1019838412.db2.gz SDUZXLSXUJPNTP-UHFFFAOYSA-N 2 0 344.421 4.137 20 0 EIADRP COc1ccc2oc([C@H](C)[NH2+][C@@H](C)C3CC[NH+](C)CC3)c(C)c2c1 ZINC000153666209 1020363264 /nfs/dbraw/zinc/36/32/64/1020363264.db2.gz XFKXPXQTLQMDHJ-GJZGRUSLSA-N 2 0 330.472 4.131 20 0 EIADRP CC[C@H](CC(F)(F)F)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547830239 1020775715 /nfs/dbraw/zinc/77/57/15/1020775715.db2.gz KLSCIUISJUWKSL-HYVNUMGLSA-N 2 0 328.422 4.218 20 0 EIADRP CCC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cccc(C(F)(F)F)c1 ZINC000655804899 1020972628 /nfs/dbraw/zinc/97/26/28/1020972628.db2.gz FKRNBCHPDBWXSJ-XOKHGSTOSA-N 2 0 328.422 4.476 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1 ZINC000655806416 1020975643 /nfs/dbraw/zinc/97/56/43/1020975643.db2.gz UWSXTAFRXUYSED-HLIPFELVSA-N 2 0 338.495 4.353 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCCOc3c(Cl)c(Cl)ccc32)C1 ZINC000655806056 1020975845 /nfs/dbraw/zinc/97/58/45/1020975845.db2.gz YLAGGCQEYLRJNB-ZOWXZIJZSA-N 2 0 343.298 4.137 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@H]2CCCc3ccc(O)cc32)C1 ZINC000340471531 1021079774 /nfs/dbraw/zinc/07/97/74/1021079774.db2.gz XWTNGHHCUSWIKV-LZJOCLMNSA-N 2 0 330.516 4.117 20 0 EIADRP CC(C)=CCOc1ccc(CC[C@@H](C)[NH2+]CC2CC[NH+](C)CC2)cc1 ZINC000468443866 1021217047 /nfs/dbraw/zinc/21/70/47/1021217047.db2.gz HDBSWRLPIRLBTK-LJQANCHMSA-N 2 0 344.543 4.284 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(OC)cc2C)c1 ZINC000414083595 1021822325 /nfs/dbraw/zinc/82/23/25/1021822325.db2.gz WIZMHSLHFNHTTI-QGZVFWFLSA-N 2 0 326.484 4.306 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2c(c1)CCC2 ZINC000398017869 1021898280 /nfs/dbraw/zinc/89/82/80/1021898280.db2.gz IIXQUYISKOXQAP-FDDCHVKYSA-N 2 0 334.507 4.176 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2ccc(F)cc2C(F)(F)F)CC1 ZINC000511495695 1021899288 /nfs/dbraw/zinc/89/92/88/1021899288.db2.gz OSCQDZXFDFDFOA-UHFFFAOYSA-N 2 0 332.385 4.008 20 0 EIADRP C[C@@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)c1nc(-c2ccccc2)cs1 ZINC000089553668 1021929515 /nfs/dbraw/zinc/92/95/15/1021929515.db2.gz KRQVOGNXGQSGER-HUUCEWRRSA-N 2 0 329.513 4.191 20 0 EIADRP COc1ccccc1[C@@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)c1ccccc1 ZINC000089554974 1021933526 /nfs/dbraw/zinc/93/35/26/1021933526.db2.gz LDWRYKZKUPTYLC-VGSWGCGISA-N 2 0 338.495 4.105 20 0 EIADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@H](c2cc3ccccc3o2)c2cccnc2)C1 ZINC000414170380 1022020319 /nfs/dbraw/zinc/02/03/19/1022020319.db2.gz BYYWSLMPMFOGJZ-JTSKRJEESA-N 2 0 349.478 4.239 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cccc(C)c1 ZINC000580453511 1022039426 /nfs/dbraw/zinc/03/94/26/1022039426.db2.gz AXTKGGCYSVYMLK-FQEVSTJZSA-N 2 0 326.484 4.176 20 0 EIADRP COc1ccc([C@H]([NH2+]CC[C@H]2CCC[N@H+](C)C2)c2ccccc2)cc1 ZINC000414199435 1022106236 /nfs/dbraw/zinc/10/62/36/1022106236.db2.gz XAUHQFMPDFKMPA-XMSQKQJNSA-N 2 0 338.495 4.106 20 0 EIADRP CSC1(C[NH2+][C@@H](c2ccc(C)cc2)C2CCC2)CC[NH+](C)CC1 ZINC000580605711 1022301811 /nfs/dbraw/zinc/30/18/11/1022301811.db2.gz LOPQBDDVWNLZGN-LJQANCHMSA-N 2 0 332.557 4.253 20 0 EIADRP FC(F)(F)c1ccccc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000047971044 1022303933 /nfs/dbraw/zinc/30/39/33/1022303933.db2.gz AZFFNOHXTAOBPI-UHFFFAOYSA-N 2 0 326.406 4.013 20 0 EIADRP C[C@@H](C[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)CC(F)(F)F ZINC000414264528 1022341673 /nfs/dbraw/zinc/34/16/73/1022341673.db2.gz KOEMPTAFJPUMJV-CVEARBPZSA-N 2 0 342.449 4.260 20 0 EIADRP C[C@H](Cc1cn(C)c2ccc(F)cc12)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000414342754 1022649197 /nfs/dbraw/zinc/64/91/97/1022649197.db2.gz JHEBEAMWJMRPGG-OAHLLOKOSA-N 2 0 345.506 4.101 20 0 EIADRP C[C@]1(C[NH2+]Cc2cccc3[nH]ccc32)CC[N@H+](Cc2ccccc2)C1 ZINC000310940637 1022676572 /nfs/dbraw/zinc/67/65/72/1022676572.db2.gz WAPMIJIMYZVXIW-JOCHJYFZSA-N 2 0 333.479 4.170 20 0 EIADRP c1csc(-c2ncc(C[N@@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)s2)c1 ZINC000647544100 1022796889 /nfs/dbraw/zinc/79/68/89/1022796889.db2.gz WTOIPUGDAVEINL-LSDHHAIUSA-N 2 0 347.553 4.083 20 0 EIADRP Clc1ccc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c2ncccc12 ZINC000647543836 1022797894 /nfs/dbraw/zinc/79/78/94/1022797894.db2.gz SRFKPSBBSHAPRI-JKSUJKDBSA-N 2 0 343.902 4.100 20 0 EIADRP C[C@@H]([NH2+]CCc1c(F)cccc1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000402101121 1022801348 /nfs/dbraw/zinc/80/13/48/1022801348.db2.gz VGCRZWLMUXDAJU-SJLPKXTDSA-N 2 0 344.449 4.008 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CN(C)Cc3ccccc32)cc1 ZINC000378407580 1022805994 /nfs/dbraw/zinc/80/59/94/1022805994.db2.gz YAGSJCRJZJWUMT-OPAMFIHVSA-N 2 0 346.478 4.018 20 0 EIADRP Cc1nc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@H]4CCC[C@@H]43)cc2)cs1 ZINC000581326323 1023025080 /nfs/dbraw/zinc/02/50/80/1023025080.db2.gz TWKUHOPVVGUNGE-GGPKGHCWSA-N 2 0 341.524 4.081 20 0 EIADRP CN1CC[C@H]([NH2+][C@@H]2CCCN(c3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000584581445 1023037631 /nfs/dbraw/zinc/03/76/31/1023037631.db2.gz VNRAMWUDGAKDEF-QZNHQXDQSA-N 2 0 349.522 4.081 20 0 EIADRP CC(C)(C)Oc1ccc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000656493594 1023048573 /nfs/dbraw/zinc/04/85/73/1023048573.db2.gz HLOCGWNYRDELRU-UHFFFAOYSA-N 2 0 339.483 4.018 20 0 EIADRP Cn1ccnc1C[C@@H]([NH2+]C1CC(C)(c2ccccc2)C1)c1ccccc1 ZINC000656503611 1023074056 /nfs/dbraw/zinc/07/40/56/1023074056.db2.gz QKSVEFGFTANNQN-WQMHRJNTSA-N 2 0 345.490 4.414 20 0 EIADRP CCC[C@@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000473307877 1033105716 /nfs/dbraw/zinc/10/57/16/1033105716.db2.gz DVVWSWSNVBESKL-YLJYHZDGSA-N 2 0 345.531 4.024 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2ccc(CSC(F)F)o2)c1 ZINC000069673848 1023109293 /nfs/dbraw/zinc/10/92/93/1023109293.db2.gz OEAOHWXNNVWULH-UHFFFAOYSA-N 2 0 340.439 4.087 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1cncc(F)c1 ZINC000156191641 1023137904 /nfs/dbraw/zinc/13/79/04/1023137904.db2.gz ILVWQLCTZKDODH-SJORKVTESA-N 2 0 341.474 4.446 20 0 EIADRP Cc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1F ZINC000310140053 1023142447 /nfs/dbraw/zinc/14/24/47/1023142447.db2.gz CBUNRBMGOOIFPI-FQEVSTJZSA-N 2 0 326.459 4.136 20 0 EIADRP CCC[C@@H](CCO)C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449169804 1023173288 /nfs/dbraw/zinc/17/32/88/1023173288.db2.gz DWXJBEFUYQONMI-KRWDZBQOSA-N 2 0 326.569 4.054 20 0 EIADRP c1ccc(C[N@H+]2CC[C@@H](C[NH2+][C@@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000376672598 1023254642 /nfs/dbraw/zinc/25/46/42/1023254642.db2.gz OJELGPNBPZUIOD-SIKLNZKXSA-N 2 0 335.495 4.035 20 0 EIADRP Fc1cc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)ccc1C(F)F ZINC000893301436 1023261728 /nfs/dbraw/zinc/26/17/28/1023261728.db2.gz CKMUQBKFBLZETG-UHFFFAOYSA-N 2 0 349.400 4.165 20 0 EIADRP c1cc(C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)nc2c1CCC2 ZINC000584765167 1023296575 /nfs/dbraw/zinc/29/65/75/1023296575.db2.gz NDQZBFKWEVLOFS-UHFFFAOYSA-N 2 0 349.522 4.236 20 0 EIADRP C[C@H]([NH2+]CCc1nsc2ccccc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000660255324 1023389494 /nfs/dbraw/zinc/38/94/94/1023389494.db2.gz BAHHSGGXZQOSBJ-JKSUJKDBSA-N 2 0 343.540 4.081 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cc(C(F)(F)F)ccc1F)c1ccccc1 ZINC000415046652 1023408019 /nfs/dbraw/zinc/40/80/19/1023408019.db2.gz CYWNWLYAMSGPAQ-QGZVFWFLSA-N 2 0 340.364 4.414 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000415075437 1023421129 /nfs/dbraw/zinc/42/11/29/1023421129.db2.gz FKNRKXONWKKBJQ-HLLBOEOZSA-N 2 0 343.540 4.466 20 0 EIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC(OC(C)(C)C)CC1 ZINC000511640086 1023432207 /nfs/dbraw/zinc/43/22/07/1023432207.db2.gz KFASSULSZHDLNW-UHFFFAOYSA-N 2 0 346.559 4.424 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000415086561 1023434741 /nfs/dbraw/zinc/43/47/41/1023434741.db2.gz UTFYGRVNUUIHTN-YOEHRIQHSA-N 2 0 329.513 4.220 20 0 EIADRP CN1CC[C@H]([NH2+]CC(C)(C)Oc2ccccc2)C[C@H]1c1ccccc1 ZINC000581621799 1023440351 /nfs/dbraw/zinc/44/03/51/1023440351.db2.gz HGAOZWZIEBGCFV-FPOVZHCZSA-N 2 0 338.495 4.269 20 0 EIADRP C[C@H](C[NH2+][C@H]1CCN[C@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000415121015 1023452259 /nfs/dbraw/zinc/45/22/59/1023452259.db2.gz YSKPEYXAAKBRNR-LIVBEALHSA-N 2 0 330.422 4.151 20 0 EIADRP c1ccc(C[NH+]2CCCCCC2)c(C[NH2+]Cc2cccc3c2NCC3)c1 ZINC000415124148 1023453039 /nfs/dbraw/zinc/45/30/39/1023453039.db2.gz QNLKLXHRPYUFDL-UHFFFAOYSA-N 2 0 349.522 4.320 20 0 EIADRP C[C@H](C[N@H+](C)CC1CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000500065110 1023479087 /nfs/dbraw/zinc/47/90/87/1023479087.db2.gz AVRPXSZPKJFLEA-CQSZACIVSA-N 2 0 328.422 4.083 20 0 EIADRP C[C@H]1CC([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C[C@H](C)C1 ZINC000341273660 1023494605 /nfs/dbraw/zinc/49/46/05/1023494605.db2.gz QHADYNZPLAPNIH-IAGOWNOFSA-N 2 0 330.516 4.074 20 0 EIADRP Cc1ccc(OC2CC[NH+](CC[C@@H]3CCCC[N@H+]3C)CC2)cc1C ZINC000472752452 1023502095 /nfs/dbraw/zinc/50/20/95/1023502095.db2.gz PRBCORPVTCIALI-IBGZPJMESA-N 2 0 330.516 4.021 20 0 EIADRP c1nc(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)sc1-c1ccccc1 ZINC000656786161 1023527451 /nfs/dbraw/zinc/52/74/51/1023527451.db2.gz LJSJOVQSZUQFHQ-SFHVURJKSA-N 2 0 341.524 4.022 20 0 EIADRP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)C1 ZINC000684369838 1023540832 /nfs/dbraw/zinc/54/08/32/1023540832.db2.gz BYKOLPKQRJCXQU-DUXKGJEZSA-N 2 0 330.516 4.108 20 0 EIADRP CO[C@H]1CCC[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)C1 ZINC000684374288 1023566237 /nfs/dbraw/zinc/56/62/37/1023566237.db2.gz NLOFBTMYSMEBLK-RTWAWAEBSA-N 2 0 330.516 4.110 20 0 EIADRP Cc1ccc(-c2nc(C[NH+]3CCC([C@H]4CCC[NH2+]4)CC3)cs2)cc1 ZINC000261753504 1023617737 /nfs/dbraw/zinc/61/77/37/1023617737.db2.gz UZKLIBPNNNURDP-LJQANCHMSA-N 2 0 341.524 4.083 20 0 EIADRP Cc1n[nH]cc1C1CC[NH+]([C@@H](C)c2ccc(-n3ccnc3C)cc2)CC1 ZINC000377632568 1023648248 /nfs/dbraw/zinc/64/82/48/1023648248.db2.gz SYRAFZGIQXJMSZ-INIZCTEOSA-N 2 0 349.482 4.153 20 0 EIADRP CC[C@@H](Cc1cccs1)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000684410401 1023661435 /nfs/dbraw/zinc/66/14/35/1023661435.db2.gz XPGGXCXUAWJJDX-MOPGFXCFSA-N 2 0 328.525 4.181 20 0 EIADRP Cc1cc(F)ccc1-c1ccc(CN[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)o1 ZINC000377750835 1023742078 /nfs/dbraw/zinc/74/20/78/1023742078.db2.gz WTCJWEDELPJKBG-IAGOWNOFSA-N 2 0 328.431 4.111 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+]C2CCC(F)(F)CC2)C[N@@H+]1Cc1ccccc1 ZINC000647196190 1023851018 /nfs/dbraw/zinc/85/10/18/1023851018.db2.gz RSAXFDRKKHQWMB-SJLPKXTDSA-N 2 0 336.470 4.455 20 0 EIADRP Cc1nc(-c2ccc([C@@H](C)[NH2+]CC[C@H]3CCC[N@@H+]3C)cc2)cs1 ZINC000341588624 1023895426 /nfs/dbraw/zinc/89/54/26/1023895426.db2.gz BXJBIMBPUBSSLY-RDTXWAMCSA-N 2 0 329.513 4.253 20 0 EIADRP CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cccc(Br)c1 ZINC000130225672 1023932164 /nfs/dbraw/zinc/93/21/64/1023932164.db2.gz YTXFOVKGNLZJLO-BBWFWOEESA-N 2 0 337.305 4.117 20 0 EIADRP COc1ccc([C@@H](C)C[NH+]2CCC([NH2+]Cc3ccccc3)CC2)cc1 ZINC000660679839 1024014493 /nfs/dbraw/zinc/01/44/93/1024014493.db2.gz PPRRGOJNSFNCEN-SFHVURJKSA-N 2 0 338.495 4.053 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]Cc2cc(-c3ccc(OC)cc3)cs2)[C@@H](C)C1 ZINC000468875893 1024090513 /nfs/dbraw/zinc/09/05/13/1024090513.db2.gz FVRLAIMYTCSMFV-YWZLYKJASA-N 2 0 344.524 4.244 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CCN2CCCC[C@H]12 ZINC000510683425 1024229769 /nfs/dbraw/zinc/22/97/69/1024229769.db2.gz FVYSFJYSYGNDND-FHLIZLRMSA-N 2 0 340.433 4.243 20 0 EIADRP Cc1cc(OCCC[C@@H](C)[NH2+]CC2CC[NH+](C)CC2)ccc1Cl ZINC000510747013 1024389684 /nfs/dbraw/zinc/38/96/84/1024389684.db2.gz GBUOFABSLQHCCB-MRXNPFEDSA-N 2 0 338.923 4.127 20 0 EIADRP CC(C)c1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000090525179 1024424509 /nfs/dbraw/zinc/42/45/09/1024424509.db2.gz CHTSLWUHFDLEHC-WTOYTKOKSA-N 2 0 344.543 4.229 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ccc(Br)cn1 ZINC000684549453 1024526944 /nfs/dbraw/zinc/52/69/44/1024526944.db2.gz ORYWBSRUJWMIRG-ZIAGYGMSSA-N 2 0 342.325 4.005 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](CNCc2ccc(Sc3ccccn3)o2)C1 ZINC000510874854 1024698513 /nfs/dbraw/zinc/69/85/13/1024698513.db2.gz QQQHDUPPFYFYPX-INIZCTEOSA-N 2 0 345.512 4.036 20 0 EIADRP CCc1cnccc1[C@H](C)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548481310 1024825595 /nfs/dbraw/zinc/82/55/95/1024825595.db2.gz MWFKQSDJOWAXQU-LVCYWYKZSA-N 2 0 337.511 4.205 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cccn2CCC(C)C)c1 ZINC000236879791 1024837014 /nfs/dbraw/zinc/83/70/14/1024837014.db2.gz YQJALTQLTZWKSQ-UHFFFAOYSA-N 2 0 327.516 4.276 20 0 EIADRP C[C@H](c1ccc(OC(F)F)cc1)[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000662294955 1025044515 /nfs/dbraw/zinc/04/45/15/1025044515.db2.gz XKNDRCZHXSRYSK-PBHICJAKSA-N 2 0 338.442 4.061 20 0 EIADRP C[C@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662295634 1025045956 /nfs/dbraw/zinc/04/59/56/1025045956.db2.gz VYYDMTBTTWHOLV-VQIMIIECSA-N 2 0 339.483 4.114 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2csc(Cc3ccccc3)n2)[C@@H]1CCC[NH3+] ZINC000662311692 1025062730 /nfs/dbraw/zinc/06/27/30/1025062730.db2.gz CYGDAGYFFWUZPX-VQIMIIECSA-N 2 0 343.540 4.073 20 0 EIADRP C[C@@H](c1nc2ccccc2o1)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000181188323 1025121625 /nfs/dbraw/zinc/12/16/25/1025121625.db2.gz BOJAGAPLYNNUAI-KRWDZBQOSA-N 2 0 341.499 4.477 20 0 EIADRP COCCC[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc(F)cc1 ZINC000663465248 1025387930 /nfs/dbraw/zinc/38/79/30/1025387930.db2.gz IUTILJYPQAACOD-NQIIRXRSSA-N 2 0 348.506 4.005 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc1Cl ZINC000663467354 1025399359 /nfs/dbraw/zinc/39/93/59/1025399359.db2.gz DZNBDXODMCLFLT-GDBMZVCRSA-N 2 0 336.907 4.121 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc(OC(F)F)cc1 ZINC000663467566 1025408596 /nfs/dbraw/zinc/40/85/96/1025408596.db2.gz GTHWSIXCHJANJD-GDBMZVCRSA-N 2 0 338.442 4.061 20 0 EIADRP C[C@H]1C[C@H](CC[NH2+]Cc2ncc(Cl)s2)C[N@@H+]1Cc1ccccc1 ZINC000472037151 1025460296 /nfs/dbraw/zinc/46/02/96/1025460296.db2.gz HQRSXQKRRPEMEJ-HOCLYGCPSA-N 2 0 349.931 4.187 20 0 EIADRP CCN1CCC[C@@H]1C[NH2+][C@@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000546164907 1025581566 /nfs/dbraw/zinc/58/15/66/1025581566.db2.gz VRAPUAJVFKFDFX-UXHICEINSA-N 2 0 343.902 4.093 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)Cc1ccc(Br)cc1 ZINC001167826188 1025618520 /nfs/dbraw/zinc/61/85/20/1025618520.db2.gz OLHITYHCIJGRBZ-OAHLLOKOSA-N 2 0 341.337 4.391 20 0 EIADRP CC(C)(C)C[C@H]([NH2+]C[C@H]1C[NH2+]CCC1(F)F)c1ccc(F)cc1 ZINC000925783893 1025634642 /nfs/dbraw/zinc/63/46/42/1025634642.db2.gz PDAIYRSDIKYCTE-ZBFHGGJFSA-N 2 0 328.422 4.137 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(OC(C)(C)C)cc2)CC1 ZINC000156899291 1025722103 /nfs/dbraw/zinc/72/21/03/1025722103.db2.gz LLVBLDOIXNHRTQ-QGZVFWFLSA-N 2 0 348.531 4.015 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)CC1 ZINC000333775836 1025842438 /nfs/dbraw/zinc/84/24/38/1025842438.db2.gz CWUNLHYJFMYEOT-GPANFISMSA-N 2 0 327.497 4.047 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@@H]1c1ccc(C(=O)OC)cc1 ZINC001167836395 1025846512 /nfs/dbraw/zinc/84/65/12/1025846512.db2.gz ZHBCKCYUTFODNU-FXAWDEMLSA-N 2 0 346.515 4.121 20 0 EIADRP Cc1cccc([C@@H](NCc2ncc(CN(C)C)s2)C(C)(C)C)c1 ZINC000512050889 1025847161 /nfs/dbraw/zinc/84/71/61/1025847161.db2.gz FJNYJVCJQKLGIH-GOSISDBHSA-N 2 0 331.529 4.390 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCO[C@@](C)(c2ccc(C)cc2)C1 ZINC001167837436 1025848475 /nfs/dbraw/zinc/84/84/75/1025848475.db2.gz KBKWXNQPJWVJCD-TZIWHRDSSA-N 2 0 332.532 4.053 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(C(C)=O)(c2ccccc2)CC1 ZINC001167838333 1025850262 /nfs/dbraw/zinc/85/02/62/1025850262.db2.gz TVRUEDBDNSHIIK-IBGZPJMESA-N 2 0 344.543 4.120 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCc2nccn2C1)c1ccc(SC(F)F)cc1 ZINC000278943185 1025855454 /nfs/dbraw/zinc/85/54/54/1025855454.db2.gz KJZVIACXTKNKGS-QWHCGFSZSA-N 2 0 337.439 4.111 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cc(Cl)cc2cccnc21)c1ccccc1 ZINC000415049903 1025857915 /nfs/dbraw/zinc/85/79/15/1025857915.db2.gz HWCMGJCTTHEOJE-LJQANCHMSA-N 2 0 339.870 4.458 20 0 EIADRP CCC[C@H]([NH2+][C@H]1CC[N@H+](CCCOCC)C[C@@H]1C)c1ccsc1 ZINC000187722541 1025887617 /nfs/dbraw/zinc/88/76/17/1025887617.db2.gz LOPPMPMVMMUCGZ-WDSOQIARSA-N 2 0 338.561 4.316 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](Cc1cc(C)no1)Cc1ccccc1 ZINC001167841999 1025892752 /nfs/dbraw/zinc/89/27/52/1025892752.db2.gz VNSWKQRDVBZVTP-LJQANCHMSA-N 2 0 343.515 4.496 20 0 EIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)CCCO1 ZINC000432433114 1025968268 /nfs/dbraw/zinc/96/82/68/1025968268.db2.gz ZORANQBABCGQMQ-DYESRHJHSA-N 2 0 348.506 4.148 20 0 EIADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)c1ccc(Oc2cccnc2)cc1 ZINC000344090900 1025997328 /nfs/dbraw/zinc/99/73/28/1025997328.db2.gz JPIJOTDWBMGIDZ-SJLPKXTDSA-N 2 0 325.456 4.009 20 0 EIADRP CC(C)(C)Oc1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167973137 1026152216 /nfs/dbraw/zinc/15/22/16/1026152216.db2.gz HNDLJNHEUVRFRL-IHWFROFDSA-N 2 0 342.527 4.359 20 0 EIADRP Cc1cccc2[nH]c(C[NH2+]C3CC[NH+](CC4CCCC4)CC3)cc21 ZINC000657336129 1026154509 /nfs/dbraw/zinc/15/45/09/1026154509.db2.gz MHGPSEYZQSOMEL-UHFFFAOYSA-N 2 0 325.500 4.221 20 0 EIADRP C[C@H]1Cc2ccccc2[C@H]1[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000111410892 1026161199 /nfs/dbraw/zinc/16/11/99/1026161199.db2.gz NFMPXXPDUHIVOB-JTSKRJEESA-N 2 0 338.495 4.040 20 0 EIADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000111410890 1026161839 /nfs/dbraw/zinc/16/18/39/1026161839.db2.gz NFMPXXPDUHIVOB-VGSWGCGISA-N 2 0 338.495 4.040 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCCc3c(Cl)sc(Cl)c32)CC1 ZINC000344306301 1026237450 /nfs/dbraw/zinc/23/74/50/1026237450.db2.gz WHYZKULLOBYBJN-GFCCVEGCSA-N 2 0 331.312 4.284 20 0 EIADRP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccc(F)c(F)c1 ZINC001167979151 1026344032 /nfs/dbraw/zinc/34/40/32/1026344032.db2.gz WZSVAZNJHJBWKV-KVMCETHSSA-N 2 0 334.454 4.411 20 0 EIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000279499977 1026460848 /nfs/dbraw/zinc/46/08/48/1026460848.db2.gz MNBSVWZKAPDWHM-NEOGFGCTSA-N 2 0 330.516 4.005 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](C/C=C/c2ccccc2OC)CC1 ZINC000506867955 1026476606 /nfs/dbraw/zinc/47/66/06/1026476606.db2.gz PMOYYSUDJWOAFV-CSKARUKUSA-N 2 0 330.516 4.152 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CCCCC[NH+]2CCCC2)ccc1SC ZINC000559891051 1026495412 /nfs/dbraw/zinc/49/54/12/1026495412.db2.gz MJGGTTDJPYQMAN-MRXNPFEDSA-N 2 0 336.545 4.334 20 0 EIADRP COCc1cc([C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)ccc1OC ZINC000158192791 1026557129 /nfs/dbraw/zinc/55/71/29/1026557129.db2.gz ZLAQEOHPSXYPEH-GOSISDBHSA-N 2 0 348.531 4.004 20 0 EIADRP CC(C)n1cc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cn1 ZINC000112383554 1026665419 /nfs/dbraw/zinc/66/54/19/1026665419.db2.gz VRGVKPDSEUOAPW-GOSISDBHSA-N 2 0 340.515 4.301 20 0 EIADRP CCOc1ccccc1[C@H](C)N[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512330905 1026709821 /nfs/dbraw/zinc/70/98/21/1026709821.db2.gz VVLQVQPPLDAPRY-FGTMMUONSA-N 2 0 330.516 4.389 20 0 EIADRP Cc1ccccc1C[N@H+](Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2 ZINC000432673079 1026709980 /nfs/dbraw/zinc/70/99/80/1026709980.db2.gz VRSVDMOTHNCYRX-IBGZPJMESA-N 2 0 326.509 4.201 20 0 EIADRP CCOc1ccccc1[C@H](C)N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512330906 1026710272 /nfs/dbraw/zinc/71/02/72/1026710272.db2.gz VVLQVQPPLDAPRY-OKZBNKHCSA-N 2 0 330.516 4.389 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@]1(C)Cc1ccccc1 ZINC000344938372 1026713922 /nfs/dbraw/zinc/71/39/22/1026713922.db2.gz UFVHNTWIVIBYLZ-QFIPXVFZSA-N 2 0 346.478 4.173 20 0 EIADRP C[C@@H](NC1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512333834 1026725225 /nfs/dbraw/zinc/72/52/25/1026725225.db2.gz XOSKDQZJOVRKRN-RTBURBONSA-N 2 0 347.591 4.026 20 0 EIADRP Cc1ccc2cc(C[NH2+]C[C@H]3CC[N@H+](Cc4ccccc4)C3)[nH]c2c1 ZINC000657452859 1026770395 /nfs/dbraw/zinc/77/03/95/1026770395.db2.gz LPDQIEBPXQPAID-LJQANCHMSA-N 2 0 333.479 4.088 20 0 EIADRP CC[NH+]1CCN(c2ccccc2C[N@H+](C)[C@@H](C)c2cccs2)CC1 ZINC000507440094 1026795740 /nfs/dbraw/zinc/79/57/40/1026795740.db2.gz HEBNQILQBPJIHC-KRWDZBQOSA-N 2 0 343.540 4.083 20 0 EIADRP COc1ccc([C@H]2CCCC[C@H]2[NH2+]CC2(C)CC[NH+](C)CC2)cc1F ZINC000507446441 1026796362 /nfs/dbraw/zinc/79/63/62/1026796362.db2.gz UFOVWFZMYBATAM-IEBWSBKVSA-N 2 0 348.506 4.182 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000507449546 1026797798 /nfs/dbraw/zinc/79/77/98/1026797798.db2.gz NRDGYWXBDMBJPL-HNNXBMFYSA-N 2 0 327.299 4.302 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)[C@@H]1CCCOC1 ZINC000507491680 1026816188 /nfs/dbraw/zinc/81/61/88/1026816188.db2.gz CERWUDJOKKPDPX-LMVRJCEZSA-N 2 0 344.543 4.069 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)[C@@H]1CCCOC1 ZINC000507491682 1026817180 /nfs/dbraw/zinc/81/71/80/1026817180.db2.gz CERWUDJOKKPDPX-VQQMMKBISA-N 2 0 344.543 4.069 20 0 EIADRP CCc1cccnc1[C@H](C)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000507528580 1026828858 /nfs/dbraw/zinc/82/88/58/1026828858.db2.gz OCFGQBLPGYLLFH-KKXNLOMOSA-N 2 0 329.532 4.338 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)cc1 ZINC000657493708 1026857384 /nfs/dbraw/zinc/85/73/84/1026857384.db2.gz ILFBDWNLPHZLCV-UHFFFAOYSA-N 2 0 329.513 4.081 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCOc2cccc3ccccc32)C[C@@H]1C ZINC001167589377 1026860191 /nfs/dbraw/zinc/86/01/91/1026860191.db2.gz DKKYOBPXNIBJDQ-AZUAARDMSA-N 2 0 340.511 4.413 20 0 EIADRP CC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCCc3cccnc32)CC1 ZINC000684952971 1026885513 /nfs/dbraw/zinc/88/55/13/1026885513.db2.gz BJXCZIBABSUYOJ-JOCHJYFZSA-N 2 0 349.522 4.481 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000519771068 1026982497 /nfs/dbraw/zinc/98/24/97/1026982497.db2.gz KBIPRUUTLCQPSB-KNXBSLHKSA-N 2 0 338.495 4.039 20 0 EIADRP FC(F)(F)c1cccc(CCCC[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000474469998 1027097459 /nfs/dbraw/zinc/09/74/59/1027097459.db2.gz CYJYJKDSTSAWOZ-MSOLQXFVSA-N 2 0 340.433 4.245 20 0 EIADRP CCOC1CCC([NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001168036223 1027152371 /nfs/dbraw/zinc/15/23/71/1027152371.db2.gz UPKTYJQKFCTTPJ-IYVCXYCASA-N 2 0 344.543 4.365 20 0 EIADRP c1ccc2c(CC[NH2+]C3CC[NH+](C4CCCCC4)CC3)ccnc2c1 ZINC000657589724 1027210148 /nfs/dbraw/zinc/21/01/48/1027210148.db2.gz GNBUPJWCBFYESP-UHFFFAOYSA-N 2 0 337.511 4.164 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H]2C[C@H](C)C[C@@H](c3ccccc3)C2)CC1 ZINC000159237898 1027327200 /nfs/dbraw/zinc/32/72/00/1027327200.db2.gz BKCNMJJLCKMJFJ-SYYKKAFVSA-N 2 0 344.543 4.049 20 0 EIADRP COc1ccccc1[C@H](CNc1cc[nH+]c(C)c1)[NH+]1CCCCC1 ZINC000302569677 1027338076 /nfs/dbraw/zinc/33/80/76/1027338076.db2.gz OWEOKYAOHYJSED-IBGZPJMESA-N 2 0 325.456 4.038 20 0 EIADRP CC1([NH+]2CCCC2)CCC([NH2+]Cc2csc(C(F)(F)F)n2)CC1 ZINC000896387828 1027448019 /nfs/dbraw/zinc/44/80/19/1027448019.db2.gz IXSVUAUHRDRWCB-UHFFFAOYSA-N 2 0 347.450 4.049 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)C1CCOCC1 ZINC000532206190 1027496354 /nfs/dbraw/zinc/49/63/54/1027496354.db2.gz KGNMDOSVIQGZAU-JOCHJYFZSA-N 2 0 344.543 4.357 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H]2C[C@H](c3ccccc3)C[C@H](C)C2)CC1 ZINC000159238001 1027496588 /nfs/dbraw/zinc/49/65/88/1027496588.db2.gz BKCNMJJLCKMJFJ-CZTZKLFOSA-N 2 0 344.543 4.049 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)CC1 ZINC000474885764 1027740032 /nfs/dbraw/zinc/74/00/32/1027740032.db2.gz WETZLQWNPZLEMK-AEGPPILISA-N 2 0 326.937 4.358 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](CCCc2ccc(C)nc2)CC1 ZINC000474927238 1027792106 /nfs/dbraw/zinc/79/21/06/1027792106.db2.gz JYRDOIGZODTFST-UHFFFAOYSA-N 2 0 331.548 4.157 20 0 EIADRP C[N@H+](Cc1cccc2cccnc21)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995891 1027819767 /nfs/dbraw/zinc/81/97/67/1027819767.db2.gz UPOKYLBEPJNTIK-WCRBZPEASA-N 2 0 335.495 4.072 20 0 EIADRP C[N@H+](C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1)C12CC3CC(CC(C3)C1)C2 ZINC001167996090 1027845277 /nfs/dbraw/zinc/84/52/77/1027845277.db2.gz WQTXUWKNLDYTLH-OJGPNISVSA-N 2 0 328.544 4.292 20 0 EIADRP CC[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccc(OC)c(OC)c1 ZINC000324070185 1028097948 /nfs/dbraw/zinc/09/79/48/1028097948.db2.gz XZRNXHPXCYTZHJ-SJLPKXTDSA-N 2 0 334.504 4.009 20 0 EIADRP CC[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccc(OC)c(OC)c1 ZINC000324070182 1028098565 /nfs/dbraw/zinc/09/85/65/1028098565.db2.gz XZRNXHPXCYTZHJ-AEFFLSMTSA-N 2 0 334.504 4.009 20 0 EIADRP Cc1ccc2cc(C[NH2+]Cc3cccc(C[NH+]4CCCC4)c3)ccc2n1 ZINC000189242061 1028108154 /nfs/dbraw/zinc/10/81/54/1028108154.db2.gz YESZZZBQNZBEHW-UHFFFAOYSA-N 2 0 345.490 4.429 20 0 EIADRP Cc1cc(C)cc(OCCC[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000523439828 1028117350 /nfs/dbraw/zinc/11/73/50/1028117350.db2.gz OSRRWJWFMKQMDJ-HXUWFJFHSA-N 2 0 330.516 4.023 20 0 EIADRP Cc1cccc([C@H](O)C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)c1 ZINC001167660088 1028269177 /nfs/dbraw/zinc/26/91/77/1028269177.db2.gz ZFKIRFZPWGYURR-DENIHFKCSA-N 2 0 344.543 4.005 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@H]1Cc1ccccc1C ZINC000346192038 1028319048 /nfs/dbraw/zinc/31/90/48/1028319048.db2.gz XLFZJBCVFPLEPX-JOCHJYFZSA-N 2 0 346.478 4.091 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)[C@H](C)c1cccc(Cl)c1 ZINC000346207114 1028328847 /nfs/dbraw/zinc/32/88/47/1028328847.db2.gz MCOSMCTXVJPVJN-OAHLLOKOSA-N 2 0 340.858 4.422 20 0 EIADRP CC[C@H](Cc1ccccc1)[N@H+](C)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000346222501 1028333472 /nfs/dbraw/zinc/33/34/72/1028333472.db2.gz OWHSWDPVWOOCEJ-HXUWFJFHSA-N 2 0 334.467 4.029 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C(C)(C)C)cc2)[C@H](C)C1 ZINC000523733323 1028343111 /nfs/dbraw/zinc/34/31/11/1028343111.db2.gz VVRWNXYVOJKGRP-WIYYLYMNSA-N 2 0 346.559 4.211 20 0 EIADRP C[C@H]1C[C@H]([NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)CC[N@@H+]1C ZINC000443983776 1028694029 /nfs/dbraw/zinc/69/40/29/1028694029.db2.gz FXZFFQDJODLJKW-MAUKXSAKSA-N 2 0 328.431 4.190 20 0 EIADRP [NH3+]C[C@H]1CC[C@H]([NH2+][C@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000635006784 1028816595 /nfs/dbraw/zinc/81/65/95/1028816595.db2.gz STYJOTJLWPXRPS-XERREHJYSA-N 2 0 335.451 4.024 20 0 EIADRP C[C@@H]([NH3+])C1CC[NH+](Cc2c(OC(F)F)ccc3ccccc32)CC1 ZINC000347141417 1028886801 /nfs/dbraw/zinc/88/68/01/1028886801.db2.gz WIURXJJOKOAZJH-CYBMUJFWSA-N 2 0 334.410 4.000 20 0 EIADRP Cc1ccsc1C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000583660788 1029005094 /nfs/dbraw/zinc/00/50/94/1029005094.db2.gz MFWBSJIYHNLTMC-HXUWFJFHSA-N 2 0 326.509 4.155 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CNc3ccccc3C2)CC1 ZINC000650749563 1029112718 /nfs/dbraw/zinc/11/27/18/1029112718.db2.gz PXMVNOZYPUPPAG-ORFBVSJDSA-N 2 0 349.522 4.056 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(C(F)(F)F)cc1 ZINC000650752520 1029137419 /nfs/dbraw/zinc/13/74/19/1029137419.db2.gz SPONGPKQFVHBCL-LLVKDONJSA-N 2 0 326.337 4.154 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(Cl)c(Cl)c1 ZINC000650752206 1029138814 /nfs/dbraw/zinc/13/88/14/1029138814.db2.gz LVWYOOJHPWZOOR-JTQLQIEISA-N 2 0 327.230 4.442 20 0 EIADRP C[C@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1ccc(OC(F)F)cc1 ZINC000522973586 1029139426 /nfs/dbraw/zinc/13/94/26/1029139426.db2.gz BRQKXHXEUKHIBU-XJKSGUPXSA-N 2 0 328.447 4.305 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(OC(F)F)cc1 ZINC000650752266 1029139571 /nfs/dbraw/zinc/13/95/71/1029139571.db2.gz NBYKZNSAOYZNPX-KRWDZBQOSA-N 2 0 338.373 4.127 20 0 EIADRP COc1ccc2oc([C@H](C)[NH2+]Cc3ccc(C[NH3+])cc3F)c(C)c2c1 ZINC000650753390 1029159307 /nfs/dbraw/zinc/15/93/07/1029159307.db2.gz MJOAWLBPSKTCNT-ZDUSSCGKSA-N 2 0 342.414 4.198 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)cc1 ZINC000650756190 1029184015 /nfs/dbraw/zinc/18/40/15/1029184015.db2.gz WGXDVNUIQQSDQD-HNNXBMFYSA-N 2 0 330.447 4.314 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H]1CCCc2c3cc(C)ccc3[nH]c21 ZINC000650756764 1029195435 /nfs/dbraw/zinc/19/54/35/1029195435.db2.gz JLBNBCAYMAUSBJ-NRFANRHFSA-N 2 0 333.479 4.363 20 0 EIADRP CCOc1cccc2cc([C@H](C)[NH2+]Cc3ccccc3C[NH2+]C)oc21 ZINC000650757499 1029204293 /nfs/dbraw/zinc/20/42/93/1029204293.db2.gz YHYOSOCMTKGABA-HNNXBMFYSA-N 2 0 338.451 4.402 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1ccc(OC)c2ccccc21 ZINC000650757897 1029210878 /nfs/dbraw/zinc/21/08/78/1029210878.db2.gz DIRDGXWIKUIYQK-INIZCTEOSA-N 2 0 334.463 4.419 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1cccc(Br)c1 ZINC000650759072 1029218042 /nfs/dbraw/zinc/21/80/42/1029218042.db2.gz CLBBGKOCBMIBGH-ZDUSSCGKSA-N 2 0 333.273 4.019 20 0 EIADRP CC(C)CC[NH+]1CCC([NH2+][C@H]2CCO[C@@H](c3cccs3)C2)CC1 ZINC000926536927 1029327439 /nfs/dbraw/zinc/32/74/39/1029327439.db2.gz INYXHSYBUGPLMC-ZWKOTPCHSA-N 2 0 336.545 4.068 20 0 EIADRP C[NH+](C)[C@@H]1CCC[N@H+](CCCCc2cccc(C(F)(F)F)c2)CC1 ZINC000475212272 1029443777 /nfs/dbraw/zinc/44/37/77/1029443777.db2.gz UQQQGHYKWUEKTB-GOSISDBHSA-N 2 0 342.449 4.444 20 0 EIADRP Cc1cc2[nH]c(C[NH2+]C[C@@H]3CC[N@H+](Cc4ccccc4)C3)cc2c(C)c1 ZINC000475278362 1029485561 /nfs/dbraw/zinc/48/55/61/1029485561.db2.gz VNCOKMLBNHDFRW-FQEVSTJZSA-N 2 0 347.506 4.396 20 0 EIADRP C[C@H](CCc1ccccc1F)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475279234 1029486804 /nfs/dbraw/zinc/48/68/04/1029486804.db2.gz XQWNNSPMYHPYEI-QUCCMNQESA-N 2 0 340.486 4.259 20 0 EIADRP C[C@H]1C[C@H](NCc2cc(Cl)ccc2OC2CCCC2)CC[N@@H+]1C ZINC000525207852 1029514924 /nfs/dbraw/zinc/51/49/24/1029514924.db2.gz RFDBKVYVIQJXKK-WMLDXEAASA-N 2 0 336.907 4.234 20 0 EIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccc3ncccc3c2)CC1 ZINC000475339030 1029553302 /nfs/dbraw/zinc/55/33/02/1029553302.db2.gz XMICWEZVLAPRJH-JTSKRJEESA-N 2 0 337.511 4.368 20 0 EIADRP C[C@@H](CC[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000446758577 1029571318 /nfs/dbraw/zinc/57/13/18/1029571318.db2.gz JUGMXEJCQWCTGH-IBGZPJMESA-N 2 0 337.511 4.424 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1cccc(OC(F)F)c1 ZINC000584067848 1029588445 /nfs/dbraw/zinc/58/84/45/1029588445.db2.gz KDWOYMCPZIDYJA-OAHLLOKOSA-N 2 0 326.431 4.205 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H]2CCCSc3ccc(OC)cc32)CC1 ZINC000446828428 1029594810 /nfs/dbraw/zinc/59/48/10/1029594810.db2.gz UQBJWSDJKSUDTK-LJQANCHMSA-N 2 0 348.556 4.334 20 0 EIADRP c1cc(-c2ccccc2)sc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446886923 1029631810 /nfs/dbraw/zinc/63/18/10/1029631810.db2.gz LTPYUWHLZJVPHR-UHFFFAOYSA-N 2 0 326.509 4.379 20 0 EIADRP CC(C)[C@@H](COCc1ccccc1)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000446929548 1029643166 /nfs/dbraw/zinc/64/31/66/1029643166.db2.gz RBCAQQYZJBSYTQ-JOCHJYFZSA-N 2 0 344.543 4.224 20 0 EIADRP CC(C)[C@@H](COCc1ccccc1)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000446937920 1029646243 /nfs/dbraw/zinc/64/62/43/1029646243.db2.gz UBCDYYNWSQSJCS-HXUWFJFHSA-N 2 0 332.532 4.080 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000657841280 1029753760 /nfs/dbraw/zinc/75/37/60/1029753760.db2.gz OPFNPJMHCNKEAE-JSGCOSHPSA-N 2 0 348.840 4.221 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000657841275 1029754793 /nfs/dbraw/zinc/75/47/93/1029754793.db2.gz OPFNPJMHCNKEAE-GXTWGEPZSA-N 2 0 348.840 4.221 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(Cl)s1 ZINC000708528741 1029813117 /nfs/dbraw/zinc/81/31/17/1029813117.db2.gz IGKGJNJDPDFCDV-GOEBONIOSA-N 2 0 334.916 4.259 20 0 EIADRP c1c[nH]c([C@@H]2CCC[N@@H+](Cc3ccccc3OC3CCCC3)C2)n1 ZINC000092071552 1029899750 /nfs/dbraw/zinc/89/97/50/1029899750.db2.gz XQEBQJZKPZQFLU-QGZVFWFLSA-N 2 0 325.456 4.111 20 0 EIADRP Cc1nc2c(s1)[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C3CCC3)C1)CCC2 ZINC000183187774 1029994585 /nfs/dbraw/zinc/99/45/85/1029994585.db2.gz DHDHOQQKKDMISZ-FRFSOERESA-N 2 0 333.545 4.072 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1nc2c(s1)CCCC2 ZINC000093398259 1030002093 /nfs/dbraw/zinc/00/20/93/1030002093.db2.gz KBAYEMORCRGJAB-HOTGVXAUSA-N 2 0 335.561 4.327 20 0 EIADRP Cc1ccccc1[C@H](C)[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000171126545 1030062769 /nfs/dbraw/zinc/06/27/69/1030062769.db2.gz HADDMWYWZYGBQO-SFHVURJKSA-N 2 0 326.484 4.176 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(C(F)F)nc2)c1 ZINC000657872240 1030088366 /nfs/dbraw/zinc/08/83/66/1030088366.db2.gz PNQFDQSCILELDG-CQSZACIVSA-N 2 0 333.426 4.322 20 0 EIADRP Clc1cnc2oc(C[NH2+]CCCCC[NH+]3CCCCC3)cc2c1 ZINC000648445627 1030149982 /nfs/dbraw/zinc/14/99/82/1030149982.db2.gz OLDKVNUDAFSBCO-UHFFFAOYSA-N 2 0 335.879 4.227 20 0 EIADRP Cc1[nH]c2ccc(F)cc2c1CC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000530221298 1030217072 /nfs/dbraw/zinc/21/70/72/1030217072.db2.gz OWOYZLQOHLVMQA-MISYRCLQSA-N 2 0 343.490 4.058 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc(-c2ccccc2)s1 ZINC000530214085 1030218091 /nfs/dbraw/zinc/21/80/91/1030218091.db2.gz XMTHCGYXQBJLDF-AWEZNQCLSA-N 2 0 337.492 4.428 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2ccc(F)c(F)c2)CC1 ZINC000530329387 1030318174 /nfs/dbraw/zinc/31/81/74/1030318174.db2.gz XQBLYLKXRKAWKH-QRWLVFNGSA-N 2 0 336.470 4.140 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000685443117 1030319745 /nfs/dbraw/zinc/31/97/45/1030319745.db2.gz BXXSPNUWCSQTLW-SJPCQFCGSA-N 2 0 326.406 4.071 20 0 EIADRP CCCOc1ccc([C@@H](C)[NH2+]CC2=CC[N@H+](C)CC2)cc1OCCC ZINC000392288464 1030330500 /nfs/dbraw/zinc/33/05/00/1030330500.db2.gz LVVVXZRTGJHRKV-QGZVFWFLSA-N 2 0 346.515 4.177 20 0 EIADRP CCOC1CCC([NH2+]C2CCN([C@@H](C)c3ccccc3)CC2)CC1 ZINC000657891336 1030363051 /nfs/dbraw/zinc/36/30/51/1030363051.db2.gz ZEYZALOINJXLKH-OCDPCBSRSA-N 2 0 330.516 4.149 20 0 EIADRP Cn1cncc1CC[NH2+][C@H](c1ccc(F)cc1)c1ccccc1Cl ZINC000530407243 1030378326 /nfs/dbraw/zinc/37/83/26/1030378326.db2.gz HQWGSLWKQFATRS-LJQANCHMSA-N 2 0 343.833 4.134 20 0 EIADRP C[C@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH3+])(Cc2ccccc2)CC1 ZINC001168168622 1030395863 /nfs/dbraw/zinc/39/58/63/1030395863.db2.gz SWMSMBIFBHEBHZ-QGZVFWFLSA-N 2 0 342.914 4.307 20 0 EIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+][C@H]1CCCSCC1 ZINC000657907117 1030456608 /nfs/dbraw/zinc/45/66/08/1030456608.db2.gz GTJZGQOJIRYUSN-LMMKCTJWSA-N 2 0 332.557 4.018 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c3cccnc23)C[C@@H]1C ZINC000530663224 1030620058 /nfs/dbraw/zinc/62/00/58/1030620058.db2.gz YNSHKOXVEPOUSC-HOCLYGCPSA-N 2 0 331.891 4.193 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000548851782 1030634267 /nfs/dbraw/zinc/63/42/67/1030634267.db2.gz FHCPGEDZZOCZAD-BAAYTWLHSA-N 2 0 326.406 4.040 20 0 EIADRP Cc1cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cc(C)c1O ZINC000398182632 1030732888 /nfs/dbraw/zinc/73/28/88/1030732888.db2.gz KKMMTTGOQHOVJI-GHTZIAJQSA-N 2 0 338.495 4.009 20 0 EIADRP CCC[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)C1CCCCC1 ZINC000658067914 1030814456 /nfs/dbraw/zinc/81/44/56/1030814456.db2.gz SATZKFMHGLPQOW-NRFANRHFSA-N 2 0 336.564 4.216 20 0 EIADRP CCCC[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccccc1 ZINC000658068604 1030814601 /nfs/dbraw/zinc/81/46/01/1030814601.db2.gz XOWFVHPLIGQKRJ-JOCHJYFZSA-N 2 0 344.543 4.399 20 0 EIADRP C[C@H]1CC[C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)c2sccc21 ZINC000658069523 1030815611 /nfs/dbraw/zinc/81/56/11/1030815611.db2.gz GNFZVGVGUFBMSK-KXBFYZLASA-N 2 0 348.556 4.167 20 0 EIADRP CC(C)CC[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)C(C)(C)C ZINC000658071796 1030815817 /nfs/dbraw/zinc/81/58/17/1030815817.db2.gz ZKAQRVVNSDAJSK-FQEVSTJZSA-N 2 0 338.580 4.318 20 0 EIADRP C[C@@H]1[C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C[C@H]1c1ccccc1 ZINC000658164471 1030861311 /nfs/dbraw/zinc/86/13/11/1030861311.db2.gz DKGAFRGGTXBZIQ-CDNPAEQRSA-N 2 0 349.522 4.075 20 0 EIADRP CC1(C)C[C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c2ccccc21 ZINC000658167270 1030864292 /nfs/dbraw/zinc/86/42/92/1030864292.db2.gz RHWCYTXXCATXIP-QFIPXVFZSA-N 2 0 349.522 4.306 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c(C)s1 ZINC000658167372 1030864743 /nfs/dbraw/zinc/86/47/43/1030864743.db2.gz RTUDPDAVYKFGEO-MRXNPFEDSA-N 2 0 343.540 4.323 20 0 EIADRP CCCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)cc1OCCC ZINC000392722146 1030946730 /nfs/dbraw/zinc/94/67/30/1030946730.db2.gz PTWYZTCJCPXEGI-QZTJIDSGSA-N 2 0 348.531 4.257 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cc2ccncc2s1 ZINC000658353281 1031022134 /nfs/dbraw/zinc/02/21/34/1031022134.db2.gz KNFQGYLTLVKVNX-CQSZACIVSA-N 2 0 329.513 4.069 20 0 EIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3c[nH]c4ccccc34)CC2)C1 ZINC000532442228 1031070628 /nfs/dbraw/zinc/07/06/28/1031070628.db2.gz MUPBXMMTFOEKQR-FXAWDEMLSA-N 2 0 339.527 4.343 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]CCC[NH+]2CCCC2)cc1 ZINC000532454364 1031089308 /nfs/dbraw/zinc/08/93/08/1031089308.db2.gz UBJVEHSEDJIFEM-SFHVURJKSA-N 2 0 338.495 4.499 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)C1CCOCC1 ZINC000532459775 1031107024 /nfs/dbraw/zinc/10/70/24/1031107024.db2.gz IVSHHGSSUUXKFV-GCJKJVERSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(Sc2ccccc2)CCCC1 ZINC000532506783 1031228305 /nfs/dbraw/zinc/22/83/05/1031228305.db2.gz FXUMAODPFZMWOV-LMMKCTJWSA-N 2 0 332.557 4.410 20 0 EIADRP CCC(CC)(CN[C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C)[NH2+][C@H](C)c1ccccc1 ZINC000532517022 1031248600 /nfs/dbraw/zinc/24/86/00/1031248600.db2.gz MAWIRKASXQLFEJ-CTAFRAEOSA-N 2 0 345.575 4.214 20 0 EIADRP CC1CCC(n2cc(CC[NH+]3CCC([NH3+])CC3)c3ccccc32)CC1 ZINC001168203304 1031267848 /nfs/dbraw/zinc/26/78/48/1031267848.db2.gz MAMDMBLQXFZKFR-UHFFFAOYSA-N 2 0 339.527 4.358 20 0 EIADRP Cn1ccc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)c1 ZINC000123136410 1031328357 /nfs/dbraw/zinc/32/83/57/1031328357.db2.gz MMAZTVVTYIYBAX-UHFFFAOYSA-N 2 0 333.479 4.044 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)[C@H](C)O1 ZINC000449074686 1031429968 /nfs/dbraw/zinc/42/99/68/1031429968.db2.gz LPAWPAPXKDYULF-JLHGSKIFSA-N 2 0 338.495 4.071 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)Cc2cccs2)CC1 ZINC000449078528 1031431421 /nfs/dbraw/zinc/43/14/21/1031431421.db2.gz YGZSEDMFURFVGN-ZWKOTPCHSA-N 2 0 342.552 4.364 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2csc(C)c2)cc1 ZINC000449081643 1031437118 /nfs/dbraw/zinc/43/71/18/1031437118.db2.gz GVKAWHGWKXUZJW-UHFFFAOYSA-N 2 0 332.513 4.067 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCOC3(CCC3)C2)C1 ZINC000449082168 1031438427 /nfs/dbraw/zinc/43/84/27/1031438427.db2.gz LFFHJTMAZISQNL-NQIIRXRSSA-N 2 0 342.527 4.110 20 0 EIADRP Cc1ccc2sc(C[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)nc2c1 ZINC000528370996 1031455830 /nfs/dbraw/zinc/45/58/30/1031455830.db2.gz GTUFKBMXVSUTMN-UHFFFAOYSA-N 2 0 331.529 4.157 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H](CC2CC2)c2ccccc2)c1 ZINC000531699634 1031483436 /nfs/dbraw/zinc/48/34/36/1031483436.db2.gz PGHIURSQFRFCCC-JOCHJYFZSA-N 2 0 338.495 4.258 20 0 EIADRP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000531715400 1031501915 /nfs/dbraw/zinc/50/19/15/1031501915.db2.gz ZOOLAGCFLCYWSC-ZBFHGGJFSA-N 2 0 326.937 4.142 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCC[C@@H]3OCC[C@@H]32)CC1 ZINC000449189394 1031507438 /nfs/dbraw/zinc/50/74/38/1031507438.db2.gz UPQJMUYAUNASSX-QRVBRYPASA-N 2 0 336.564 4.213 20 0 EIADRP CC[C@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)C1CCOCC1 ZINC000449180867 1031520018 /nfs/dbraw/zinc/52/00/18/1031520018.db2.gz CRSNIUYKQMFGQF-IBGZPJMESA-N 2 0 338.580 4.460 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2sccc2Br)CC1 ZINC000531724580 1031526553 /nfs/dbraw/zinc/52/65/53/1031526553.db2.gz DVNFTFYXDFZOHU-LBPRGKRZSA-N 2 0 345.350 4.283 20 0 EIADRP COc1cc(C[NH2+]Cc2cccc(C[NH+](C)C)c2)cc2ccccc21 ZINC000449218387 1031551128 /nfs/dbraw/zinc/55/11/28/1031551128.db2.gz HUSXAPJNLJCEKQ-UHFFFAOYSA-N 2 0 334.463 4.200 20 0 EIADRP C[C@@H]([NH2+]C1CCC(OC2CCCC2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000449231325 1031561550 /nfs/dbraw/zinc/56/15/50/1031561550.db2.gz DGUQYEXVNBSWJX-HQHQBECKSA-N 2 0 348.575 4.499 20 0 EIADRP C[C@H](CCCc1cccnc1)[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000453084778 1031574741 /nfs/dbraw/zinc/57/47/41/1031574741.db2.gz WRODZUUAMQFCBG-LJQANCHMSA-N 2 0 337.511 4.178 20 0 EIADRP C[C@H](NCCC[N@@H+]1CCCC[C@H]1C)c1ncc(-c2ccccc2)n1C ZINC000453093397 1031585037 /nfs/dbraw/zinc/58/50/37/1031585037.db2.gz RCJUIOYTVFWRDU-MSOLQXFVSA-N 2 0 340.515 4.002 20 0 EIADRP FC(F)(F)CCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000453122747 1031615572 /nfs/dbraw/zinc/61/55/72/1031615572.db2.gz PKDYFHQYRJQBTC-KZNAEPCWSA-N 2 0 340.433 4.362 20 0 EIADRP C[C@H](CCCc1cccnc1)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000453121901 1031616293 /nfs/dbraw/zinc/61/62/93/1031616293.db2.gz DJFLALDBKIWIFR-GOSISDBHSA-N 2 0 329.532 4.180 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C[C@H]2CCCSC2)CC1 ZINC000449335053 1031652813 /nfs/dbraw/zinc/65/28/13/1031652813.db2.gz YKSARKVYTKGZFO-MRXNPFEDSA-N 2 0 326.594 4.398 20 0 EIADRP CC1(C)C[N@H+](Cc2cccnc2)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449413592 1031695754 /nfs/dbraw/zinc/69/57/54/1031695754.db2.gz JLEQUDOGHOUGMZ-QFIPXVFZSA-N 2 0 349.522 4.204 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCCCC1(F)F)c1cccc(OCC[NH+](C)C)c1 ZINC000453251811 1031775350 /nfs/dbraw/zinc/77/53/50/1031775350.db2.gz NUSHDUTZOWCCQU-RDJZCZTQSA-N 2 0 340.458 4.103 20 0 EIADRP COc1cc(Cl)c(C[NH2+]C(C)(C)CCC[NH+](C)C)cc1Cl ZINC000449525943 1031822685 /nfs/dbraw/zinc/82/26/85/1031822685.db2.gz CUTRWWQIPLBNMY-UHFFFAOYSA-N 2 0 333.303 4.212 20 0 EIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000531944454 1031826183 /nfs/dbraw/zinc/82/61/83/1031826183.db2.gz NNOXLFJNYMCUOK-IRXDYDNUSA-N 2 0 326.484 4.039 20 0 EIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3C)CCCO2 ZINC000453335189 1031860394 /nfs/dbraw/zinc/86/03/94/1031860394.db2.gz DCPGHNOQYOZINF-DLZDZTESSA-N 2 0 328.500 4.239 20 0 EIADRP CC[C@@H]1CCC[C@H]1[NH2+]CC1CC[NH+](Cc2ccc(OC)cc2)CC1 ZINC000531950171 1031865053 /nfs/dbraw/zinc/86/50/53/1031865053.db2.gz CZBJDUFKVKEWEB-TZIWHRDSSA-N 2 0 330.516 4.076 20 0 EIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000531970871 1031903570 /nfs/dbraw/zinc/90/35/70/1031903570.db2.gz ZDINZSKSVGJXEE-BFHYXJOUSA-N 2 0 345.314 4.081 20 0 EIADRP Cc1cccc([C@@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2cccc(F)c2)c1 ZINC000453376695 1031926454 /nfs/dbraw/zinc/92/64/54/1031926454.db2.gz YRFNHFSVELKRSZ-LQCXBHPOSA-N 2 0 338.470 4.438 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1cccc(OC(F)(F)F)c1 ZINC000453399171 1031933167 /nfs/dbraw/zinc/93/31/67/1031933167.db2.gz KZQLVTCRNSHBBP-ZDUSSCGKSA-N 2 0 330.394 4.110 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(F)cc1Br ZINC000453399781 1031934176 /nfs/dbraw/zinc/93/41/76/1031934176.db2.gz LJTFZCLXEUWCLE-GFCCVEGCSA-N 2 0 343.284 4.113 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@@H](C)c1nc2ccccc2s1 ZINC000453417581 1031952386 /nfs/dbraw/zinc/95/23/86/1031952386.db2.gz XVEGFGIYBKHQFZ-HUUCEWRRSA-N 2 0 331.529 4.252 20 0 EIADRP CC[C@@H]1CCC[C@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000531994586 1031960878 /nfs/dbraw/zinc/96/08/78/1031960878.db2.gz BDBLDWSQQHSIIN-IFMALSPDSA-N 2 0 344.543 4.226 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(OC(F)(F)F)cc1 ZINC000453420099 1031974803 /nfs/dbraw/zinc/97/48/03/1031974803.db2.gz ZCLSHIBLHNIXJP-CYBMUJFWSA-N 2 0 330.394 4.110 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+]CCCC[N@H+](C)C2CC2)cc1 ZINC000453592404 1032035348 /nfs/dbraw/zinc/03/53/48/1032035348.db2.gz DZBHWQNAEIUTJS-UHFFFAOYSA-N 2 0 338.495 4.326 20 0 EIADRP FC1(F)CCC[C@H]([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000512646591 1033613339 /nfs/dbraw/zinc/61/33/39/1033613339.db2.gz BMWAUGSCCQIEGO-VNTMZGSJSA-N 2 0 348.481 4.455 20 0 EIADRP C[C@H]1[N@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CCC12CCOCC2 ZINC000411527755 1033964704 /nfs/dbraw/zinc/96/47/04/1033964704.db2.gz QXXRKLWYTSWXMK-LJQANCHMSA-N 2 0 342.527 4.064 20 0 EIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC1(C(F)(F)F)CC1 ZINC000512868449 1034102746 /nfs/dbraw/zinc/10/27/46/1034102746.db2.gz CYBWBYCDKVMAKY-UHFFFAOYSA-N 2 0 328.422 4.077 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cc(C)c(O)c(C)c2)c1 ZINC000513109432 1034600262 /nfs/dbraw/zinc/60/02/62/1034600262.db2.gz BMHNUSKWWXAVDV-UHFFFAOYSA-N 2 0 326.484 4.141 20 0 EIADRP C[N@H+](Cc1ccc(-c2cccs2)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513127017 1034604206 /nfs/dbraw/zinc/60/42/06/1034604206.db2.gz BHDNWNKRCWAIFK-DFNIBXOVSA-N 2 0 326.509 4.472 20 0 EIADRP Cc1ccc(C[NH+]2CCC3(CC2)CC[NH+]([C@H]2C[C@H]4C[C@H]4C2)CC3)cc1 ZINC001167933136 1034696901 /nfs/dbraw/zinc/69/69/01/1034696901.db2.gz BBVBSJIFAISAGB-ZBYYUNFXSA-N 2 0 338.539 4.472 20 0 EIADRP c1csc(C[NH+]2CCC3(CC2)CC[NH+]([C@@H]2C[C@H]4C[C@H]4C2)CC3)c1 ZINC001167933156 1034697237 /nfs/dbraw/zinc/69/72/37/1034697237.db2.gz BHDQNVUIMCLQJB-BCDXTJNWSA-N 2 0 330.541 4.225 20 0 EIADRP C[N@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+]([C@H]3C[C@H]4C[C@H]4C3)C[C@@H]21 ZINC001167934139 1034710659 /nfs/dbraw/zinc/71/06/59/1034710659.db2.gz GVMRSHOMCRAQES-YDMYOYKNSA-N 2 0 330.541 4.079 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1(c2cccc(Cl)c2)CCC1 ZINC000647804619 1034892572 /nfs/dbraw/zinc/89/25/72/1034892572.db2.gz VVUFPVWOGWZJPC-AWEZNQCLSA-N 2 0 329.875 4.232 20 0 EIADRP CCC(CC)[C@@H]1C[C@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)CCO1 ZINC000513414543 1034933449 /nfs/dbraw/zinc/93/34/49/1034933449.db2.gz OHAVKTNDUUTKGT-CTNGQTDRSA-N 2 0 336.564 4.357 20 0 EIADRP COc1ccccc1C[NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000513500032 1034997717 /nfs/dbraw/zinc/99/77/17/1034997717.db2.gz KMYKOPSBVDGDAS-ICSRJNTNSA-N 2 0 338.495 4.086 20 0 EIADRP COc1ccccc1C[NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000513500031 1034998608 /nfs/dbraw/zinc/99/86/08/1034998608.db2.gz KMYKOPSBVDGDAS-AZUAARDMSA-N 2 0 338.495 4.086 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2ccc(Cl)o2)C[N@@H+]1Cc1ccccc1 ZINC000513501542 1034999459 /nfs/dbraw/zinc/99/94/59/1034999459.db2.gz TVTQRHXIURNJQL-NVXWUHKLSA-N 2 0 332.875 4.323 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000513683332 1035101097 /nfs/dbraw/zinc/10/10/97/1035101097.db2.gz JJKCLWWGBHOOFE-PPUFBPAQSA-N 2 0 327.299 4.443 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cc1OC ZINC000513702608 1035322656 /nfs/dbraw/zinc/32/26/56/1035322656.db2.gz KSGVRLMASLHCBC-IVMQYODDSA-N 2 0 348.531 4.398 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000501384129 1035436242 /nfs/dbraw/zinc/43/62/42/1035436242.db2.gz WRWVEMQVKNAFDD-HDAAZOAOSA-N 2 0 329.532 4.065 20 0 EIADRP CC(C)n1c2ccccc2nc1[C@H]1CCC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000420307251 1035505639 /nfs/dbraw/zinc/50/56/39/1035505639.db2.gz BILYTKVVPVAZCR-YLJYHZDGSA-N 2 0 340.515 4.144 20 0 EIADRP CC(=O)c1c(C)cc(C)c(C[NH+]2CCC(CCC[NH+](C)C)CC2)c1C ZINC000501773283 1035575950 /nfs/dbraw/zinc/57/59/50/1035575950.db2.gz IHJVLVAMSQITRG-UHFFFAOYSA-N 2 0 344.543 4.368 20 0 EIADRP Cc1sc([C@@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)nc1-c1ccc(Cl)cc1 ZINC000420402246 1035576501 /nfs/dbraw/zinc/57/65/01/1035576501.db2.gz JXTADDPLBLRPPL-TZMCWYRMSA-N 2 0 349.931 4.422 20 0 EIADRP CCSC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000595100650 1035589839 /nfs/dbraw/zinc/58/98/39/1035589839.db2.gz TZVMMMIWIGCNDQ-REPLKXPHSA-N 2 0 330.541 4.057 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000491057586 1035796935 /nfs/dbraw/zinc/79/69/35/1035796935.db2.gz FUEARGSCFBBBAI-FQEVSTJZSA-N 2 0 328.887 4.361 20 0 EIADRP C[C@H]([NH2+][C@H]1CCc2ccc(F)cc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000485257797 1035801547 /nfs/dbraw/zinc/80/15/47/1035801547.db2.gz HADPKMFKABLZFO-NBCNXNJRSA-N 2 0 338.470 4.313 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CCC[C@@H]4C[C@@]43C)CC2)cc1 ZINC000502267141 1036004219 /nfs/dbraw/zinc/00/42/19/1036004219.db2.gz HGVCINPVRKZYCJ-FCEUIQTBSA-N 2 0 342.527 4.076 20 0 EIADRP FC(F)C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000421366214 1036309784 /nfs/dbraw/zinc/30/97/84/1036309784.db2.gz CABBPINJHWCHMG-SFHVURJKSA-N 2 0 331.410 4.037 20 0 EIADRP C[C@@H](CCc1cccc(C(F)(F)F)c1)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421367505 1036310900 /nfs/dbraw/zinc/31/09/00/1036310900.db2.gz DXTSHMCZMFKESK-NNGSBXSVSA-N 2 0 342.449 4.489 20 0 EIADRP C[C@H](C[NH2+]C1CCC([NH+](C)C)CC1)c1cccc(Br)c1 ZINC000421371534 1036318400 /nfs/dbraw/zinc/31/84/00/1036318400.db2.gz KVLPENRGBFLGIS-NVPAJSRCSA-N 2 0 339.321 4.015 20 0 EIADRP c1c(C[NH2+]CCC[NH+]2CCCC2)c2ccccc2n1Cc1ccccc1 ZINC000588281022 1036337833 /nfs/dbraw/zinc/33/78/33/1036337833.db2.gz YDHXNTPZMJEJOF-UHFFFAOYSA-N 2 0 347.506 4.265 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@@H]3CC34CCSCC4)CC2)C1 ZINC000421391656 1036355094 /nfs/dbraw/zinc/35/50/94/1036355094.db2.gz WNRBBSBCMWZPIM-AOIWGVFYSA-N 2 0 336.589 4.152 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000502708755 1036565846 /nfs/dbraw/zinc/56/58/46/1036565846.db2.gz LJXCKWWHDNEXGD-VXKWHMMOSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502729033 1036589226 /nfs/dbraw/zinc/58/92/26/1036589226.db2.gz VICITSWNRADEPX-QZTJIDSGSA-N 2 0 332.536 4.161 20 0 EIADRP c1ccc(SC2CC[NH+](C3CC[NH+](CC4CC4)CC3)CC2)cc1 ZINC001168388176 1036714784 /nfs/dbraw/zinc/71/47/84/1036714784.db2.gz CGHIRVUPOIMWTM-UHFFFAOYSA-N 2 0 330.541 4.118 20 0 EIADRP C[C@H]([NH2+]C/C=C\c1ccc(F)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486472921 1036722006 /nfs/dbraw/zinc/72/20/06/1036722006.db2.gz DPKARZYRVMHYLF-BAZGULGGSA-N 2 0 338.470 4.339 20 0 EIADRP CSC1(C[NH2+][C@H]2C[C@H](C(C)C)c3ccccc32)CC[NH+](C)CC1 ZINC000589348091 1036759804 /nfs/dbraw/zinc/75/98/04/1036759804.db2.gz QNGZZNSJIIDBBD-MOPGFXCFSA-N 2 0 332.557 4.288 20 0 EIADRP COc1ccc([C@@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)C(C)C)c(F)c1 ZINC000421821080 1036774384 /nfs/dbraw/zinc/77/43/84/1036774384.db2.gz PJCXECNPHJEGEO-NRFANRHFSA-N 2 0 344.474 4.383 20 0 EIADRP COc1ccc([C@@H]([NH2+]Cc2cccc(C[NH+](C)C)c2)C2CC2)c(F)c1 ZINC000421821893 1036776094 /nfs/dbraw/zinc/77/60/94/1036776094.db2.gz UREKJIQFTXMYMO-NRFANRHFSA-N 2 0 342.458 4.137 20 0 EIADRP COc1cc(Cl)ccc1[C@@H](C)[NH2+]C1CCN(c2ccccn2)CC1 ZINC000421821366 1036777133 /nfs/dbraw/zinc/77/71/33/1036777133.db2.gz RBKHISDYSAUUTD-CQSZACIVSA-N 2 0 345.874 4.063 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cc3ccc(F)cc3[nH]2)c1 ZINC000486688126 1036817062 /nfs/dbraw/zinc/81/70/62/1036817062.db2.gz FRQZZPGSNQLYQH-UHFFFAOYSA-N 2 0 325.431 4.049 20 0 EIADRP c1cc(OCC[NH+]2CCCC2)ccc1CC[NH2+]C1CCC2(CC2)CC1 ZINC000486699064 1036820541 /nfs/dbraw/zinc/82/05/41/1036820541.db2.gz WGHSLKGJMQYULW-UHFFFAOYSA-N 2 0 342.527 4.016 20 0 EIADRP c1ccc(CC[C@@H]2CCC[N@@H+](C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC001168395180 1036881342 /nfs/dbraw/zinc/88/13/42/1036881342.db2.gz PGHKRSPUAWGNJU-FQEVSTJZSA-N 2 0 326.528 4.206 20 0 EIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(C)ccc1OC ZINC000589999647 1036918175 /nfs/dbraw/zinc/91/81/75/1036918175.db2.gz QCCUKKFXZJKWBQ-UHFFFAOYSA-N 2 0 326.484 4.087 20 0 EIADRP C(=C/c1ccncc1)\C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000486958890 1036922269 /nfs/dbraw/zinc/92/22/69/1036922269.db2.gz QBILYLQSXAZBSF-AATRIKPKSA-N 2 0 335.495 4.261 20 0 EIADRP c1ccc(C[NH+]2CCCCC2)c(CNc2cc[nH+]c3ccccc23)c1 ZINC000599447496 1037009291 /nfs/dbraw/zinc/00/92/91/1037009291.db2.gz HUNWBYGGRHBCKP-UHFFFAOYSA-N 2 0 331.463 4.255 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+]Cc1cn(Cc2ccccc2)c2ccccc12 ZINC000590611165 1037116382 /nfs/dbraw/zinc/11/63/82/1037116382.db2.gz CUPJTYFZSIPCJT-GOSISDBHSA-N 2 0 335.495 4.119 20 0 EIADRP C[C@@H](CC[NH+](C)C)[NH2+]Cc1cn(Cc2ccccc2)c2ccccc12 ZINC000590611166 1037116965 /nfs/dbraw/zinc/11/69/65/1037116965.db2.gz CUPJTYFZSIPCJT-SFHVURJKSA-N 2 0 335.495 4.119 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)C1 ZINC000590611659 1037117916 /nfs/dbraw/zinc/11/79/16/1037117916.db2.gz QWDWCPSWLLBFCK-FQEVSTJZSA-N 2 0 347.506 4.121 20 0 EIADRP CCC1(C[NH2+]C/C=C\c2ccncc2)CC[NH+](Cc2ccccc2)CC1 ZINC000487553525 1037138670 /nfs/dbraw/zinc/13/86/70/1037138670.db2.gz CUBTUYWSIDWMPA-TWGQIWQCSA-N 2 0 349.522 4.377 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(Cl)c3cccnc23)CC1 ZINC000590786192 1037167657 /nfs/dbraw/zinc/16/76/57/1037167657.db2.gz GLIBYOGFLSKQEB-UHFFFAOYSA-N 2 0 345.918 4.440 20 0 EIADRP CCc1ncc(C[NH+]2CCC(CC[N@@H+](CC)CC(C)C)CC2)s1 ZINC000573167389 1037385349 /nfs/dbraw/zinc/38/53/49/1037385349.db2.gz FSLUDRAIVBVXNV-UHFFFAOYSA-N 2 0 337.577 4.286 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](CCCOc2cccc(Cl)c2)CC1 ZINC000488265144 1037466475 /nfs/dbraw/zinc/46/64/75/1037466475.db2.gz FPHNVBONSJAZQT-UHFFFAOYSA-N 2 0 338.923 4.163 20 0 EIADRP CC(=O)c1c(C)cc(C)c(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c1C ZINC000488343452 1037545433 /nfs/dbraw/zinc/54/54/33/1037545433.db2.gz KQWBTRIJMHUQIH-UHFFFAOYSA-N 2 0 342.527 4.122 20 0 EIADRP CC(C)[NH2+]CCC[NH2+][C@@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000573474515 1037567482 /nfs/dbraw/zinc/56/74/82/1037567482.db2.gz ZVURNOIKJQOIGA-MRXNPFEDSA-N 2 0 329.513 4.165 20 0 EIADRP CC[C@@H]1C[C@H](C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CCO1 ZINC000503572728 1037824107 /nfs/dbraw/zinc/82/41/07/1037824107.db2.gz HHKMJPMHYLVUCB-WSWWRLHASA-N 2 0 344.543 4.082 20 0 EIADRP CC[C@H]([NH2+][C@H](C)c1ccc(C[NH3+])nc1C)C(C)(C)c1ccccc1 ZINC000422784782 1037832016 /nfs/dbraw/zinc/83/20/16/1037832016.db2.gz OOGXLQYJNQUZEW-UZLBHIALSA-N 2 0 325.500 4.256 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000422800113 1037835677 /nfs/dbraw/zinc/83/56/77/1037835677.db2.gz AUMPSWPXEUKPHC-NEPJUHHUSA-N 2 0 337.389 4.279 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c(C)s1 ZINC000422808549 1037837865 /nfs/dbraw/zinc/83/78/65/1037837865.db2.gz OJLLKCGUGLPRQZ-ADLFWFRXSA-N 2 0 342.508 4.271 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1C ZINC000422792023 1037839212 /nfs/dbraw/zinc/83/92/12/1037839212.db2.gz ZABIKJFVKNZBET-WEYGHZABSA-N 2 0 336.479 4.210 20 0 EIADRP COc1ccccc1[C@H](CC(C)C)[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422825938 1037841042 /nfs/dbraw/zinc/84/10/42/1037841042.db2.gz QFLMOVBVDAIJPA-UZLBHIALSA-N 2 0 341.499 4.295 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]CCOc1c(Cl)cc(Cl)cc1Cl ZINC000422841154 1037844454 /nfs/dbraw/zinc/84/44/54/1037844454.db2.gz VJBCEPINAOWGFO-SNVBAGLBSA-N 2 0 339.694 4.133 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]CCOc1c(Cl)cc(Cl)cc1Cl ZINC000422841147 1037844580 /nfs/dbraw/zinc/84/45/80/1037844580.db2.gz VJBCEPINAOWGFO-JTQLQIEISA-N 2 0 339.694 4.133 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CN[C@@H]3C[C@H]([NH3+])c4ccccc43)cc2)C1 ZINC000422866966 1037849518 /nfs/dbraw/zinc/84/95/18/1037849518.db2.gz RGZOJHFOMMLFJE-MQNAVGNWSA-N 2 0 349.522 4.153 20 0 EIADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1ccccc1COCc1ccccc1 ZINC000422862315 1037849558 /nfs/dbraw/zinc/84/95/58/1037849558.db2.gz NMSLPLTUKOUUBW-DENIHFKCSA-N 2 0 338.495 4.011 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]C1CCC(C[NH3+])CC1 ZINC000422931226 1037874103 /nfs/dbraw/zinc/87/41/03/1037874103.db2.gz BCDSPZXHOHQGPN-BZOOQXSSSA-N 2 0 329.513 4.287 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](COc1ccccc1F)c1ccccc1 ZINC000422940952 1037875078 /nfs/dbraw/zinc/87/50/78/1037875078.db2.gz UJZXBAXFFUNKJA-QFBILLFUSA-N 2 0 330.447 4.053 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000422940964 1037875496 /nfs/dbraw/zinc/87/54/96/1037875496.db2.gz ULCPFYQNDVTPHL-GRDNDAEWSA-N 2 0 329.513 4.157 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC(C)(C)c1c(F)cccc1Cl ZINC000422917703 1037877983 /nfs/dbraw/zinc/87/79/83/1037877983.db2.gz FPTGOHCMEGEUTJ-LBPRGKRZSA-N 2 0 349.881 4.270 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000422963741 1037880250 /nfs/dbraw/zinc/88/02/50/1037880250.db2.gz GUGCPJLJPLKWTI-GOSISDBHSA-N 3 0 339.527 4.022 20 0 EIADRP CC1CC[NH+](Cc2ccccc2CN[C@@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000422967255 1037880885 /nfs/dbraw/zinc/88/08/85/1037880885.db2.gz OTCKRCNGMFAORR-DHIUTWEWSA-N 2 0 349.522 4.153 20 0 EIADRP CCOc1ccc([C@@H]([NH2+][C@H](C)CCCC[NH3+])c2ccccc2)cc1 ZINC000422946745 1037884666 /nfs/dbraw/zinc/88/46/66/1037884666.db2.gz PDUOQSAQRWITOD-UTKZUKDTSA-N 2 0 326.484 4.282 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]C[C@H](C)Sc1ccc(Br)cc1 ZINC000422957085 1037889723 /nfs/dbraw/zinc/88/97/23/1037889723.db2.gz MLESWLMNSIINMP-OLZOCXBDSA-N 2 0 345.350 4.037 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c2ccccc21 ZINC000422993381 1037891127 /nfs/dbraw/zinc/89/11/27/1037891127.db2.gz SRTPNRIENPSQBF-SXWKCWPCSA-N 2 0 348.490 4.255 20 0 EIADRP CC[C@H](Cc1ccc(Cl)cc1)[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422982773 1037895622 /nfs/dbraw/zinc/89/56/22/1037895622.db2.gz RGPSCLCPZWDWHV-SUMWQHHRSA-N 2 0 331.891 4.174 20 0 EIADRP Clc1ccc(CSCC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c(Cl)c1 ZINC000423017265 1037902488 /nfs/dbraw/zinc/90/24/88/1037902488.db2.gz OEZBINNCUPKZFE-YIONKMFJSA-N 2 0 345.339 4.099 20 0 EIADRP C([NH2+][C@@H]1CCOC[C@@H]1[C@@H]1CCC[NH2+]1)C1(C2CCCCC2)CCCCC1 ZINC000423022258 1037905384 /nfs/dbraw/zinc/90/53/84/1037905384.db2.gz HHALDIFTVBSXMA-QHAWAJNXSA-N 2 0 348.575 4.264 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H]1CCCOc2c(Cl)cccc21 ZINC000423035791 1037921033 /nfs/dbraw/zinc/92/10/33/1037921033.db2.gz ZGZJIJROBQNUGC-FZKQIMNGSA-N 2 0 345.874 4.067 20 0 EIADRP CSC1(C[NH2+][C@H](C)c2ccc(CC(C)C)cc2)CC[NH+](C)CC1 ZINC000574085914 1037923896 /nfs/dbraw/zinc/92/38/96/1037923896.db2.gz IWQCVEFTUPSWNF-QGZVFWFLSA-N 2 0 334.573 4.363 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000423056246 1037923967 /nfs/dbraw/zinc/92/39/67/1037923967.db2.gz XEDYSUKTZDRXLB-MEDUHNTESA-N 2 0 343.284 4.146 20 0 EIADRP FC(F)(F)[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)c1ccccc1 ZINC000423067190 1037928314 /nfs/dbraw/zinc/92/83/14/1037928314.db2.gz YVEWCODUYFUTFN-BRSBDYLESA-N 2 0 340.433 4.233 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000423063697 1037930432 /nfs/dbraw/zinc/93/04/32/1037930432.db2.gz XGUHLNUAGUTHKL-IXDOHACOSA-N 2 0 326.406 4.024 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@@H](Cc1ccccc1)C(C)C ZINC000423076754 1037942636 /nfs/dbraw/zinc/94/26/36/1037942636.db2.gz ZPWIFXYKNHDVQF-VQIMIIECSA-N 2 0 325.500 4.014 20 0 EIADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000423092032 1037952681 /nfs/dbraw/zinc/95/26/81/1037952681.db2.gz AGAWQGSOEJUFCY-QSPRXWTASA-N 2 0 326.406 4.201 20 0 EIADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000423096955 1037953342 /nfs/dbraw/zinc/95/33/42/1037953342.db2.gz QDQQPIQVEYPUSB-OTRWWLKZSA-N 2 0 326.406 4.059 20 0 EIADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@H]1CC[C@@H](c2ccccc2F)C1 ZINC000423097627 1037960139 /nfs/dbraw/zinc/96/01/39/1037960139.db2.gz QXHVHTRDELUGMF-DKXUYOFUSA-N 2 0 326.459 4.010 20 0 EIADRP Cc1ccccc1[C@H]1C[C@H]([NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423106923 1037980927 /nfs/dbraw/zinc/98/09/27/1037980927.db2.gz RSEYBTJBHDUMIO-ZVEOBBNSSA-N 2 0 348.490 4.087 20 0 EIADRP FC(F)(F)c1cccc([C@H]([NH2+][C@H]2CCC[NH2+]CC2)C2CCC2)c1 ZINC000423107102 1037983357 /nfs/dbraw/zinc/98/33/57/1037983357.db2.gz PGOSBYKHDLFFOF-DLBZAZTESA-N 2 0 326.406 4.278 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000423111466 1037991287 /nfs/dbraw/zinc/99/12/87/1037991287.db2.gz WAEPCVJJLNHABQ-MLGOLLRUSA-N 2 0 330.394 4.143 20 0 EIADRP Fc1ccc([C@H](CCSc2ccccc2)[NH2+]C2CC[NH2+]CC2)cc1 ZINC000423195202 1038050745 /nfs/dbraw/zinc/05/07/45/1038050745.db2.gz YUIPSOHGVGXKLI-FQEVSTJZSA-N 2 0 344.499 4.391 20 0 EIADRP Brc1ccc2c(c1)CCCC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423214431 1038059700 /nfs/dbraw/zinc/05/97/00/1038059700.db2.gz MMSOAJHEAWDAAB-IXEWLPCDSA-N 2 0 349.316 4.089 20 0 EIADRP C[N@@H+](Cc1ccc(OCc2ccccc2)cc1)C[C@@H]1CCC[NH+](C)C1 ZINC000607358217 1038080245 /nfs/dbraw/zinc/08/02/45/1038080245.db2.gz RMRAEZMZAVFTPA-OAQYLSRUSA-N 2 0 338.495 4.039 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc2ccccc2c1OC(F)F ZINC000423248247 1038081420 /nfs/dbraw/zinc/08/14/20/1038081420.db2.gz MTLOIUHFQBFZOR-UONOGXRCSA-N 2 0 334.410 4.091 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]CC[C@H]3CCC[NH2+]C3)cs2)cs1 ZINC000423260769 1038089732 /nfs/dbraw/zinc/08/97/32/1038089732.db2.gz QQVIPDSBCBXFJY-TZMCWYRMSA-N 2 0 335.542 4.220 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2cccc3c2OC(C)(C)C3)C1 ZINC000606469275 1038090883 /nfs/dbraw/zinc/09/08/83/1038090883.db2.gz FHBXMVFUNYHYOV-QGZVFWFLSA-N 2 0 330.516 4.002 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)cc1 ZINC000423288929 1038093245 /nfs/dbraw/zinc/09/32/45/1038093245.db2.gz AAUDJRCGKOJMEP-ACJLOTCBSA-N 2 0 330.859 4.363 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423290811 1038095139 /nfs/dbraw/zinc/09/51/39/1038095139.db2.gz FODDJEPMBCTEFR-HZPDHXFCSA-N 2 0 334.467 4.051 20 0 EIADRP C[C@@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc(SCC(F)F)cc1 ZINC000423319199 1038115936 /nfs/dbraw/zinc/11/59/36/1038115936.db2.gz DDDQROOXXRIYOK-CXAGYDPISA-N 2 0 328.472 4.084 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423323035 1038136479 /nfs/dbraw/zinc/13/64/79/1038136479.db2.gz HYDGUIXYIYSBMG-CQSZACIVSA-N 2 0 328.422 4.006 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCCc3cc(N)ccc32)cc1 ZINC000423344726 1038138076 /nfs/dbraw/zinc/13/80/76/1038138076.db2.gz FMNZFCLQCZPLAZ-OYHNWAKOSA-N 2 0 346.478 4.491 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423327684 1038139173 /nfs/dbraw/zinc/13/91/73/1038139173.db2.gz LPAJFQHBNIZFTF-FOIQADDNSA-N 2 0 343.540 4.083 20 0 EIADRP [NH3+]C1(C[NH2+]C2CCC(c3cccc(C(F)(F)F)c3)CC2)CCC1 ZINC000423326382 1038141180 /nfs/dbraw/zinc/14/11/80/1038141180.db2.gz METJMCMMMYPPKX-UHFFFAOYSA-N 2 0 326.406 4.203 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423329049 1038143827 /nfs/dbraw/zinc/14/38/27/1038143827.db2.gz DULPDPXEKBHJIQ-IERDGZPVSA-N 2 0 327.516 4.203 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]C[C@]3(C)CCC[NH2+]C3)cs2)cs1 ZINC000423339449 1038147153 /nfs/dbraw/zinc/14/71/53/1038147153.db2.gz VBVMKIWYFXSYFQ-SJKOYZFVSA-N 2 0 335.542 4.220 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]C[C@@]3(C)CCC[NH2+]C3)cs2)cs1 ZINC000423339447 1038148078 /nfs/dbraw/zinc/14/80/78/1038148078.db2.gz VBVMKIWYFXSYFQ-SJCJKPOMSA-N 2 0 335.542 4.220 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423337256 1038149582 /nfs/dbraw/zinc/14/95/82/1038149582.db2.gz UBIRZYYLTVSTJD-AWEZNQCLSA-N 2 0 329.513 4.159 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]C[C@@]3(C)CCC[NH2+]C3)cs2)cs1 ZINC000423339445 1038149896 /nfs/dbraw/zinc/14/98/96/1038149896.db2.gz VBVMKIWYFXSYFQ-PXAZEXFGSA-N 2 0 335.542 4.220 20 0 EIADRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc2ccccc2c1OC(F)F ZINC000423341900 1038156570 /nfs/dbraw/zinc/15/65/70/1038156570.db2.gz KOCKZJBVSIKKEJ-CYBMUJFWSA-N 2 0 332.394 4.012 20 0 EIADRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc2ccccc2c1OC(F)F ZINC000423341902 1038156850 /nfs/dbraw/zinc/15/68/50/1038156850.db2.gz KOCKZJBVSIKKEJ-ZDUSSCGKSA-N 2 0 332.394 4.012 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+][C@@H](C)C2)cc1OCCC ZINC000423363550 1038175196 /nfs/dbraw/zinc/17/51/96/1038175196.db2.gz AOKZDUYVNAJPGT-XYJFISCASA-N 2 0 334.504 4.055 20 0 EIADRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(-c2c(F)cccc2F)cc1 ZINC000423365667 1038183803 /nfs/dbraw/zinc/18/38/03/1038183803.db2.gz ZYUQEGZLLLDPSH-CQSZACIVSA-N 2 0 328.406 4.202 20 0 EIADRP C[C@@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423368690 1038186754 /nfs/dbraw/zinc/18/67/54/1038186754.db2.gz FERGPVLGUXAWBC-QINHECLXSA-N 2 0 342.458 4.196 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)[C@H](C)c1nc2ccccc2s1 ZINC000423375984 1038189816 /nfs/dbraw/zinc/18/98/16/1038189816.db2.gz IZBIUUGIOWINMV-UONOGXRCSA-N 2 0 337.492 4.181 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC[NH2+]1 ZINC000423385836 1038194918 /nfs/dbraw/zinc/19/49/18/1038194918.db2.gz RCCHAWSARPKDGS-YYQUZTFQSA-N 2 0 326.406 4.072 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2ccccc2Cl)c2ccsc2)CC[NH2+]1 ZINC000423393605 1038198369 /nfs/dbraw/zinc/19/83/69/1038198369.db2.gz YZJWHDYMABKGPC-RPVQJOFSSA-N 2 0 334.916 4.415 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(Cl)ccc1OC ZINC000423385961 1038198758 /nfs/dbraw/zinc/19/87/58/1038198758.db2.gz LNOUCNWBJIEXLW-SFHVURJKSA-N 2 0 330.859 4.193 20 0 EIADRP c1cc(C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCCC4)cc2c1C[NH2+]C2 ZINC000423390641 1038199525 /nfs/dbraw/zinc/19/95/25/1038199525.db2.gz PARCWPZPOSKXJY-JOCHJYFZSA-N 2 0 348.490 4.172 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000423405604 1038215236 /nfs/dbraw/zinc/21/52/36/1038215236.db2.gz YCYKHMIYOMEPSR-UVBJJODRSA-N 2 0 333.476 4.178 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423405602 1038216221 /nfs/dbraw/zinc/21/62/21/1038216221.db2.gz YCYKHMIYOMEPSR-IUIKQTSFSA-N 2 0 333.476 4.178 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423445360 1038224540 /nfs/dbraw/zinc/22/45/40/1038224540.db2.gz RVJKJCBOISHZML-DOPJRALCSA-N 2 0 341.524 4.157 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccc(Oc2ccccc2)cn1 ZINC000423427409 1038231031 /nfs/dbraw/zinc/23/10/31/1038231031.db2.gz QETSQCSFWQJGAS-KZNAEPCWSA-N 2 0 339.483 4.290 20 0 EIADRP Cc1ccccc1COc1ccc([C@@H](C)[NH2+][C@H](C)CCC[NH3+])cc1 ZINC000423450519 1038231334 /nfs/dbraw/zinc/23/13/34/1038231334.db2.gz HJSSKROCIVEUQC-QZTJIDSGSA-N 2 0 326.484 4.352 20 0 EIADRP CC(C)Oc1ccc([C@@H](C)[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)cc1Cl ZINC000423435002 1038235835 /nfs/dbraw/zinc/23/58/35/1038235835.db2.gz LCNOAQUNARAJMR-RPVQJOFSSA-N 2 0 336.907 4.166 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1ccccc1Br ZINC000423461583 1038240098 /nfs/dbraw/zinc/24/00/98/1038240098.db2.gz SYDZGXLSRIDLPS-KSSFIOAISA-N 2 0 347.300 4.256 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000423459228 1038240814 /nfs/dbraw/zinc/24/08/14/1038240814.db2.gz LAVJOJSKAIMMGH-QEORTHHSSA-N 2 0 347.503 4.426 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000423463914 1038241986 /nfs/dbraw/zinc/24/19/86/1038241986.db2.gz GAGATCUMBBFVHE-UKPHBRMFSA-N 2 0 328.422 4.134 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H](c2ccc(Br)s2)C2CC2)C1 ZINC000423465287 1038242588 /nfs/dbraw/zinc/24/25/88/1038242588.db2.gz HOQGAPGVQPHXBK-NVBFEUDRSA-N 2 0 343.334 4.069 20 0 EIADRP CCOc1ccc([C@H](CC)[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)cc1OCC ZINC000423464847 1038242952 /nfs/dbraw/zinc/24/29/52/1038242952.db2.gz RGGOQUNVPYKWGB-NJAFHUGGSA-N 2 0 334.504 4.042 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000423467489 1038245543 /nfs/dbraw/zinc/24/55/43/1038245543.db2.gz JBSWICPTIYOCIV-NZPGVSJUSA-N 2 0 340.433 4.449 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1 ZINC000423478671 1038248992 /nfs/dbraw/zinc/24/89/92/1038248992.db2.gz UISICEJBQGENPA-GZRFBZBPSA-N 2 0 330.422 4.009 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)sc1Br ZINC000423478381 1038250249 /nfs/dbraw/zinc/25/02/49/1038250249.db2.gz LDUDOLWHLCPGMG-VXGBXAGGSA-N 2 0 331.323 4.002 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423479717 1038253186 /nfs/dbraw/zinc/25/31/86/1038253186.db2.gz MOJRHFMIZZTCHS-SUMWQHHRSA-N 2 0 347.503 4.440 20 0 EIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccccc1OC(F)F ZINC000423497349 1038254545 /nfs/dbraw/zinc/25/45/45/1038254545.db2.gz GQSRXIZLNHLLKX-YOEHRIQHSA-N 2 0 334.410 4.419 20 0 EIADRP CCc1nc2c(s1)[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)CCC2 ZINC000423500565 1038255847 /nfs/dbraw/zinc/25/58/47/1038255847.db2.gz KMCWPMXQVREISF-CVEARBPZSA-N 2 0 329.513 4.153 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423505352 1038258107 /nfs/dbraw/zinc/25/81/07/1038258107.db2.gz HLXCVGTWRHHQHU-XUFNMVPLSA-N 2 0 338.495 4.257 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423486817 1038259894 /nfs/dbraw/zinc/25/98/94/1038259894.db2.gz SUXWRPAHIRKYRB-SJORKVTESA-N 2 0 327.516 4.346 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000423491976 1038264875 /nfs/dbraw/zinc/26/48/75/1038264875.db2.gz LAUNYBNRFZGMPV-UBHSHLNASA-N 2 0 333.476 4.036 20 0 EIADRP C[C@@H]([NH2+]CCC[NH2+]C1CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000423531278 1038266275 /nfs/dbraw/zinc/26/62/75/1038266275.db2.gz SGKHBDLGQAANIQ-GFCCVEGCSA-N 2 0 332.435 4.134 20 0 EIADRP COc1ccc([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)c(C)c1OC ZINC000423519689 1038272973 /nfs/dbraw/zinc/27/29/73/1038272973.db2.gz QDLSNRRWVMCUTF-VQIMIIECSA-N 2 0 342.483 4.143 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccc(F)cc2)c2ccccc2Cl)C1 ZINC000423519998 1038273602 /nfs/dbraw/zinc/27/36/02/1038273602.db2.gz VTUJVVITMJSKSM-NRXGSXMXSA-N 2 0 332.850 4.286 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000423519160 1038274831 /nfs/dbraw/zinc/27/48/31/1038274831.db2.gz VGUOCQWJXUNJPP-NQZOLGFYSA-N 2 0 326.406 4.059 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423539940 1038285659 /nfs/dbraw/zinc/28/56/59/1038285659.db2.gz JBVGCTAWOYZGGG-VIPLHTEESA-N 2 0 328.500 4.001 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423538692 1038287133 /nfs/dbraw/zinc/28/71/33/1038287133.db2.gz GVTWYVLFRCABNR-OKDNKWQNSA-N 2 0 341.524 4.157 20 0 EIADRP Cc1cccc([C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c2cccc(F)c2)c1 ZINC000423548854 1038292578 /nfs/dbraw/zinc/29/25/78/1038292578.db2.gz MYNQAIGNCXJWNG-PSBKLILYSA-N 2 0 338.470 4.201 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000490070174 1038331990 /nfs/dbraw/zinc/33/19/90/1038331990.db2.gz WRCXGXISGHLADO-IRXDYDNUSA-N 2 0 347.572 4.076 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)s2)C1 ZINC000594786051 1038401801 /nfs/dbraw/zinc/40/18/01/1038401801.db2.gz ISDGXNRSXYNHSL-AWEZNQCLSA-N 2 0 334.916 4.500 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCCc3ccc(C)cc32)[C@H](C)C1 ZINC000490269970 1038417331 /nfs/dbraw/zinc/41/73/31/1038417331.db2.gz FJHMJMMQTCHPLV-COPCDDAFSA-N 2 0 344.543 4.099 20 0 EIADRP Cc1c(Cl)c(C[N@H+]2CC3(C[C@@H]2C)CC[NH2+]CC3)nc2ccccc12 ZINC000424289143 1038768858 /nfs/dbraw/zinc/76/88/58/1038768858.db2.gz LTBVRURZFFSRAT-AWEZNQCLSA-N 2 0 343.902 4.161 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H](CC2CCOCC2)c2ccc(F)cc2)CC1 ZINC001168311883 1038781382 /nfs/dbraw/zinc/78/13/82/1038781382.db2.gz CZPLGIUETJPTMB-CBNMVNINSA-N 2 0 348.506 4.146 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H]3CCO[C@H](C(C)(C)C)C3)CC2)C1 ZINC000539064331 1038808848 /nfs/dbraw/zinc/80/88/48/1038808848.db2.gz AJXYNXNAEJYTCX-GTAWCEEGSA-N 2 0 336.564 4.213 20 0 EIADRP C[NH+](C)C1CCC([NH+]2CCC(Oc3ccc(Cl)cc3)CC2)CC1 ZINC001168314501 1038812168 /nfs/dbraw/zinc/81/21/68/1038812168.db2.gz LZSSUURILZSGDD-UHFFFAOYSA-N 2 0 336.907 4.056 20 0 EIADRP Cc1cccc2c1CC[C@H]2[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000539082141 1038828430 /nfs/dbraw/zinc/82/84/30/1038828430.db2.gz LWJGXWRRGFMAKB-VGOFRKELSA-N 2 0 338.495 4.274 20 0 EIADRP C[NH+](C)C1CCC([N@@H+]2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)CC1 ZINC001168324859 1038873857 /nfs/dbraw/zinc/87/38/57/1038873857.db2.gz YQRAATMDXKTNIR-FAEJEUNOSA-N 2 0 340.433 4.368 20 0 EIADRP CC[N@@H+](Cc1ccc(F)c(C)c1)CC1CCN(c2ccccn2)CC1 ZINC000537615689 1038899077 /nfs/dbraw/zinc/89/90/77/1038899077.db2.gz AKJCMGPCKYQIJE-UHFFFAOYSA-N 2 0 341.474 4.268 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(OCC(F)(F)F)cc2)C1 ZINC000481024740 1038963808 /nfs/dbraw/zinc/96/38/08/1038963808.db2.gz OQTDSOJOKCVWHG-HUUCEWRRSA-N 2 0 344.421 4.010 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000481045404 1038978715 /nfs/dbraw/zinc/97/87/15/1038978715.db2.gz ZWZPJRXBLYNDNA-SJORKVTESA-N 2 0 344.474 4.048 20 0 EIADRP CC[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cc(F)ccc1F ZINC000089215404 1039022784 /nfs/dbraw/zinc/02/27/84/1039022784.db2.gz UHCHCLNILKXGDP-FQEVSTJZSA-N 2 0 345.437 4.317 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(-c3ccco3)cc2F)[C@H]2CCC[C@H]21 ZINC000552057359 1039075476 /nfs/dbraw/zinc/07/54/76/1039075476.db2.gz QDNPBNQPRRABEN-NZSAHSFTSA-N 2 0 328.431 4.048 20 0 EIADRP CC1(C)CCCC[C@H]1[NH2+]CC1(C[NH2+][C@@H]2CCCCC2(C)C)COC1 ZINC000481183689 1039085214 /nfs/dbraw/zinc/08/52/14/1039085214.db2.gz RRXUKKKGBMJFCR-QZTJIDSGSA-N 2 0 336.564 4.120 20 0 EIADRP CC1(C)CCCC[C@H]1[NH2+]CC1(C[NH2+][C@H]2CCCCC2(C)C)COC1 ZINC000481183688 1039085674 /nfs/dbraw/zinc/08/56/74/1039085674.db2.gz RRXUKKKGBMJFCR-HDICACEKSA-N 2 0 336.564 4.120 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1cccc(OC)c1 ZINC000120447867 1039108432 /nfs/dbraw/zinc/10/84/32/1039108432.db2.gz DBWLVLLDQQCKLW-QGZVFWFLSA-N 2 0 326.484 4.388 20 0 EIADRP Cc1nc(C(C)C)ccc1C[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000555422767 1039178783 /nfs/dbraw/zinc/17/87/83/1039178783.db2.gz FOGQAIWSMYBRLQ-LPHOPBHVSA-N 2 0 329.532 4.256 20 0 EIADRP c1ccc(CSCCC[NH+]2CCC(Nc3ccccn3)CC2)cc1 ZINC000534173023 1039193677 /nfs/dbraw/zinc/19/36/77/1039193677.db2.gz SRCQHSUKBXLYLK-UHFFFAOYSA-N 2 0 341.524 4.281 20 0 EIADRP FC(F)(F)c1ccc([C@H]2CCC[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000414829712 1039222211 /nfs/dbraw/zinc/22/22/11/1039222211.db2.gz NZMDDXRWOHFIGE-ZFHLEULCSA-N 2 0 338.417 4.214 20 0 EIADRP CCC[N@H+](C)C[C@H]1CC[NH+]([C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000478000693 1039296895 /nfs/dbraw/zinc/29/68/95/1039296895.db2.gz IQXGHXSNVQBBMJ-LSDHHAIUSA-N 2 0 328.422 4.430 20 0 EIADRP CC[C@@H]([NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1)c1c(C)noc1C ZINC000090886762 1039317949 /nfs/dbraw/zinc/31/79/49/1039317949.db2.gz GPHUMWFGSRCGHX-AUUYWEPGSA-N 2 0 345.487 4.034 20 0 EIADRP C[C@H]1C[C@H](N(C)Cc2ccc(Cl)o2)CC[N@@H+]1Cc1ccccc1 ZINC000552256655 1039318783 /nfs/dbraw/zinc/31/87/83/1039318783.db2.gz WJTLDRFBMCGRFR-DOTOQJQBSA-N 2 0 332.875 4.418 20 0 EIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](C[C@@H]3CCCC(F)(F)C3)C2)CC1 ZINC000513882638 1039344853 /nfs/dbraw/zinc/34/48/53/1039344853.db2.gz MYLNQFIQCCADMP-QZTJIDSGSA-N 2 0 328.491 4.256 20 0 EIADRP CC[NH+]1CCC([NH2+]Cc2ccc(Oc3ccc(F)cc3)cc2)CC1 ZINC000552303813 1039358786 /nfs/dbraw/zinc/35/87/86/1039358786.db2.gz LLYBNZSEFGRDPZ-UHFFFAOYSA-N 2 0 328.431 4.192 20 0 EIADRP CO[C@@H]1C[C@@H](c2ccccc2)CC[C@H]1[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000552322729 1039380686 /nfs/dbraw/zinc/38/06/86/1039380686.db2.gz XJKASLZCPSSSOV-CEWLAPEOSA-N 2 0 344.543 4.190 20 0 EIADRP C[N@@H+]1CCC[C@@]2(CC[NH+](CCCSc3ccccc3Cl)C2)C1 ZINC000555598317 1039424967 /nfs/dbraw/zinc/42/49/67/1039424967.db2.gz XTCHPSXKTQDHJU-GOSISDBHSA-N 2 0 338.948 4.240 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2cccc(OC(F)F)c2)CC1 ZINC000121713159 1039440380 /nfs/dbraw/zinc/44/03/80/1039440380.db2.gz JDKRSCJMCXEXLT-AWEZNQCLSA-N 2 0 326.431 4.061 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000121892799 1039528651 /nfs/dbraw/zinc/52/86/51/1039528651.db2.gz MIZZYFSLPUJHNR-UZLBHIALSA-N 2 0 328.500 4.098 20 0 EIADRP Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cn1 ZINC000514097967 1039631135 /nfs/dbraw/zinc/63/11/35/1039631135.db2.gz CHLSOGABQDBQPF-YTFSRNRJSA-N 2 0 349.522 4.170 20 0 EIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000481669059 1039702085 /nfs/dbraw/zinc/70/20/85/1039702085.db2.gz KDMHJYXILWLHCI-KBMXLJTQSA-N 2 0 328.422 4.099 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCOc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000429781290 1039733962 /nfs/dbraw/zinc/73/39/62/1039733962.db2.gz SLHKRVDIHLAAPB-XJKSGUPXSA-N 2 0 345.314 4.034 20 0 EIADRP Fc1ccc2c(c1)CC[C@H]2[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000481717820 1039773953 /nfs/dbraw/zinc/77/39/53/1039773953.db2.gz LLNZWECLGUZBIC-HXUWFJFHSA-N 2 0 344.499 4.376 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(C)c(C)c2)[C@H](C)C1 ZINC000481734910 1039800124 /nfs/dbraw/zinc/80/01/24/1039800124.db2.gz XPIFMUXVOPGPFB-SBHAEUEKSA-N 2 0 332.532 4.091 20 0 EIADRP c1cc2c(cccc2C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)[nH]1 ZINC000537651066 1039841297 /nfs/dbraw/zinc/84/12/97/1039841297.db2.gz UQNJXZMASRORPK-UHFFFAOYSA-N 2 0 325.500 4.256 20 0 EIADRP Cc1ccccc1CCC[NH+]1CCC(c2ncc3n2CCCC3)CC1 ZINC000434746155 1039855746 /nfs/dbraw/zinc/85/57/46/1039855746.db2.gz IFWDREUMAPSISB-UHFFFAOYSA-N 2 0 337.511 4.340 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CCC[C@H]2[NH2+][C@H]2CC23CC[NH2+]CC3)cc1 ZINC000666954261 1039861291 /nfs/dbraw/zinc/86/12/91/1039861291.db2.gz SUDJWKZZLCXDIX-BBWFWOEESA-N 2 0 338.417 4.073 20 0 EIADRP CN1CC[C@@H]([NH2+]CCc2ccc3ccccc3n2)C[C@H]1c1ccccc1 ZINC000551029283 1039886767 /nfs/dbraw/zinc/88/67/67/1039886767.db2.gz CBIANMYTINVFEZ-GGAORHGYSA-N 2 0 345.490 4.202 20 0 EIADRP c1ccc(C[NH+]2CCC(C[NH2+][C@H](c3cccnc3)C3CCC3)CC2)cc1 ZINC000481922452 1039898764 /nfs/dbraw/zinc/89/87/64/1039898764.db2.gz ORBIBEPFSVISRL-QHCPKHFHSA-N 2 0 349.522 4.425 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1ccc(SCC(F)(F)F)cc1 ZINC000481959270 1039910792 /nfs/dbraw/zinc/91/07/92/1039910792.db2.gz LGFASBVGDLLKOE-QWHCGFSZSA-N 2 0 334.451 4.332 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)c1cccc(OCc2ccccc2)c1 ZINC000481957764 1039911929 /nfs/dbraw/zinc/91/19/29/1039911929.db2.gz MVWZNIIRFYYGQJ-QZTJIDSGSA-N 2 0 326.484 4.256 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+](C)C)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000481975021 1039923767 /nfs/dbraw/zinc/92/37/67/1039923767.db2.gz QGWIVHRRTXPUQS-OLZOCXBDSA-N 2 0 333.303 4.081 20 0 EIADRP Cc1cc([C@H]([NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)C2CC2)ccc1F ZINC000553104204 1039991564 /nfs/dbraw/zinc/99/15/64/1039991564.db2.gz OXXJKYSYFWTFKY-LLGFUMIMSA-N 2 0 348.506 4.064 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC(C)(C)c1ccc(Cl)c(Cl)c1 ZINC000482137203 1040030917 /nfs/dbraw/zinc/03/09/17/1040030917.db2.gz ILYPSMHDXFWQAX-WBMJQRKESA-N 2 0 329.315 4.201 20 0 EIADRP C[C@@H]([NH2+]CCc1ccc2[nH]ccc2c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000514633510 1040068098 /nfs/dbraw/zinc/06/80/98/1040068098.db2.gz GARKPRQOZDCAPG-GCJKJVERSA-N 2 0 347.506 4.211 20 0 EIADRP Cc1cccnc1C(C)(C)C[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1 ZINC000514637713 1040074799 /nfs/dbraw/zinc/07/47/99/1040074799.db2.gz SLUWKGAHGLSIGF-XLIONFOSSA-N 2 0 343.559 4.300 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccc(Br)cc1 ZINC000551262804 1040121012 /nfs/dbraw/zinc/12/10/12/1040121012.db2.gz HVLVATWOWRXJSB-OAHLLOKOSA-N 2 0 339.321 4.366 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]CCC2CC[NH+](C)CC2)cc1F ZINC000482358705 1040197532 /nfs/dbraw/zinc/19/75/32/1040197532.db2.gz NGKIQFJMPDBBNI-ICSRJNTNSA-N 2 0 348.506 4.182 20 0 EIADRP C[C@H]([NH2+]CCCC[NH3+])c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000315019118 1040239299 /nfs/dbraw/zinc/23/92/99/1040239299.db2.gz VKPAPNFUKZLLQS-VIFPVBQESA-N 2 0 328.300 4.114 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cc(F)cc(F)c1 ZINC000162921962 1040241721 /nfs/dbraw/zinc/24/17/21/1040241721.db2.gz VYAVPLGTSOGZQX-OAHLLOKOSA-N 2 0 330.422 4.411 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cccs1 ZINC000482443009 1040251428 /nfs/dbraw/zinc/25/14/28/1040251428.db2.gz FCYNTBQBECHXDS-OALUTQOASA-N 2 0 328.525 4.353 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)s1 ZINC000482462793 1040272838 /nfs/dbraw/zinc/27/28/38/1040272838.db2.gz XMIQLEIDEPGICQ-PKOBYXMFSA-N 2 0 328.525 4.272 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(OCC)c(OCC)c2)CC1 ZINC000482509977 1040308280 /nfs/dbraw/zinc/30/82/80/1040308280.db2.gz LZTGYYRRQQKCBQ-KRWDZBQOSA-N 2 0 348.531 4.257 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)c1ccc(C2CCCCC2)cc1)N1CC[NH+](C)CC1 ZINC000482555428 1040357758 /nfs/dbraw/zinc/35/77/58/1040357758.db2.gz RCJGLSDLDBBLEY-MOPGFXCFSA-N 2 0 343.559 4.021 20 0 EIADRP COC1CCC(C)(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000479447866 1040376978 /nfs/dbraw/zinc/37/69/78/1040376978.db2.gz DRMJOMMKMZWRPQ-YOLZPYMBSA-N 2 0 344.543 4.082 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cc(C)cc(C)c2)[C@H](C)C1 ZINC000482647707 1040408206 /nfs/dbraw/zinc/40/82/06/1040408206.db2.gz BMAQCEUHBIJGKV-SBHAEUEKSA-N 2 0 332.532 4.091 20 0 EIADRP c1ccc(COc2cccc(C[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)c2)cc1 ZINC000666998400 1040421633 /nfs/dbraw/zinc/42/16/33/1040421633.db2.gz RFKWPFVFXKGTJZ-HXUWFJFHSA-N 2 0 336.479 4.030 20 0 EIADRP CCC1(Cc2ccccc2)CC[NH+]([C@H]2CC[N@@H+]3CCC[C@@H]3C2)CC1 ZINC000479540573 1040446227 /nfs/dbraw/zinc/44/62/27/1040446227.db2.gz GHACOGIEPKFVBY-RTWAWAEBSA-N 2 0 326.528 4.348 20 0 EIADRP Cc1cc(Cl)cc2c1OCCC[C@H]2NC1CC([NH+]2CCCCC2)C1 ZINC000479546479 1040450156 /nfs/dbraw/zinc/45/01/56/1040450156.db2.gz UMCCHBPHIKLURE-FAFZWHIHSA-N 2 0 348.918 4.469 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH+]2CC[C@]3(C2)CCC[N@@H+](C)C3)cc1 ZINC000668194369 1040644781 /nfs/dbraw/zinc/64/47/81/1040644781.db2.gz GMMAYUGHHPIXDZ-HXUWFJFHSA-N 2 0 341.524 4.036 20 0 EIADRP CSC1(C[NH2+][C@H]2CCC[C@@H]2CCc2ccccc2)CC[NH+](C)CC1 ZINC000515353217 1040673571 /nfs/dbraw/zinc/67/35/71/1040673571.db2.gz GNIBTGBYRPKXKY-UXHICEINSA-N 2 0 346.584 4.205 20 0 EIADRP COc1cc([C@@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)ccc1SC ZINC000483204028 1040758689 /nfs/dbraw/zinc/75/86/89/1040758689.db2.gz RXSIJQNSJBXHRJ-RDTXWAMCSA-N 2 0 338.561 4.434 20 0 EIADRP C[C@@H]([NH2+]CCOC1CCCCCC1)c1cccc(OCC[NH+](C)C)c1 ZINC000483191979 1040765081 /nfs/dbraw/zinc/76/50/81/1040765081.db2.gz FYMHICCKARUOIL-GOSISDBHSA-N 2 0 348.531 4.017 20 0 EIADRP Cc1ccc(C[C@@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)s1 ZINC000483312904 1040817346 /nfs/dbraw/zinc/81/73/46/1040817346.db2.gz WMHFHLAZUJDAEE-NVXWUHKLSA-N 2 0 346.540 4.279 20 0 EIADRP Cc1cn2c(n1)[C@H](C[NH2+][C@@H](C)c1ccc(OCC(C)C)cc1)CCC2 ZINC000483444489 1040861561 /nfs/dbraw/zinc/86/15/61/1040861561.db2.gz FTLSARLIGQGWIN-HKUYNNGSSA-N 2 0 341.499 4.455 20 0 EIADRP Cc1ccncc1[C@H](C)[NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C ZINC000537881516 1040869009 /nfs/dbraw/zinc/86/90/09/1040869009.db2.gz NZHAJUAUGYBCJP-FHWLQOOXSA-N 2 0 337.511 4.197 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCc1ccc(Oc2ccc(F)cc2)cc1 ZINC000537938879 1040900477 /nfs/dbraw/zinc/90/04/77/1040900477.db2.gz UUEVICWWFTXIIJ-KKSFZXQISA-N 2 0 342.458 4.090 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1cncs1 ZINC000537941598 1040906179 /nfs/dbraw/zinc/90/61/79/1040906179.db2.gz XLEMBIUWVDPEBJ-RYRKJORJSA-N 2 0 329.513 4.094 20 0 EIADRP COc1cc2c(NC3CC[NH+](C4CCCC4)CC3)cc[nH+]c2cc1F ZINC000480069939 1040914224 /nfs/dbraw/zinc/91/42/24/1040914224.db2.gz NMCNSRBUASNAGN-UHFFFAOYSA-N 2 0 343.446 4.201 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCN2CC)cc1OC ZINC000480082861 1040937581 /nfs/dbraw/zinc/93/75/81/1040937581.db2.gz GTIQOVXBTMSKJN-AEFFLSMTSA-N 2 0 334.504 4.009 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]([C@H]3CCOC3)C2)cc1 ZINC000462791415 1040940177 /nfs/dbraw/zinc/94/01/77/1040940177.db2.gz PBIFTTZOTRKBHA-BHIFYINESA-N 2 0 344.543 4.213 20 0 EIADRP C[C@@H]1C[C@@H](N[C@H](COCc2ccccc2)c2ccccc2)CC[N@@H+]1C ZINC000537980877 1040951203 /nfs/dbraw/zinc/95/12/03/1040951203.db2.gz OIJARRVZJYUPQN-BVYCBKJFSA-N 2 0 338.495 4.017 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+]CCC2CC[NH+](CC)CC2)cc1OCC ZINC000483713150 1040971410 /nfs/dbraw/zinc/97/14/10/1040971410.db2.gz NSNWZHKEEANLJF-KRWDZBQOSA-N 2 0 348.531 4.257 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)Cc1cccs1 ZINC000483741955 1040994548 /nfs/dbraw/zinc/99/45/48/1040994548.db2.gz INCJWKKDWFFFIJ-SJORKVTESA-N 2 0 346.540 4.218 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CC[C@H](c2ccccc2)C1 ZINC000436273523 1041045096 /nfs/dbraw/zinc/04/50/96/1041045096.db2.gz KALTWRXRZGUPOK-PZJWPPBQSA-N 2 0 338.495 4.053 20 0 EIADRP CC(C)[C@@H]([NH2+]CCC[NH+](C(C)C)C(C)C)c1ccc2[nH]c(=O)oc2c1 ZINC000538116681 1041047946 /nfs/dbraw/zinc/04/79/46/1041047946.db2.gz OQUSWLMFCCCTRQ-LJQANCHMSA-N 2 0 347.503 4.329 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@@H](c3ccccc3)C3CC3)C2)cc1 ZINC000538103101 1041058010 /nfs/dbraw/zinc/05/80/10/1041058010.db2.gz UCVDGXKNAXNMFA-OFNKIYASSA-N 2 0 334.507 4.292 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000436292873 1041059945 /nfs/dbraw/zinc/05/99/45/1041059945.db2.gz MCCJWVHHHLRDQQ-DUXKGJEZSA-N 2 0 338.495 4.224 20 0 EIADRP C[C@@H]([NH2+]CC1(c2ccccc2)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000480212272 1041084173 /nfs/dbraw/zinc/08/41/73/1041084173.db2.gz GAKOQMVJPIHLCA-GOSISDBHSA-N 2 0 338.495 4.009 20 0 EIADRP C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000480267480 1041141127 /nfs/dbraw/zinc/14/11/27/1041141127.db2.gz SCIHNVCCTQFTQF-YCRPNKLZSA-N 2 0 326.459 4.301 20 0 EIADRP Cc1ccc2c(c1)CC[C@H]2[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000540143045 1041165374 /nfs/dbraw/zinc/16/53/74/1041165374.db2.gz BZAPHNCSVUFNDJ-HTAPYJJXSA-N 2 0 338.495 4.274 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000484280793 1041184627 /nfs/dbraw/zinc/18/46/27/1041184627.db2.gz TXDAZEMWWUPJOA-TZMCWYRMSA-N 2 0 333.303 4.001 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)cc1F ZINC000484293325 1041197536 /nfs/dbraw/zinc/19/75/36/1041197536.db2.gz KOVMIUGLFWPEOA-INIZCTEOSA-N 2 0 336.495 4.243 20 0 EIADRP Cc1ccc(SC2(C[NH2+][C@H]3CC[N@@H+](C)C[C@H]3C)CCCC2)cc1 ZINC000484308114 1041204478 /nfs/dbraw/zinc/20/44/78/1041204478.db2.gz LYLMDENCGWLWEA-MJGOQNOKSA-N 2 0 332.557 4.330 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000540170832 1041214191 /nfs/dbraw/zinc/21/41/91/1041214191.db2.gz PQQFQAZQSDWNND-QRVBRYPASA-N 2 0 348.531 4.015 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]CCCCn1ccnc1 ZINC000554553018 1041237886 /nfs/dbraw/zinc/23/78/86/1041237886.db2.gz BAEUUJYONQESFT-NTCAYCPXSA-N 2 0 337.389 4.375 20 0 EIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCCC(C)(C)C)c1ccccc1O2 ZINC000538295098 1041245849 /nfs/dbraw/zinc/24/58/49/1041245849.db2.gz YIGOWHYRAUUDSO-GOSISDBHSA-N 2 0 330.516 4.391 20 0 EIADRP Clc1ccc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c(Cl)c1 ZINC000436480319 1041265213 /nfs/dbraw/zinc/26/52/13/1041265213.db2.gz AHPDCGNKRWJGFQ-UHFFFAOYSA-N 2 0 336.266 4.147 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(OC(F)(F)F)cc1 ZINC000484476812 1041270050 /nfs/dbraw/zinc/27/00/50/1041270050.db2.gz WPKQSXCAKRUKGY-CFVMTHIKSA-N 2 0 330.394 4.109 20 0 EIADRP Cc1cc(N2CCC(C[N@@H+](C)C(C)C)CC2)c2cc(F)ccc2[nH+]1 ZINC000540284639 1041341659 /nfs/dbraw/zinc/34/16/59/1041341659.db2.gz HACWWAYGKOYHOP-UHFFFAOYSA-N 2 0 329.463 4.239 20 0 EIADRP CC(C)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000540302936 1041354079 /nfs/dbraw/zinc/35/40/79/1041354079.db2.gz WMRLMJXLVNKPBE-WMLDXEAASA-N 2 0 328.422 4.334 20 0 EIADRP CC(C)(C[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12)C(F)(F)F ZINC000554722030 1041363948 /nfs/dbraw/zinc/36/39/48/1041363948.db2.gz DJVVFMKVCLMZRO-BRWVUGGUSA-N 2 0 340.433 4.075 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(C[NH+](C)C)c2)cc1OC ZINC000924796830 1041394355 /nfs/dbraw/zinc/39/43/55/1041394355.db2.gz DIAWULFSVSFOLK-HOTGVXAUSA-N 2 0 342.483 4.177 20 0 EIADRP CCc1nc2c(s1)[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)CCC2 ZINC000480612192 1041423447 /nfs/dbraw/zinc/42/34/47/1041423447.db2.gz OCCNKNBYHXUHJF-HOTGVXAUSA-N 2 0 335.561 4.185 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(F)cc1N(C)C ZINC000480638494 1041450333 /nfs/dbraw/zinc/45/03/33/1041450333.db2.gz IXZQRFUQUVQIIR-IRXDYDNUSA-N 2 0 335.511 4.197 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)C(F)(F)F ZINC000480668808 1041462172 /nfs/dbraw/zinc/46/21/72/1041462172.db2.gz WOZCBRVWDMKCSV-BZZMCLGOSA-N 2 0 340.433 4.075 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCc2c(F)cccc2F)CCN1Cc1ccccc1 ZINC000401998633 1041474438 /nfs/dbraw/zinc/47/44/38/1041474438.db2.gz DGDVMFGZWCGHSV-AEFFLSMTSA-N 2 0 344.449 4.150 20 0 EIADRP C[C@@H]([NH2+]C1(Cc2ccccc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000480692503 1041476605 /nfs/dbraw/zinc/47/66/05/1041476605.db2.gz ASDBOOZMTQCQNQ-KNQAVFIVSA-N 2 0 334.507 4.262 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2c[nH]nc2C(C)(C)C)CC1 ZINC000538721710 1041493108 /nfs/dbraw/zinc/49/31/08/1041493108.db2.gz YWYFATFWPYQESG-QGZVFWFLSA-N 2 0 346.563 4.184 20 0 EIADRP Cc1cccc(COc2ccc(C[NH2+][C@H]3CC[N@H+](C)[C@H](C)C3)cc2)c1 ZINC000480753978 1041508563 /nfs/dbraw/zinc/50/85/63/1041508563.db2.gz CPLQXMMXWSEYHZ-NQIIRXRSSA-N 2 0 338.495 4.146 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2c(OC)ccc3ccccc32)[C@@H](C)C1 ZINC000538738759 1041512954 /nfs/dbraw/zinc/51/29/54/1041512954.db2.gz XOMNFXNLWGXCPN-OXJNMPFZSA-N 2 0 326.484 4.011 20 0 EIADRP c1cc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc(-c2ccncc2)c1 ZINC000538799318 1041540077 /nfs/dbraw/zinc/54/00/77/1041540077.db2.gz YOXZFEVMKODDEY-JTHBVZDNSA-N 2 0 347.506 4.197 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000540708625 1041606360 /nfs/dbraw/zinc/60/63/60/1041606360.db2.gz ZMGCHYBLRFFWJO-QZTJIDSGSA-N 2 0 338.417 4.193 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000539040588 1041616896 /nfs/dbraw/zinc/61/68/96/1041616896.db2.gz DNZHJXOMVWBMAS-AOIWGVFYSA-N 2 0 341.474 4.172 20 0 EIADRP CC(C)[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000437076326 1041625386 /nfs/dbraw/zinc/62/53/86/1041625386.db2.gz OBFQGWJVJMLUFM-WMLDXEAASA-N 2 0 346.437 4.255 20 0 EIADRP [NH3+]CCCC[NH2+]Cc1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000414901202 1041757148 /nfs/dbraw/zinc/75/71/48/1041757148.db2.gz IRYDDOVKPGRDFT-UHFFFAOYSA-N 2 0 328.403 4.262 20 0 EIADRP CSC1(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CCC1 ZINC000516822418 1041774434 /nfs/dbraw/zinc/77/44/34/1041774434.db2.gz RHMOIXYPNLBTRD-PKOBYXMFSA-N 2 0 332.557 4.162 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc3c(cccc3F)[nH]2)CC1 ZINC000437577152 1041844789 /nfs/dbraw/zinc/84/47/89/1041844789.db2.gz HFPYZMMJHIFILB-UHFFFAOYSA-N 2 0 331.479 4.251 20 0 EIADRP CCCn1nc(C)c(C[NH+]2CCC(CCC[NH+](CC)CC)CC2)c1C ZINC000541244117 1041862809 /nfs/dbraw/zinc/86/28/09/1041862809.db2.gz VSIUWASWPCXQOM-UHFFFAOYSA-N 2 0 348.579 4.244 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C1(c2ccccc2)CCCC1 ZINC000541374601 1041917494 /nfs/dbraw/zinc/91/74/94/1041917494.db2.gz PGALQITUFZDWSE-UHFFFAOYSA-N 2 0 332.451 4.135 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCCOCc2ccccc2)C1 ZINC000541579330 1042014263 /nfs/dbraw/zinc/01/42/63/1042014263.db2.gz WQKWBZKFLLMJIS-IFMALSPDSA-N 2 0 344.543 4.180 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000425945127 1042033790 /nfs/dbraw/zinc/03/37/90/1042033790.db2.gz JOLZMWAQPTXENL-CHWSQXEVSA-N 2 0 335.492 4.106 20 0 EIADRP Fc1ccc2c(c1)CC[C@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001168438782 1042061306 /nfs/dbraw/zinc/06/13/06/1042061306.db2.gz ODZJDEQHKCYARD-SFTDATJTSA-N 2 0 330.491 4.023 20 0 EIADRP C[C@@H]1CCCC[C@@H]1OCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464847134 1042194380 /nfs/dbraw/zinc/19/43/80/1042194380.db2.gz UTUIURPIHCXRCE-FCEUIQTBSA-N 2 0 344.543 4.036 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C/C=C/c2ccc(OCc3ccccc3)cc2)CC[NH2+]1 ZINC000414962048 1042394565 /nfs/dbraw/zinc/39/45/65/1042394565.db2.gz ZMBHWQGZMHNHJL-HGGRVWGASA-N 2 0 336.479 4.009 20 0 EIADRP CCC[NH+]1CCC(C[NH2+]Cc2ccccc2OC2CCCC2)CC1 ZINC000518275404 1042448054 /nfs/dbraw/zinc/44/80/54/1042448054.db2.gz BHLFSOFQQOMKFA-UHFFFAOYSA-N 2 0 330.516 4.220 20 0 EIADRP FC(F)Oc1ccc2ccccc2c1C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414977361 1042476353 /nfs/dbraw/zinc/47/63/53/1042476353.db2.gz RIVKXBLADNVBEV-OAHLLOKOSA-N 2 0 334.410 4.063 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC(C)C)c(Cl)c2)[C@H](C)C1 ZINC000492335626 1042611474 /nfs/dbraw/zinc/61/14/74/1042611474.db2.gz SQMUEZOROOSWCW-CRAIPNDOSA-N 2 0 338.923 4.289 20 0 EIADRP Fc1ccc(CSCC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167964574 1042639408 /nfs/dbraw/zinc/63/94/08/1042639408.db2.gz SVQZWUFVVGPDHI-IHWFROFDSA-N 2 0 348.531 4.054 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ccc(Cl)c(F)c2)C1 ZINC000518763480 1042673857 /nfs/dbraw/zinc/67/38/57/1042673857.db2.gz OKRCHJVIQMWFRP-HUUCEWRRSA-N 2 0 326.887 4.327 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]CC2=Cc3ccccc3OC2)cc1 ZINC000518770258 1042685407 /nfs/dbraw/zinc/68/54/07/1042685407.db2.gz FVRNLOJCADOALG-UHFFFAOYSA-N 2 0 336.479 4.094 20 0 EIADRP C[C@H](CCc1ccsc1)[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000415005037 1042788138 /nfs/dbraw/zinc/78/81/38/1042788138.db2.gz OPBYEGCRVAZYDH-MOXGXCLJSA-N 2 0 346.515 4.191 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCN(C2CC2)[C@@H](c2ccccc2)C1)c1nccs1 ZINC000639046977 1042819225 /nfs/dbraw/zinc/81/92/25/1042819225.db2.gz YNXSJFAYBXCQKZ-SZVBFZGTSA-N 2 0 341.524 4.204 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310236026 1042832091 /nfs/dbraw/zinc/83/20/91/1042832091.db2.gz KSFFZNFLYDVSOF-UHOSZYNNSA-N 2 0 336.470 4.312 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000310473097 1042838137 /nfs/dbraw/zinc/83/81/37/1042838137.db2.gz BXUBODHVCUMBPF-ZWOKBUDYSA-N 2 0 326.459 4.387 20 0 EIADRP FC1(F)CCC[C@H](C[NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000311007386 1042849932 /nfs/dbraw/zinc/84/99/32/1042849932.db2.gz WOYAWOMPCPZDHJ-VNTMZGSJSA-N 2 0 348.481 4.312 20 0 EIADRP COCCC[C@@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000178439914 1042866486 /nfs/dbraw/zinc/86/64/86/1042866486.db2.gz WIOTYGOJIQUFAB-GOSISDBHSA-N 2 0 332.532 4.356 20 0 EIADRP CC(C)[NH2+]C1CCN(Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC000170986937 1042911553 /nfs/dbraw/zinc/91/15/53/1042911553.db2.gz NREAYQVSLQTKCR-UHFFFAOYSA-N 2 0 338.495 4.228 20 0 EIADRP C[C@H]1CC([NH2+]C(C)(C)c2cccnc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168005147 1042958066 /nfs/dbraw/zinc/95/80/66/1042958066.db2.gz GVPDKMDFNUROHO-ROUUACIJSA-N 2 0 337.511 4.348 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[N@H+](C)CC1CC[NH2+]CC1 ZINC000262124523 1042991472 /nfs/dbraw/zinc/99/14/72/1042991472.db2.gz CHTOFHGJSWFVIZ-MRXNPFEDSA-N 2 0 343.540 4.419 20 0 EIADRP C[C@H]1CC([NH2+]C2Cc3ccccc3C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168006367 1043000047 /nfs/dbraw/zinc/00/00/47/1043000047.db2.gz NONMJRSHUDZXQQ-ROUUACIJSA-N 2 0 334.507 4.185 20 0 EIADRP C[C@H]1CC([NH2+]CCCc2ccncc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168007268 1043015142 /nfs/dbraw/zinc/01/51/42/1043015142.db2.gz ACFSPNLNUWMXJK-OALUTQOASA-N 2 0 337.511 4.045 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1N(C)C ZINC000183195394 1043039668 /nfs/dbraw/zinc/03/96/68/1043039668.db2.gz VVPWURMSYYSBGE-OKZBNKHCSA-N 2 0 329.532 4.056 20 0 EIADRP CCOc1cccc2cc([C@@H](C)[NH2+][C@H](C)C3CC[NH+](C)CC3)oc21 ZINC000161858524 1043050893 /nfs/dbraw/zinc/05/08/93/1043050893.db2.gz JXGFLDPLDOCLTP-HUUCEWRRSA-N 2 0 330.472 4.212 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc(-c2cccs2)cc1 ZINC000665238150 1043139177 /nfs/dbraw/zinc/13/91/77/1043139177.db2.gz RPFIMRRVYFZMQD-AWEZNQCLSA-N 2 0 337.492 4.428 20 0 EIADRP CC[NH+](CC)CCOC1CC[NH+]([C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000347851107 1043215507 /nfs/dbraw/zinc/21/55/07/1043215507.db2.gz LOJSNAJSQLJNCZ-INIZCTEOSA-N 2 0 338.923 4.224 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CC2(c3ccc(F)cc3Cl)CCCC2)CC[N@@H+]1C ZINC000427882717 1043246827 /nfs/dbraw/zinc/24/68/27/1043246827.db2.gz ANQQNIRAJHNZNV-GOEBONIOSA-N 2 0 338.898 4.363 20 0 EIADRP COc1cccc2cc(C[NH2+]CCCC[N@@H+]3CCC[C@H](C)C3)oc21 ZINC000727644194 1043255886 /nfs/dbraw/zinc/25/58/86/1043255886.db2.gz RTIPUKLCAKBDPG-INIZCTEOSA-N 2 0 330.472 4.043 20 0 EIADRP C[C@@H](NC1CC[NH+](C2CCCCC2)CC1)[C@H](c1ccccc1)[NH+](C)C ZINC000186320983 1043268127 /nfs/dbraw/zinc/26/81/27/1043268127.db2.gz HEWLSXITCBHJEJ-XMSQKQJNSA-N 2 0 343.559 4.065 20 0 EIADRP CCC[N@H+](C)C[C@H]1CC[NH+](CCCc2ccc(C(F)(F)F)cc2)C1 ZINC000674008001 1043285286 /nfs/dbraw/zinc/28/52/86/1043285286.db2.gz VODYWMWFEQKFOG-QGZVFWFLSA-N 2 0 342.449 4.302 20 0 EIADRP CCC[NH+](CCC)CCC[NH2+]Cc1sc2nc(C)nc(C)c2c1C ZINC000728063345 1043348311 /nfs/dbraw/zinc/34/83/11/1043348311.db2.gz KWZLLXACNRRBML-UHFFFAOYSA-N 2 0 348.560 4.218 20 0 EIADRP c1cc(CC[NH2+][C@H]2CCN(Cc3ccccc3)C3(CC3)C2)cs1 ZINC000520811511 1043390674 /nfs/dbraw/zinc/39/06/74/1043390674.db2.gz KOWGQOJNNFNKAT-IBGZPJMESA-N 2 0 326.509 4.077 20 0 EIADRP Cc1nc2ccc(C[NH2+]CCCC[N@H+]3CCC[C@H](C)C3)cc2s1 ZINC000494385260 1043459043 /nfs/dbraw/zinc/45/90/43/1043459043.db2.gz LYCJIMWAPQCUQV-HNNXBMFYSA-N 2 0 331.529 4.206 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3cccc(Cl)c3)s2)C1 ZINC000520974167 1043459505 /nfs/dbraw/zinc/45/95/05/1043459505.db2.gz RSXKKVMIKSUDEI-AWEZNQCLSA-N 2 0 334.916 4.500 20 0 EIADRP FC(F)(F)CCC(CCC(F)(F)F)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000665272364 1043503549 /nfs/dbraw/zinc/50/35/49/1043503549.db2.gz DBIPDLSYBMAIKH-NQBHXWOUSA-N 2 0 346.359 4.018 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccnn1-c1ccccc1 ZINC000467364157 1043581451 /nfs/dbraw/zinc/58/14/51/1043581451.db2.gz JIHAYROLHMUBSG-MOPGFXCFSA-N 2 0 340.515 4.178 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442790824 1043841359 /nfs/dbraw/zinc/84/13/59/1043841359.db2.gz MIDAJFGJWNJWGA-AEFFLSMTSA-N 2 0 340.433 4.273 20 0 EIADRP CCCCCC[N@H+](C)CC(=O)Nc1cccc(C[NH+]2CCCCC2)c1 ZINC000731868950 1043841620 /nfs/dbraw/zinc/84/16/20/1043841620.db2.gz GCXGGVCMWOJSGC-UHFFFAOYSA-N 2 0 345.531 4.123 20 0 EIADRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000442918221 1043889656 /nfs/dbraw/zinc/88/96/56/1043889656.db2.gz CEHOTZQZWDEMIZ-AWEZNQCLSA-N 2 0 341.480 4.117 20 0 EIADRP COc1cccc2cc(C[NH2+]CCCCC[NH+]3CCCCC3)oc21 ZINC000733326585 1044188329 /nfs/dbraw/zinc/18/83/29/1044188329.db2.gz NFBKKLGQZCCQJS-UHFFFAOYSA-N 2 0 330.472 4.187 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)CC1 ZINC000193991477 1044233693 /nfs/dbraw/zinc/23/36/93/1044233693.db2.gz KBBLWJURQYUCNX-HNNXBMFYSA-N 2 0 342.449 4.489 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1cc(Br)cs1 ZINC000194069371 1044248730 /nfs/dbraw/zinc/24/87/30/1044248730.db2.gz DETRVVSPYMJRFH-DRZSPHRISA-N 2 0 331.323 4.034 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[NH2+]CC1CC[NH+](CC2CCCC2)CC1 ZINC001168470486 1044295628 /nfs/dbraw/zinc/29/56/28/1044295628.db2.gz ZAHMZEYAILNXSO-QGZVFWFLSA-N 2 0 332.507 4.249 20 0 EIADRP C[C@@H]1CC([NH2+]CC2(c3ccccn3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168017574 1044309429 /nfs/dbraw/zinc/30/94/29/1044309429.db2.gz BDQWSGDSSPVRDP-RTBURBONSA-N 2 0 349.522 4.144 20 0 EIADRP COc1ccc2cc([C@@H](C)[NH2+]CC3(C)CC[NH+](C)CC3)ccc2c1 ZINC000326841753 1044310792 /nfs/dbraw/zinc/31/07/92/1044310792.db2.gz ORPYRWIDPGZBBQ-MRXNPFEDSA-N 2 0 326.484 4.231 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(Cl)cc1 ZINC000069645320 1044368766 /nfs/dbraw/zinc/36/87/66/1044368766.db2.gz SRNHPZSJNZNYES-HNNXBMFYSA-N 2 0 332.875 4.131 20 0 EIADRP CCn1c2ccccc2c2cc(C[NH2+][C@H]3CC[N@H+](C)[C@@H](C)C3)ccc21 ZINC000327016915 1044402919 /nfs/dbraw/zinc/40/29/19/1044402919.db2.gz HMJOJOWVVUOPHZ-WMZOPIPTSA-N 2 0 335.495 4.387 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3c2ccc(OC)c3F)c1 ZINC000675728664 1044460109 /nfs/dbraw/zinc/46/01/09/1044460109.db2.gz SRVJWOIRWZOWOG-IBGZPJMESA-N 2 0 342.458 4.063 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCCc3c4ccccc4[nH]c32)C1 ZINC000675728290 1044461277 /nfs/dbraw/zinc/46/12/77/1044461277.db2.gz FVLGTTIIQYEYGU-JXFKEZNVSA-N 2 0 325.500 4.255 20 0 EIADRP CCOc1ccc([C@@H](CC)[NH2+]CC2CC[NH+](CC)CC2)cc1OCC ZINC000675818489 1044516094 /nfs/dbraw/zinc/51/60/94/1044516094.db2.gz GCWCNWQZGQGFGM-LJQANCHMSA-N 2 0 348.531 4.257 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](c2ccc(F)cc2)c2cccnc2)CC1 ZINC000543402734 1044523713 /nfs/dbraw/zinc/52/37/13/1044523713.db2.gz NARGIGBEIFUSKD-OAQYLSRUSA-N 2 0 341.474 4.022 20 0 EIADRP C[C@@H]1CC([NH2+]Cc2cccc3ncoc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168022566 1044523863 /nfs/dbraw/zinc/52/38/63/1044523863.db2.gz AGTBIRFPCIDJJJ-IAGOWNOFSA-N 2 0 349.478 4.359 20 0 EIADRP C[C@@H]([NH2+]CC1(Sc2ccccc2)CCCC1)C1CC[NH+](C)CC1 ZINC000675840109 1044526208 /nfs/dbraw/zinc/52/62/08/1044526208.db2.gz QTKYJTIMMFXHCL-QGZVFWFLSA-N 2 0 332.557 4.411 20 0 EIADRP Cc1cccc(C(=[NH2+])NC2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168022692 1044533773 /nfs/dbraw/zinc/53/37/73/1044533773.db2.gz AWSYDFILNBJKKO-ROUUACIJSA-N 2 0 335.495 4.352 20 0 EIADRP C[C@@H](CC1CCC1)[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000675928550 1044581050 /nfs/dbraw/zinc/58/10/50/1044581050.db2.gz LOYPHPCBWRCKHC-IBGZPJMESA-N 2 0 344.543 4.226 20 0 EIADRP C[NH+](C)CC1CC[NH+](CCCCc2cccc(C(F)(F)F)c2)CC1 ZINC000474149876 1044691268 /nfs/dbraw/zinc/69/12/68/1044691268.db2.gz FYZYFOZNRJMNKM-UHFFFAOYSA-N 2 0 342.449 4.302 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2ccc(C(F)(F)F)s2)cc1 ZINC000428863295 1044759582 /nfs/dbraw/zinc/75/95/82/1044759582.db2.gz XXPUTYXZRAUQDQ-UHFFFAOYSA-N 2 0 328.403 4.118 20 0 EIADRP C[C@H]1CC(n2c(C[NH3+])cc3ccncc32)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168030500 1044800851 /nfs/dbraw/zinc/80/08/51/1044800851.db2.gz WHPHSYXZIPBGDK-IRXDYDNUSA-N 2 0 348.494 4.109 20 0 EIADRP CC1(C[NH2+][C@@H]2CCN(C3CC3)[C@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000895532366 1044800879 /nfs/dbraw/zinc/80/08/79/1044800879.db2.gz OAUAXHSXRHJXKP-AEFFLSMTSA-N 2 0 334.454 4.380 20 0 EIADRP C[C@H]1CC(Nc2ccc(C[NH3+])c(F)c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168031595 1044830703 /nfs/dbraw/zinc/83/07/03/1044830703.db2.gz AJKMJSYVZQENCK-HOTGVXAUSA-N 2 0 341.474 4.138 20 0 EIADRP CCC(C)(C)c1ccc(C[N@@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@@H]32)cc1 ZINC000509022464 1044945139 /nfs/dbraw/zinc/94/51/39/1044945139.db2.gz PUPVVBJVJQUNND-QHAWAJNXSA-N 2 0 344.543 4.058 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+]C1CCC(C)([NH+]2CCC2)CC1 ZINC000922845836 1044992267 /nfs/dbraw/zinc/99/22/67/1044992267.db2.gz UHNCYCABNPBTJN-OBGWFSINSA-N 2 0 342.527 4.233 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2cc(Cl)cc(Cl)c2N)CC1 ZINC000922847014 1044996206 /nfs/dbraw/zinc/99/62/06/1044996206.db2.gz TTYIMFUQUAMTPO-UHFFFAOYSA-N 2 0 342.314 4.072 20 0 EIADRP C[C@@H]1CC(Nc2cccc(CC[NH3+])c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168035144 1044998733 /nfs/dbraw/zinc/99/87/33/1044998733.db2.gz ROVCTACJCIWTPX-QZTJIDSGSA-N 2 0 337.511 4.041 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cn2c3ccccc3oc2=S)CC1 ZINC000738066791 1045033150 /nfs/dbraw/zinc/03/31/50/1045033150.db2.gz DXAOWHIUTUAJIL-UHFFFAOYSA-N 2 0 347.528 4.365 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cn2ccc(=S)c3ccccc32)CC1 ZINC000738070113 1045033681 /nfs/dbraw/zinc/03/36/81/1045033681.db2.gz BCEZHTRUSWKJGR-UHFFFAOYSA-N 2 0 343.540 4.382 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](CC(c3ccccc3)c3ccccc3)CC[C@H]21 ZINC000509069619 1045055903 /nfs/dbraw/zinc/05/59/03/1045055903.db2.gz LDCIJLFNCAIJGV-FYYLOGMGSA-N 2 0 334.507 4.235 20 0 EIADRP Fc1ccc([C@@H](CC(F)(F)F)[NH2+]CCC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000923377338 1045079874 /nfs/dbraw/zinc/07/98/74/1045079874.db2.gz SKVBHZYIJSXPMG-WPENSMPRSA-N 2 0 344.396 4.330 20 0 EIADRP Cc1nc([C@H](C)[N@@H+]2CC[C@H](C[NH3+])[C@@H](C)C2)oc1-c1ccc(Cl)cc1 ZINC000923494881 1045135833 /nfs/dbraw/zinc/13/58/33/1045135833.db2.gz PYRMSXMOXSPFOQ-DUVNUKRYSA-N 2 0 347.890 4.281 20 0 EIADRP c1nc(C2CC2)c(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)s1 ZINC000486949632 1045221432 /nfs/dbraw/zinc/22/14/32/1045221432.db2.gz ITCLNCGVHMEUCT-UHFFFAOYSA-N 2 0 341.524 4.296 20 0 EIADRP Cc1nccn1CCCC[N@@H+]1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000429124231 1045257005 /nfs/dbraw/zinc/25/70/05/1045257005.db2.gz ZFVOIVFRMWIZOG-SFHVURJKSA-N 2 0 349.931 4.492 20 0 EIADRP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC000542567526 1045334206 /nfs/dbraw/zinc/33/42/06/1045334206.db2.gz ZTSCPPKJVFINIK-SOUVJXGZSA-N 2 0 328.422 4.271 20 0 EIADRP C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](CC1CC[NH2+]CC1)C1CC1 ZINC000237626371 1045390721 /nfs/dbraw/zinc/39/07/21/1045390721.db2.gz LGVMMCLYPWNYCV-ZDUSSCGKSA-N 2 0 326.406 4.230 20 0 EIADRP COc1cccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000397495463 1045580346 /nfs/dbraw/zinc/58/03/46/1045580346.db2.gz ABMINAXQIDVBDW-GOSISDBHSA-N 2 0 338.495 4.258 20 0 EIADRP Cc1cc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c(C)o1 ZINC000397537455 1045621585 /nfs/dbraw/zinc/62/15/85/1045621585.db2.gz JTBXMSJROHTHAB-KRWDZBQOSA-N 2 0 326.484 4.459 20 0 EIADRP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1CCC[C@@H]([NH+](C)C)CC1 ZINC000429531727 1045677479 /nfs/dbraw/zinc/67/74/79/1045677479.db2.gz SFKZTMZPRWGJSX-UKRRQHHQSA-N 2 0 330.394 4.062 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc2c(c1)COC(C)(C)O2 ZINC000768677085 1045826627 /nfs/dbraw/zinc/82/66/27/1045826627.db2.gz IGFVFQDAJRASOZ-KRWDZBQOSA-N 2 0 346.515 4.076 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(-n2ccnc2)cc1 ZINC000247123235 1045841365 /nfs/dbraw/zinc/84/13/65/1045841365.db2.gz RFTIWVPMOVTUCU-RBUKOAKNSA-N 2 0 340.515 4.178 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1cnn(C)c1 ZINC000247210535 1045843311 /nfs/dbraw/zinc/84/33/11/1045843311.db2.gz WXIFTLYPYRJPKO-UTKZUKDTSA-N 2 0 340.515 4.035 20 0 EIADRP CSC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCC1 ZINC000248649016 1045879781 /nfs/dbraw/zinc/87/97/81/1045879781.db2.gz KGPNXZIBTZZEPT-LDLYASANSA-N 2 0 330.541 4.057 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2coc(-c3ccc(F)cc3)n2)CC1 ZINC000123329244 1045899377 /nfs/dbraw/zinc/89/93/77/1045899377.db2.gz FMWCAMNGENQNGW-UHFFFAOYSA-N 2 0 345.462 4.035 20 0 EIADRP Cc1cc2cc[nH]c2c(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)[nH+]1 ZINC001170330221 1046001305 /nfs/dbraw/zinc/00/13/05/1046001305.db2.gz JDADZWPSESKCGM-OWZKRDHZSA-N 2 0 346.478 4.479 20 0 EIADRP CCC1(C[NH2+]C2CC(C(F)F)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000769537457 1046012521 /nfs/dbraw/zinc/01/25/21/1046012521.db2.gz KQHYOQGUWPFWGS-UHFFFAOYSA-N 2 0 336.470 4.312 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](CC)c2cccc(Br)c2)CC1 ZINC000037236914 1046091965 /nfs/dbraw/zinc/09/19/65/1046091965.db2.gz AVXFBIUNHPNHIX-KRWDZBQOSA-N 2 0 339.321 4.364 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[N@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC000261932077 1046165981 /nfs/dbraw/zinc/16/59/81/1046165981.db2.gz LROFGFGVTRBGQM-DLBZAZTESA-N 2 0 343.540 4.419 20 0 EIADRP Cc1ccc(C[NH2+]Cc2ccc(C[N@H+]3C[C@H](C)C[C@H](C)C3)cc2)o1 ZINC000237687798 1046304096 /nfs/dbraw/zinc/30/40/96/1046304096.db2.gz YCDGVIDCRLGVED-CALCHBBNSA-N 2 0 326.484 4.356 20 0 EIADRP C[C@H](Nc1cccc(C[NH+](C)C)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508688656 1046321430 /nfs/dbraw/zinc/32/14/30/1046321430.db2.gz DLAGTOFQMIXOFR-GHTZIAJQSA-N 2 0 337.511 4.071 20 0 EIADRP C[C@@H]([NH2+]CCc1cc(F)cc(F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508712196 1046370429 /nfs/dbraw/zinc/37/04/29/1046370429.db2.gz CHGFJHWTZUOCLR-APWZRJJASA-N 2 0 344.449 4.008 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508715807 1046381358 /nfs/dbraw/zinc/38/13/58/1046381358.db2.gz XZKKVGXJZCHKKW-DWLNXYMOSA-N 2 0 346.518 4.073 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc2ccccc2c1OC(F)F ZINC000126189307 1046455711 /nfs/dbraw/zinc/45/57/11/1046455711.db2.gz YKZUMGFZNBHARJ-CQSZACIVSA-N 2 0 348.437 4.434 20 0 EIADRP C[NH+]1C(C)(C)CC(Nc2ccc([C@@H]3CCC[NH2+]C3)cc2)CC1(C)C ZINC001170454771 1046552262 /nfs/dbraw/zinc/55/22/62/1046552262.db2.gz XTNQTVMWFZHEJY-QGZVFWFLSA-N 2 0 329.532 4.217 20 0 EIADRP COc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCCN(Cc2cccs2)C1 ZINC000126815271 1046563740 /nfs/dbraw/zinc/56/37/40/1046563740.db2.gz HBSGMMGTHLUOLE-IRXDYDNUSA-N 2 0 344.524 4.320 20 0 EIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000509697831 1046575938 /nfs/dbraw/zinc/57/59/38/1046575938.db2.gz MHFDUPUZSSTURM-SFHVURJKSA-N 2 0 338.495 4.099 20 0 EIADRP Fc1cccc2c1SCC[C@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459398349 1046595619 /nfs/dbraw/zinc/59/56/19/1046595619.db2.gz YSJPJTKEFCUEFX-GOSISDBHSA-N 2 0 343.471 4.016 20 0 EIADRP C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1c(F)cccc1Cl ZINC000459434932 1046646089 /nfs/dbraw/zinc/64/60/89/1046646089.db2.gz VOBYAXYGIDRIDZ-CYBMUJFWSA-N 2 0 333.838 4.194 20 0 EIADRP c1ccc2c(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)ccnc2c1 ZINC000536697132 1046693815 /nfs/dbraw/zinc/69/38/15/1046693815.db2.gz ACYBFNGDDFBZFD-UHFFFAOYSA-N 2 0 337.511 4.323 20 0 EIADRP c1ccc(C[C@H]2CC[C@@H]([NH2+]C3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000459510853 1046747872 /nfs/dbraw/zinc/74/78/72/1046747872.db2.gz MHPBJCWCNASVOU-TZIWHRDSSA-N 2 0 335.495 4.051 20 0 EIADRP c1ccc(C[C@@H]2CC[C@H]([NH2+]C3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000459510851 1046749197 /nfs/dbraw/zinc/74/91/97/1046749197.db2.gz MHPBJCWCNASVOU-FPOVZHCZSA-N 2 0 335.495 4.051 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cc1 ZINC000536833477 1046809471 /nfs/dbraw/zinc/80/94/71/1046809471.db2.gz PTOCXSMJNMKQNP-CEXWTWQISA-N 2 0 332.532 4.145 20 0 EIADRP CCOCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CCC1 ZINC000536845214 1046817678 /nfs/dbraw/zinc/81/76/78/1046817678.db2.gz KRPJOJPOCREQLT-TZIWHRDSSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(F)c(Cl)c1 ZINC000536860580 1046828301 /nfs/dbraw/zinc/82/83/01/1046828301.db2.gz YXDMWRCWYDDBLW-ZNMIVQPWSA-N 2 0 342.886 4.019 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1cccc(F)c1F ZINC000536863771 1046829870 /nfs/dbraw/zinc/82/98/70/1046829870.db2.gz MSKUJLBHWZNHIN-OXQOHEQNSA-N 2 0 344.449 4.008 20 0 EIADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000459723560 1046863881 /nfs/dbraw/zinc/86/38/81/1046863881.db2.gz ADDZODQHPOSTON-CBBWQLFWSA-N 2 0 326.937 4.215 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)[C@H](C)c1nc2ccccc2s1 ZINC000459728907 1046865542 /nfs/dbraw/zinc/86/55/42/1046865542.db2.gz CWEUNKCBHXIVIJ-HRCADAONSA-N 2 0 331.529 4.110 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC000459728939 1046866048 /nfs/dbraw/zinc/86/60/48/1046866048.db2.gz CWEUNKCBHXIVIJ-PMPSAXMXSA-N 2 0 331.529 4.110 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+]CC[C@H]2CCC[N@H+](C)C2)cc1 ZINC000459737547 1046875885 /nfs/dbraw/zinc/87/58/85/1046875885.db2.gz RLPZZZNVIMRBKH-LJQANCHMSA-N 2 0 338.495 4.184 20 0 EIADRP C[N@@H+]1CCC[C@H](CC[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000459790964 1046891516 /nfs/dbraw/zinc/89/15/16/1046891516.db2.gz RECVULUJFYGGDU-CQSZACIVSA-N 2 0 349.931 4.285 20 0 EIADRP CC(C)CCC[C@@H](C)[NH+]1CCC2(CCC[N@@H+]2Cc2cnn(C)c2)CC1 ZINC001170079618 1047064920 /nfs/dbraw/zinc/06/49/20/1047064920.db2.gz DYXMDFFDFCIEHM-LJQANCHMSA-N 2 0 346.563 4.065 20 0 EIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000537303718 1047084424 /nfs/dbraw/zinc/08/44/24/1047084424.db2.gz IVOYGQAYMOPURI-QWHCGFSZSA-N 2 0 343.298 4.001 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)CC1 ZINC000497820979 1047103620 /nfs/dbraw/zinc/10/36/20/1047103620.db2.gz GPZOPFJQWWPWFQ-NRFANRHFSA-N 2 0 330.491 4.473 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1cc[nH]c(=O)c1 ZINC000788525004 1047200792 /nfs/dbraw/zinc/20/07/92/1047200792.db2.gz AEIGLMZUEHZTQM-IRXDYDNUSA-N 2 0 339.483 4.012 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCN(C2CC2)[C@H](c2ccccc2)C1)c1cncs1 ZINC000897931036 1047500871 /nfs/dbraw/zinc/50/08/71/1047500871.db2.gz VABOCWNQNJKYNJ-LESCRADOSA-N 2 0 327.497 4.162 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCCc3c(O)cccc32)C1 ZINC000556236330 1047602506 /nfs/dbraw/zinc/60/25/06/1047602506.db2.gz QNECRCSOTKRISO-FUHIMQAGSA-N 2 0 330.516 4.117 20 0 EIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000556242192 1047622721 /nfs/dbraw/zinc/62/27/21/1047622721.db2.gz RJIGLFQNEXNFOK-PVSGBFIBSA-N 2 0 334.507 4.290 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC000556260182 1047631738 /nfs/dbraw/zinc/63/17/38/1047631738.db2.gz KORQZFRFUVFYEZ-LMDPOFIKSA-N 2 0 336.470 4.455 20 0 EIADRP Cc1ccccc1[C@@H](O)C[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000763435121 1047791590 /nfs/dbraw/zinc/79/15/90/1047791590.db2.gz ZJBLMAGGRXMRJD-KNQAVFIVSA-N 2 0 344.543 4.005 20 0 EIADRP Cc1ccccc1[C@H](O)C[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000763435120 1047792403 /nfs/dbraw/zinc/79/24/03/1047792403.db2.gz ZJBLMAGGRXMRJD-DENIHFKCSA-N 2 0 344.543 4.005 20 0 EIADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001171064634 1047923499 /nfs/dbraw/zinc/92/34/99/1047923499.db2.gz SFSZBVLJPHMJNX-CZUORRHYSA-N 2 0 341.326 4.172 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C[C@@]2(C)CC2(Cl)Cl)CC[N@@H+]1Cc1ccccc1 ZINC000824775050 1047931377 /nfs/dbraw/zinc/93/13/77/1047931377.db2.gz XRDHYLLTENEGDE-DJIMGWMZSA-N 2 0 341.326 4.213 20 0 EIADRP C[C@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000824775079 1047935316 /nfs/dbraw/zinc/93/53/16/1047935316.db2.gz YFVHBNRDGSHPJV-XIRDDKMYSA-N 2 0 341.326 4.071 20 0 EIADRP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(OCC(F)F)cc2)CC1 ZINC001136942202 1047966386 /nfs/dbraw/zinc/96/63/86/1047966386.db2.gz ZHFGWUJUOAJULM-UHFFFAOYSA-N 2 0 340.458 4.027 20 0 EIADRP CC(C)[C@@H](NCC[C@H](C)[N@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000498939039 1047994211 /nfs/dbraw/zinc/99/42/11/1047994211.db2.gz FDXHNMPIJDWPHW-LAUBAEHRSA-N 2 0 343.490 4.418 20 0 EIADRP C[N@H+](CC1CC[NH+](C)CC1)[C@@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171082942 1048069495 /nfs/dbraw/zinc/06/94/95/1048069495.db2.gz PJFYHSZBFQHLOH-MRXNPFEDSA-N 2 0 341.326 4.124 20 0 EIADRP COc1ccc2c(c1F)CC[C@H]2[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000808701464 1048079149 /nfs/dbraw/zinc/07/91/49/1048079149.db2.gz YMJXRJWOAGXKQF-LADRWXRNSA-N 2 0 346.490 4.208 20 0 EIADRP COc1ccc2c(c1F)CC[C@@H]2[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000808701465 1048080626 /nfs/dbraw/zinc/08/06/26/1048080626.db2.gz YMJXRJWOAGXKQF-RJYAGPCLSA-N 2 0 346.490 4.208 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c(C)c1OC ZINC000556871737 1048089789 /nfs/dbraw/zinc/08/97/89/1048089789.db2.gz WSCZTVCTFHVERA-MAUKXSAKSA-N 2 0 336.520 4.029 20 0 EIADRP c1ccc(C[C@@H](C[NH+]2CCCC2)Nc2cccc(C3=[NH+]CCC3)c2)cc1 ZINC001170753935 1048094873 /nfs/dbraw/zinc/09/48/73/1048094873.db2.gz FZVZMOKYPVIPFH-QFIPXVFZSA-N 2 0 347.506 4.389 20 0 EIADRP FC1(F)CC([NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000556887850 1048099640 /nfs/dbraw/zinc/09/96/40/1048099640.db2.gz MGQXTUWWPAZQGA-QXAKKESOSA-N 2 0 334.454 4.065 20 0 EIADRP Cc1ccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499219592 1048429602 /nfs/dbraw/zinc/42/96/02/1048429602.db2.gz QTHXSNCNKODMHD-NUNAXRQHSA-N 2 0 334.507 4.323 20 0 EIADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCc3cc(Cl)c(Cl)cc3C2)C1 ZINC001171149489 1048483043 /nfs/dbraw/zinc/48/30/43/1048483043.db2.gz WOBJQIPDRAGXTI-BZUAXINKSA-N 2 0 341.326 4.313 20 0 EIADRP Cc1ccc2cc(C[N@@H+](C)Cc3ccc(C[NH+](C)C)cc3)ccc2n1 ZINC000809738933 1048509949 /nfs/dbraw/zinc/50/99/49/1048509949.db2.gz PTHLTDVPWYUZHN-UHFFFAOYSA-N 2 0 333.479 4.237 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)CCCCOc2ccccc2)cc1 ZINC000809738177 1048510564 /nfs/dbraw/zinc/51/05/64/1048510564.db2.gz SLSBFEYPGOOLHI-UHFFFAOYSA-N 2 0 326.484 4.039 20 0 EIADRP COc1cc([C@H](C)[NH2+]CCC2CC[NH2+]CC2)ccc1SC(F)F ZINC000844924646 1048548496 /nfs/dbraw/zinc/54/84/96/1048548496.db2.gz NFWAQCKCSGXVPC-LBPRGKRZSA-N 2 0 344.471 4.050 20 0 EIADRP Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3cc(N4CCCCC4)cc[nH+]3)c2c1 ZINC001171164795 1048606959 /nfs/dbraw/zinc/60/69/59/1048606959.db2.gz HDLLYRAUYKRJCD-KRWDZBQOSA-N 2 0 348.494 4.214 20 0 EIADRP Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3ccc([C@H]4CC[N@H+](C)C4)cc3)c2c1 ZINC001171167786 1048614041 /nfs/dbraw/zinc/61/40/41/1048614041.db2.gz MQQKKLQDVXNWPC-MJGOQNOKSA-N 2 0 347.506 4.248 20 0 EIADRP CSC1(C[NH2+]Cc2ccccc2-c2ccccc2)CC[NH+](C)CC1 ZINC000810171229 1048653609 /nfs/dbraw/zinc/65/36/09/1048653609.db2.gz XEBAJORYUJNIMI-UHFFFAOYSA-N 2 0 340.536 4.271 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCN(Cc2ccc(Cl)c3cccnc23)C1 ZINC000076004354 1048833930 /nfs/dbraw/zinc/83/39/30/1048833930.db2.gz GZJNLPXUVROBCF-HNNXBMFYSA-N 2 0 331.891 4.052 20 0 EIADRP C[C@H]1C[C@@H]1c1ccc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)o1 ZINC000237571026 1048963634 /nfs/dbraw/zinc/96/36/34/1048963634.db2.gz WSDCITNNYSFAOU-KXBFYZLASA-N 2 0 344.524 4.466 20 0 EIADRP CCC[N@H+](Cc1cccc(Br)c1)[C@@H]1CC[NH2+]C(C)(C)C1 ZINC001246846794 1049022369 /nfs/dbraw/zinc/02/23/69/1049022369.db2.gz QBOGFYHJWBYZPK-MRXNPFEDSA-N 2 0 339.321 4.192 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1csc2ccccc21 ZINC000817900667 1049056208 /nfs/dbraw/zinc/05/62/08/1049056208.db2.gz UYNHKSFFUVJSKB-GXTWGEPZSA-N 2 0 325.481 4.475 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc2c(c1)CCC2 ZINC000817907246 1049057276 /nfs/dbraw/zinc/05/72/76/1049057276.db2.gz SVICRDOEFWQJBA-JFJYTDJESA-N 2 0 348.490 4.082 20 0 EIADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCCN1c2ccccc2Sc2ccccc21 ZINC000817913013 1049059460 /nfs/dbraw/zinc/05/94/60/1049059460.db2.gz TYPAKHZJVZHTOH-HOTGVXAUSA-N 2 0 341.524 4.395 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1nc(-c2ccccc2)cs1 ZINC000817947347 1049063376 /nfs/dbraw/zinc/06/33/76/1049063376.db2.gz CPALKJPUVWCKIT-OAHLLOKOSA-N 2 0 337.492 4.162 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000817947373 1049064435 /nfs/dbraw/zinc/06/44/35/1049064435.db2.gz CZEZBJIWDHZNOC-OAQYLSRUSA-N 2 0 338.495 4.315 20 0 EIADRP [NH3+]CCc1ccc(C[NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)cc1 ZINC000817949954 1049067397 /nfs/dbraw/zinc/06/73/97/1049067397.db2.gz UVTOHZXKXZPIAM-QGZVFWFLSA-N 2 0 335.278 4.272 20 0 EIADRP [NH3+]CCc1ccc(C[NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)cc1 ZINC000817949953 1049067613 /nfs/dbraw/zinc/06/76/13/1049067613.db2.gz UVTOHZXKXZPIAM-KRWDZBQOSA-N 2 0 335.278 4.272 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@H]2CCCC[C@H]2C[NH3+])ccc1SC(F)F ZINC000817960104 1049069210 /nfs/dbraw/zinc/06/92/10/1049069210.db2.gz KNYMNEZWLGMZAZ-UBHSHLNASA-N 2 0 344.471 4.178 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)CC[NH2+]1 ZINC000817972081 1049072311 /nfs/dbraw/zinc/07/23/11/1049072311.db2.gz SWLOVHIQHSDQIQ-KFNAQCHYSA-N 2 0 326.456 4.109 20 0 EIADRP FC(F)Sc1ccc2c(c1)CCC[C@@H]2[NH2+][C@H]1CCC[NH2+]CC1 ZINC000817967838 1049072598 /nfs/dbraw/zinc/07/25/98/1049072598.db2.gz CSNFXXATLNUJKQ-BBRMVZONSA-N 2 0 326.456 4.110 20 0 EIADRP COc1cc(C)c([C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1C ZINC000817982855 1049078021 /nfs/dbraw/zinc/07/80/21/1049078021.db2.gz IRWCKGUGDSAVRA-PXNSSMCTSA-N 2 0 326.484 4.443 20 0 EIADRP C[C@@H](CSC(C)(C)C)[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000817979526 1049078563 /nfs/dbraw/zinc/07/85/63/1049078563.db2.gz LHUMWABOQUDGKC-QILLFSRXSA-N 2 0 338.536 4.029 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(SC(F)F)cc1 ZINC000817985563 1049079708 /nfs/dbraw/zinc/07/97/08/1049079708.db2.gz LZGZADYPRXRFBX-TZMCWYRMSA-N 2 0 326.456 4.327 20 0 EIADRP [NH3+]CCCCCCC[NH+]1CCC(c2nc3c(s2)CCCC3)CC1 ZINC000818339629 1049135826 /nfs/dbraw/zinc/13/58/26/1049135826.db2.gz BELOJZAPLOHORE-UHFFFAOYSA-N 2 0 335.561 4.111 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@H]2CCc3cccc(Cl)c3C2)C[C@@](C)(C[NH3+])C1 ZINC001170901557 1049148554 /nfs/dbraw/zinc/14/85/54/1049148554.db2.gz FCERWBKLJRSPNM-TWOQFEAHSA-N 2 0 334.935 4.331 20 0 EIADRP C[C@@H](CC[NH2+][C@@H]1CCCNc2ccccc21)[N@H+](C)Cc1ccccc1 ZINC000348097586 1049416951 /nfs/dbraw/zinc/41/69/51/1049416951.db2.gz WQQBUJDVEKAHFB-PGRDOPGGSA-N 2 0 337.511 4.434 20 0 EIADRP CCC1(C[NH2+]CC2(SC)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000348134406 1049440570 /nfs/dbraw/zinc/44/05/70/1049440570.db2.gz IAZNJOKZIOOECI-UHFFFAOYSA-N 2 0 332.557 4.164 20 0 EIADRP Fc1cc(F)c2c(c1)CC[C@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)C2 ZINC001170677633 1049466775 /nfs/dbraw/zinc/46/67/75/1049466775.db2.gz QUWLADJSYQXHDA-IBGZPJMESA-N 2 0 348.481 4.066 20 0 EIADRP COc1ccc(Cl)cc1C[NH2+][C@@H](C)c1cccc(C[NH+](C)C)c1 ZINC000820809301 1049555281 /nfs/dbraw/zinc/55/52/81/1049555281.db2.gz YUDZFPORKIXVIP-AWEZNQCLSA-N 2 0 332.875 4.261 20 0 EIADRP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1CCCO1 ZINC000820829453 1049562653 /nfs/dbraw/zinc/56/26/53/1049562653.db2.gz JLOLZGTZHBMGKF-RFQIGKHKSA-N 2 0 342.527 4.119 20 0 EIADRP CC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CCCO1 ZINC000820829452 1049563911 /nfs/dbraw/zinc/56/39/11/1049563911.db2.gz JLOLZGTZHBMGKF-NAQMCUANSA-N 2 0 342.527 4.119 20 0 EIADRP Fc1cccc2c1CC[C@@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)C2 ZINC001171394391 1049612198 /nfs/dbraw/zinc/61/21/98/1049612198.db2.gz SGTHFJZBFOYJEG-HXUWFJFHSA-N 2 0 338.470 4.069 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H]3CCc4ccccc4OC3)CC2)C1 ZINC000511008210 1049620210 /nfs/dbraw/zinc/62/02/10/1049620210.db2.gz AGORKKOLRAOQTB-DUXKGJEZSA-N 2 0 342.527 4.013 20 0 EIADRP Fc1cccc2c1CC[C@@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001171434021 1049674278 /nfs/dbraw/zinc/67/42/78/1049674278.db2.gz PMPLLEMGYBUIAV-RTBURBONSA-N 2 0 330.491 4.023 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)c1cccc(O)c1 ZINC000716693170 1049700778 /nfs/dbraw/zinc/70/07/78/1049700778.db2.gz OGBURNTVXIMOMX-GIUOSPMZSA-N 2 0 336.479 4.096 20 0 EIADRP CC(C)(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cccc(F)c2C1 ZINC001170972572 1049703433 /nfs/dbraw/zinc/70/34/33/1049703433.db2.gz QSABAKZILKQCBP-BZSNNMDCSA-N 2 0 332.507 4.301 20 0 EIADRP FC1(F)CCC[C@@H]1C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716704540 1049703576 /nfs/dbraw/zinc/70/35/76/1049703576.db2.gz GIHUGJXMZINIDQ-RDGPPVDQSA-N 2 0 334.454 4.065 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+][C@H]1CCc2cc(F)c(F)cc2C1)c1ccccc1 ZINC001171454972 1049708864 /nfs/dbraw/zinc/70/88/64/1049708864.db2.gz XXYISNKAVNGLTM-RXVVDRJESA-N 2 0 344.449 4.105 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2ccccc2Oc2cccnc2)[C@@H](C)C1 ZINC000245412717 1049710725 /nfs/dbraw/zinc/71/07/25/1049710725.db2.gz AWSHODHLRMKYBK-FXAWDEMLSA-N 2 0 339.483 4.036 20 0 EIADRP Cc1cccc2c1CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC001171551555 1049753711 /nfs/dbraw/zinc/75/37/11/1049753711.db2.gz QEMPQVNZFGECDU-GMAHTHKFSA-N 2 0 348.534 4.354 20 0 EIADRP Cc1cccc2c1CC[C@@H]([N@H+](C)C[C@@H]1CC[NH+](Cc3ccccc3)C1)C2 ZINC001171573528 1049759490 /nfs/dbraw/zinc/75/94/90/1049759490.db2.gz IYVKHQYLIGSPFI-JTHBVZDNSA-N 2 0 348.534 4.306 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CCC(C(F)(F)F)C(F)(F)F)CC1(C)C ZINC001171628572 1049762559 /nfs/dbraw/zinc/76/25/59/1049762559.db2.gz BLJNBYMPXYPFIP-UHFFFAOYSA-N 2 0 348.375 4.358 20 0 EIADRP C[C@H]([NH3+])c1ncc(-c2ccccc2)n1C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171623867 1049767814 /nfs/dbraw/zinc/76/78/14/1049767814.db2.gz HZJBJDYGHXOAFN-HNNXBMFYSA-N 2 0 340.515 4.394 20 0 EIADRP C[NH+]1C(C)(C)CC([N@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)CC1(C)C ZINC001171626889 1049769274 /nfs/dbraw/zinc/76/92/74/1049769274.db2.gz GCRLYJWGKYQRRU-QAQDUYKDSA-N 3 0 337.596 4.256 20 0 EIADRP C[NH+]1C(C)(C)CC([N@@H+]2CCSC[C@@H]2c2ccccc2)CC1(C)C ZINC001171640035 1049779949 /nfs/dbraw/zinc/77/99/49/1049779949.db2.gz ZXYCUUNCSIXLQH-GOSISDBHSA-N 2 0 332.557 4.428 20 0 EIADRP C[NH+]1C(C)(C)CC([NH+]2CCC3(COc4ccccc43)CC2)CC1(C)C ZINC001171643008 1049780364 /nfs/dbraw/zinc/78/03/64/1049780364.db2.gz PBXCYYZTGJWKAG-UHFFFAOYSA-N 2 0 342.527 4.064 20 0 EIADRP C[C@H]([NH3+])c1ccc2c(ccn2[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC001171726747 1049785271 /nfs/dbraw/zinc/78/52/71/1049785271.db2.gz HYUKEBSYGJXHJT-XGHQBKJUSA-N 2 0 333.479 4.497 20 0 EIADRP Cc1ccc2c(c1)c(CC[NH3+])cn2[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171727764 1049785389 /nfs/dbraw/zinc/78/53/89/1049785389.db2.gz XPSVBZMJBISYAB-GHTZIAJQSA-N 2 0 347.506 4.286 20 0 EIADRP C[C@H]([NH3+])c1cn([C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171740729 1049802141 /nfs/dbraw/zinc/80/21/41/1049802141.db2.gz LEFBZQQWOYYPFO-LNLFQRSKSA-N 2 0 333.479 4.497 20 0 EIADRP CC1(C)C[C@@H]([NH2+]C[C@H]2CCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171967083 1049827479 /nfs/dbraw/zinc/82/74/79/1049827479.db2.gz XFXZRKVNDUCNNF-ROUUACIJSA-N 2 0 336.470 4.455 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CC2CC(F)(F)C2)ccc1OC ZINC000813872734 1049827725 /nfs/dbraw/zinc/82/77/25/1049827725.db2.gz KFINHISYUGGLFQ-AWEZNQCLSA-N 2 0 340.458 4.233 20 0 EIADRP CC[NH+](CC)CCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171967451 1049828073 /nfs/dbraw/zinc/82/80/73/1049828073.db2.gz MCUFNQAKVLLGFX-OAQYLSRUSA-N 3 0 345.575 4.141 20 0 EIADRP CC1(C)C[C@H]([NH2+]C[C@H]2CCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171967086 1049828252 /nfs/dbraw/zinc/82/82/52/1049828252.db2.gz XFXZRKVNDUCNNF-ZWKOTPCHSA-N 2 0 336.470 4.455 20 0 EIADRP CCOC1CCC([NH2+][C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171980627 1049838817 /nfs/dbraw/zinc/83/88/17/1049838817.db2.gz SHXZTRVAZQKWKU-KBWCOIMZSA-N 2 0 344.543 4.367 20 0 EIADRP C[NH2+]Cc1ccc(N[C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)cc1 ZINC001171985743 1049840318 /nfs/dbraw/zinc/84/03/18/1049840318.db2.gz ZJJNVBQHDVHAAW-NRFANRHFSA-N 2 0 337.511 4.261 20 0 EIADRP C[N@H+](C1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCc2cccc(F)c2C1 ZINC001171014369 1049841319 /nfs/dbraw/zinc/84/13/19/1049841319.db2.gz YYMBIIVXFTWQNB-HXUWFJFHSA-N 2 0 344.518 4.412 20 0 EIADRP CS[C@@H]1CCC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000245738948 1049844487 /nfs/dbraw/zinc/84/44/87/1049844487.db2.gz RFUHKMZCLCDMOQ-JRSUCEMESA-N 2 0 344.568 4.446 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@H]2CCc4ncccc42)C3)cc1 ZINC001172077020 1049844413 /nfs/dbraw/zinc/84/44/13/1049844413.db2.gz OGECTQHXZGKJCB-GJPOJAMWSA-N 2 0 347.506 4.244 20 0 EIADRP FC1(F)C[C@]12CC[N@@H+]([C@@H]1C[C@H]3CCC[C@@H](C1)[NH+]3Cc1ccccc1)C2 ZINC001172074410 1049844666 /nfs/dbraw/zinc/84/46/66/1049844666.db2.gz IRDZIINYEOOPCE-YRPNKDGESA-N 2 0 346.465 4.303 20 0 EIADRP C[N@H+](C[C@@H]1CCCCO1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076441 1049844712 /nfs/dbraw/zinc/84/47/12/1049844712.db2.gz YOKNTWVFPLFCQJ-LRSLUSHPSA-N 2 0 342.527 4.073 20 0 EIADRP Fc1ccccc1CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245746919 1049845577 /nfs/dbraw/zinc/84/55/77/1049845577.db2.gz SSFBICODDTUSFK-WKCHPHFGSA-N 2 0 338.470 4.153 20 0 EIADRP CC(C)N([C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)(C)C[NH3+] ZINC001172079168 1049846710 /nfs/dbraw/zinc/84/67/10/1049846710.db2.gz MPWZEBRRXDPQCZ-AERCQKQUSA-N 2 0 343.559 4.020 20 0 EIADRP Cc1cc2c(cn1)CN([C@@H]1C[C@H]3CCC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC001172082888 1049847836 /nfs/dbraw/zinc/84/78/36/1049847836.db2.gz NAZSVDZTYCPTFQ-NUNAXRQHSA-N 2 0 347.506 4.291 20 0 EIADRP [NH3+]CCc1ccc(N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC001172062283 1049849391 /nfs/dbraw/zinc/84/93/91/1049849391.db2.gz LUCAPIZOWFWNDK-NUNAXRQHSA-N 2 0 349.522 4.185 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccncc1 ZINC001172064788 1049851913 /nfs/dbraw/zinc/85/19/13/1049851913.db2.gz JPPHKUJKYSZQNR-MVWVFHAYSA-N 2 0 335.495 4.318 20 0 EIADRP COC1CCC([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172070027 1049852331 /nfs/dbraw/zinc/85/23/31/1049852331.db2.gz IXJKXAMNDOMHJC-PLZZICSBSA-N 2 0 342.527 4.119 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@]3(CCc4c3cccc4F)C1)C2 ZINC001172133612 1049854979 /nfs/dbraw/zinc/85/49/79/1049854979.db2.gz UACFFLSCCOQYKS-SUWCGCSTSA-N 2 0 342.502 4.121 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccccc1N1CCCCCC1)C2 ZINC001172103758 1049856775 /nfs/dbraw/zinc/85/67/75/1049856775.db2.gz XLTCMMHIEIBZKG-MZADTFQBSA-N 2 0 341.543 4.172 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1)C2 ZINC001172105745 1049856930 /nfs/dbraw/zinc/85/69/30/1049856930.db2.gz KARUCVQYMGEBFW-MUJYYYPQSA-N 2 0 346.824 4.464 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2C)c1cccc(C(F)(F)F)c1 ZINC001172108182 1049857023 /nfs/dbraw/zinc/85/70/23/1049857023.db2.gz REOSQAJJWQODAB-SJWGOKEGSA-N 2 0 326.406 4.371 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCCc1cccc(C(F)(F)F)c1)C2 ZINC001172104248 1049857072 /nfs/dbraw/zinc/85/70/72/1049857072.db2.gz BHIRKRBYNMGKED-NNZMDNLPSA-N 2 0 340.433 4.243 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](CC1CCOCC1)c1ccccc1)C2 ZINC001172108403 1049857682 /nfs/dbraw/zinc/85/76/82/1049857682.db2.gz AAORPMLCJSBXIZ-LRSLUSHPSA-N 2 0 342.527 4.149 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC1(Cc3cccc(Cl)c3)CC1)C2 ZINC001172112632 1049858126 /nfs/dbraw/zinc/85/81/26/1049858126.db2.gz YBXIYMCRKMEVIQ-LDLYASANSA-N 2 0 332.919 4.268 20 0 EIADRP C[N@H+](C1CC[NH+](C2CCCCC2)CC1)[C@@H]1CSc2ccccc2C1 ZINC001172208079 1049864982 /nfs/dbraw/zinc/86/49/82/1049864982.db2.gz NBHDFDYZGBVUKH-FQEVSTJZSA-N 2 0 344.568 4.432 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cc(C3CC3)no2)CC1)CC(C)C ZINC000660170531 1049868371 /nfs/dbraw/zinc/86/83/71/1049868371.db2.gz HCSKELIWADTBBH-UHFFFAOYSA-N 2 0 333.520 4.132 20 0 EIADRP CC[C@@H](C)OCC[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172315278 1049875694 /nfs/dbraw/zinc/87/56/94/1049875694.db2.gz BLJRQWGABSLJAU-FTSHXLFYSA-N 2 0 344.543 4.365 20 0 EIADRP CC[C@H](C)OCC[C@@H](C)[N@H+](C)C1CCN(Cc2ccccc2)CC1 ZINC001172327954 1049885645 /nfs/dbraw/zinc/88/56/45/1049885645.db2.gz AENGEPFONOVMPI-MOPGFXCFSA-N 2 0 332.532 4.177 20 0 EIADRP CC(C)OCC[C@@H](C)[NH2+]CCC1CC[NH+](Cc2ccccc2)CC1 ZINC001172430382 1049901969 /nfs/dbraw/zinc/90/19/69/1049901969.db2.gz FROQUTSYGVCGFY-LJQANCHMSA-N 2 0 332.532 4.082 20 0 EIADRP CCCCCC[C@@H](CCC)[NH2+][C@H](CCC[NH3+])NC(=O)OC(C)(C)C ZINC001172391975 1049906017 /nfs/dbraw/zinc/90/60/17/1049906017.db2.gz UTBMGFHUXHYFHE-SJORKVTESA-N 2 0 343.556 4.305 20 0 EIADRP CC[NH+]1CCC(CC2CC[NH+]([C@H](C)CCOCC(C)C)CC2)CC1 ZINC001172485273 1049911053 /nfs/dbraw/zinc/91/10/53/1049911053.db2.gz VOHWMXGSDRRQIQ-LJQANCHMSA-N 2 0 338.580 4.272 20 0 EIADRP Cc1ccccc1C[N@@H+]([C@H](C)CCOC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172445804 1049914849 /nfs/dbraw/zinc/91/48/49/1049914849.db2.gz UDMHMQMOYQQXPX-HMXCVIKNSA-N 2 0 332.532 4.271 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]C(C)(C)CC[NH+](C)C ZINC001172567256 1049937233 /nfs/dbraw/zinc/93/72/33/1049937233.db2.gz BGDZDOFQNKPSIT-GFCCVEGCSA-N 2 0 332.866 4.259 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cnc3ccsc3c2)C1 ZINC000246356487 1049959226 /nfs/dbraw/zinc/95/92/26/1049959226.db2.gz ICLXUSJAOKYSIV-CVEARBPZSA-N 2 0 331.529 4.315 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(Br)s2)C1 ZINC000246902203 1050005263 /nfs/dbraw/zinc/00/52/63/1050005263.db2.gz FLKUXUWKOIVNGJ-CHWSQXEVSA-N 2 0 345.350 4.282 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000248410270 1050055835 /nfs/dbraw/zinc/05/58/35/1050055835.db2.gz XWFVSDGZTDXWMT-LXZJYRNTSA-N 2 0 344.543 4.430 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000248410269 1050055899 /nfs/dbraw/zinc/05/58/99/1050055899.db2.gz XWFVSDGZTDXWMT-AJYBTWMASA-N 2 0 344.543 4.430 20 0 EIADRP C[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C)c1ccc(C(F)(F)F)cc1 ZINC000249115238 1050092289 /nfs/dbraw/zinc/09/22/89/1050092289.db2.gz SEHWPXBTUMHCPE-UMPJEAMMSA-N 2 0 328.422 4.127 20 0 EIADRP c1ccc2c(c1)CCC[C@H]2C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC001177181039 1050164548 /nfs/dbraw/zinc/16/45/48/1050164548.db2.gz UTAGWSPLQGVONQ-IBGZPJMESA-N 2 0 326.528 4.493 20 0 EIADRP CC[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC001177191135 1050167008 /nfs/dbraw/zinc/16/70/08/1050167008.db2.gz LMWYGZZUIBWSQQ-PZJWPPBQSA-N 2 0 330.516 4.220 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc3ccccc3)C1)CC2 ZINC001172825423 1050167045 /nfs/dbraw/zinc/16/70/45/1050167045.db2.gz GXKYYGRURNLFIJ-XUZZJYLKSA-N 2 0 348.534 4.354 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([NH2+][C@@H]1CCN(Cc3ccccc3)C[C@@H]1C)CC2 ZINC001172837773 1050174022 /nfs/dbraw/zinc/17/40/22/1050174022.db2.gz MWUAHBKSJWLZRK-WUMKDDEVSA-N 2 0 348.534 4.353 20 0 EIADRP CCO[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)C1 ZINC001177256388 1050175633 /nfs/dbraw/zinc/17/56/33/1050175633.db2.gz DYPAKMVNKXKTPW-BVYCBKJFSA-N 2 0 344.543 4.356 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2cc(F)cc(Cl)c2)C1 ZINC001177289360 1050176917 /nfs/dbraw/zinc/17/69/17/1050176917.db2.gz FEIPOJLDYPWTBL-GASCZTMLSA-N 2 0 326.887 4.327 20 0 EIADRP CCOc1cccc(F)c1C[NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC001177290062 1050177015 /nfs/dbraw/zinc/17/70/15/1050177015.db2.gz LQDNFICWAQTSCP-IAGOWNOFSA-N 2 0 336.495 4.072 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[NH+]1C(C)(C)CC([NH3+])CC1(C)C ZINC001172845881 1050183935 /nfs/dbraw/zinc/18/39/35/1050183935.db2.gz QBAJSTOAAGUGCF-GFCCVEGCSA-N 2 0 326.887 4.390 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)[NH+]1C(C)(C)CC([NH3+])CC1(C)C ZINC001172845882 1050184258 /nfs/dbraw/zinc/18/42/58/1050184258.db2.gz QBAJSTOAAGUGCF-LBPRGKRZSA-N 2 0 326.887 4.390 20 0 EIADRP CC(C)[NH+]1CCC(C[NH2+][C@H](C)Cc2c(F)cccc2Cl)CC1 ZINC001172846777 1050186739 /nfs/dbraw/zinc/18/67/39/1050186739.db2.gz XPCUGYOAUQUGEJ-CQSZACIVSA-N 2 0 326.887 4.120 20 0 EIADRP CCc1nc2c(s1)[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)CCC2 ZINC000090586922 1050188129 /nfs/dbraw/zinc/18/81/29/1050188129.db2.gz RQXDKKINSMBAAX-JKSUJKDBSA-N 2 0 335.561 4.041 20 0 EIADRP CC(C)[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2c(F)cccc2Cl)[C@H](C)C1 ZINC001172849531 1050188923 /nfs/dbraw/zinc/18/89/23/1050188923.db2.gz NPSIXVIBKSUVMT-LBTNJELSSA-N 2 0 326.887 4.119 20 0 EIADRP Cc1ccccc1CN1CCC([NH2+]Cc2cc3ccccc3n2C)CC1 ZINC001177315287 1050189926 /nfs/dbraw/zinc/18/99/26/1050189926.db2.gz SOSXPGDPWBYOLW-UHFFFAOYSA-N 2 0 347.506 4.241 20 0 EIADRP CC(C)[NH+]1CCC(C[NH2+][C@H](C)Cc2ccc(F)cc2Cl)CC1 ZINC001172863772 1050200281 /nfs/dbraw/zinc/20/02/81/1050200281.db2.gz QBKRCQYMOGIYAZ-CQSZACIVSA-N 2 0 326.887 4.120 20 0 EIADRP C[C@@H](CSc1ccc(Cl)cc1)[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001172881686 1050222044 /nfs/dbraw/zinc/22/20/44/1050222044.db2.gz KQYIXKUKCVQNQP-HNNXBMFYSA-N 2 0 338.948 4.238 20 0 EIADRP C[C@@H](CSc1ccc(Cl)cc1)[NH2+]CCC[NH+]1CCCCC1 ZINC001172881693 1050223122 /nfs/dbraw/zinc/22/31/22/1050223122.db2.gz HOXNYGBYSAZFRG-HNNXBMFYSA-N 2 0 326.937 4.286 20 0 EIADRP CO[C@H]1CCC[C@H]([N@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172928120 1050238796 /nfs/dbraw/zinc/23/87/96/1050238796.db2.gz IXZRQQUZHITUAG-TUFLPTIASA-N 2 0 330.516 4.025 20 0 EIADRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)CCO1 ZINC001177566647 1050255658 /nfs/dbraw/zinc/25/56/58/1050255658.db2.gz YFUUGMVKDJSXQV-VXKWHMMOSA-N 2 0 344.543 4.356 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)C2CCC3(CCOCC3)CC2)CC1 ZINC001173043737 1050270598 /nfs/dbraw/zinc/27/05/98/1050270598.db2.gz IAHLUUSCUWMMGV-UAPYVXQJSA-N 2 0 334.548 4.240 20 0 EIADRP C(CC[NH2+][C@@H]1CCC[C@H](C2CCOCC2)C1)CC[NH+]1CCCCC1 ZINC001177678987 1050275906 /nfs/dbraw/zinc/27/59/06/1050275906.db2.gz HYNOZCVLSHWUSY-LEWJYISDSA-N 2 0 336.564 4.218 20 0 EIADRP CCCC1CCC([NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)CC1 ZINC001177674151 1050276526 /nfs/dbraw/zinc/27/65/26/1050276526.db2.gz NQKMQOAOBPYZRO-UHFFFAOYSA-N 2 0 332.532 4.466 20 0 EIADRP CCCOC1CCC([N@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001173094396 1050284648 /nfs/dbraw/zinc/28/46/48/1050284648.db2.gz XIGMSVTWGGQXJA-IJDVVPKISA-N 2 0 344.543 4.496 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](c2ccccc2)c2ccncc2)CC1 ZINC001173101365 1050302082 /nfs/dbraw/zinc/30/20/82/1050302082.db2.gz HNCQJIODLMMOMQ-HRTMPFAESA-N 2 0 337.511 4.414 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2cc(Cl)nc(Cl)c2)CC1 ZINC001173102232 1050303653 /nfs/dbraw/zinc/30/36/53/1050303653.db2.gz VPPICTQQAYETOL-UHFFFAOYSA-N 2 0 330.303 4.131 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccc3c(c2)CC(C)(C)O3)CC1 ZINC001173103152 1050304449 /nfs/dbraw/zinc/30/44/49/1050304449.db2.gz HGOQGPQSAJYBPT-UHFFFAOYSA-N 2 0 330.516 4.143 20 0 EIADRP c1cn2c(cccc2C[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)n1 ZINC001177803699 1050304937 /nfs/dbraw/zinc/30/49/37/1050304937.db2.gz DDEKNZJSZMFTKE-UHFFFAOYSA-N 2 0 348.494 4.000 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](CCO)c2cccc(Cl)c2)CC1 ZINC001173104286 1050306361 /nfs/dbraw/zinc/30/63/61/1050306361.db2.gz MEZPDORDVQHQAI-CTWPCTMYSA-N 2 0 338.923 4.006 20 0 EIADRP CC[NH+](CC)C1CCC(n2c3ccccc3c3c2C[C@@H]([NH3+])CC3)CC1 ZINC001173107723 1050307539 /nfs/dbraw/zinc/30/75/39/1050307539.db2.gz KBNCLWHTUGJEMS-AOCRQIFASA-N 2 0 339.527 4.283 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCc2ccc3ccccc3n2)CC1 ZINC001173107476 1050307600 /nfs/dbraw/zinc/30/76/00/1050307600.db2.gz SUABSQUPWKCIHJ-UHFFFAOYSA-N 2 0 325.500 4.020 20 0 EIADRP CC[NH+](CC)C1CCC([N@H+](CC(C)(C)C)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001173106777 1050307840 /nfs/dbraw/zinc/30/78/40/1050307840.db2.gz SBIGRQTVXULNAF-OFVLBHHSSA-N 3 0 337.596 4.257 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCOc2ccccc2SC)CC1 ZINC001173107847 1050307940 /nfs/dbraw/zinc/30/79/40/1050307940.db2.gz PJXWHJWMNMLEOQ-UHFFFAOYSA-N 2 0 336.545 4.030 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](c2ccncc2Cl)C2CC2)CC1 ZINC001173107043 1050308105 /nfs/dbraw/zinc/30/81/05/1050308105.db2.gz UXRYYRWOXYDRIZ-RJYAGPCLSA-N 2 0 335.923 4.429 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2(Cc3cccc(OC)c3)CC2)CC1 ZINC001173109363 1050308541 /nfs/dbraw/zinc/30/85/41/1050308541.db2.gz DEQOZIXGXWODAE-UHFFFAOYSA-N 2 0 330.516 4.013 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CC[C@@H](c3ccc(OC)cc3)C2)CC1 ZINC001173113487 1050309592 /nfs/dbraw/zinc/30/95/92/1050309592.db2.gz QNIPKBWUMCEKAE-XEVCZEQESA-N 2 0 330.516 4.138 20 0 EIADRP C1CCC2(CC1)CCC([NH2+][C@H]1CC[C@H]([NH+]3CCOCC3)CC1)CC2 ZINC001173119125 1050315876 /nfs/dbraw/zinc/31/58/76/1050315876.db2.gz XGWJJEXZTVKMOM-KESTWPANSA-N 2 0 334.548 4.113 20 0 EIADRP C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001173208755 1050367597 /nfs/dbraw/zinc/36/75/97/1050367597.db2.gz BPZSPRLQBZQCBE-ZFJSRUIDSA-N 2 0 348.534 4.481 20 0 EIADRP CC[N@H+]1C[C@@H]2C[NH+]([C@H](C)CC(c3ccccc3)c3ccccc3)C[C@@H]2C1 ZINC001173213749 1050372159 /nfs/dbraw/zinc/37/21/59/1050372159.db2.gz HONRGJXYNZYDOQ-PTUXOGIPSA-N 2 0 348.534 4.481 20 0 EIADRP CCc1ccc(C[C@H](C)[NH2+]CC2CC[NH+](CC3CCC3)CC2)cc1 ZINC001173242519 1050397750 /nfs/dbraw/zinc/39/77/50/1050397750.db2.gz VKCHYBXZISGNBS-SFHVURJKSA-N 2 0 328.544 4.282 20 0 EIADRP COCc1c(C)cc(C)c(C[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)c1C ZINC001178250006 1050409544 /nfs/dbraw/zinc/40/95/44/1050409544.db2.gz ZLHBRIWGYIOOQS-FQEVSTJZSA-N 2 0 346.559 4.216 20 0 EIADRP CC[N@H+]([C@H]1CCOC1)C1CC[NH+]([C@@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173343035 1050432465 /nfs/dbraw/zinc/43/24/65/1050432465.db2.gz GKYKFAJMGBBABW-RTWAWAEBSA-N 2 0 348.575 4.455 20 0 EIADRP CC[N@@H+]1CC[C@H](n2cc(C[NH2+]Cc3ccccc3)c3ccccc32)C1 ZINC001173367369 1050442902 /nfs/dbraw/zinc/44/29/02/1050442902.db2.gz GXBCXPQXBXQQMQ-FQEVSTJZSA-N 2 0 333.479 4.198 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc(Br)cs2)C1 ZINC000253355222 1050454635 /nfs/dbraw/zinc/45/46/35/1050454635.db2.gz FBVDPBPAPAFXNI-CHWSQXEVSA-N 2 0 345.350 4.282 20 0 EIADRP COC(=O)CCCC[C@@H](C)[NH2+]CCCCCCCCCCC[NH3+] ZINC001173444568 1050463377 /nfs/dbraw/zinc/46/33/77/1050463377.db2.gz KSBSILOOOJXOPV-GOSISDBHSA-N 2 0 328.541 4.168 20 0 EIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cccc(Cl)c1 ZINC000092856883 1050481262 /nfs/dbraw/zinc/48/12/62/1050481262.db2.gz SUTGTHFRTCFJIZ-OAHLLOKOSA-N 2 0 329.875 4.302 20 0 EIADRP c1ccc(Oc2cccc(C[NH2+]CC3CC[NH+](C4CC4)CC3)c2)cc1 ZINC001178605160 1050516268 /nfs/dbraw/zinc/51/62/68/1050516268.db2.gz DZMJNRIFFXURRK-UHFFFAOYSA-N 2 0 336.479 4.443 20 0 EIADRP CCOC(=O)C[C@@H]1CC[C@H]([NH2+]CCCCCCCCCCC[NH3+])C1 ZINC001173654085 1050535331 /nfs/dbraw/zinc/53/53/31/1050535331.db2.gz RLVMMZGPRJMAIA-MOPGFXCFSA-N 2 0 340.552 4.168 20 0 EIADRP Cc1cc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)ccc1Oc1ccccc1 ZINC001206209689 1050536323 /nfs/dbraw/zinc/53/63/23/1050536323.db2.gz IBHJEAWSWLQLRE-OALUTQOASA-N 2 0 328.431 4.049 20 0 EIADRP c1ccc2c(c1)CCC21CCC([NH2+]CCCC[NH+]2CCCC2)CC1 ZINC001173688205 1050539701 /nfs/dbraw/zinc/53/97/01/1050539701.db2.gz YEXIFWSAEJCAQK-UHFFFAOYSA-N 2 0 326.528 4.279 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)[C@@H]1CCC[C@@H](C)C1 ZINC001178962040 1050599902 /nfs/dbraw/zinc/59/99/02/1050599902.db2.gz ATJNVBXWFARBJJ-SVFBPWRDSA-N 2 0 344.543 4.466 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ccsc2)ccc1OC ZINC000182423740 1050651124 /nfs/dbraw/zinc/65/11/24/1050651124.db2.gz JPMMXTUSPBJOBI-HNNXBMFYSA-N 2 0 332.513 4.449 20 0 EIADRP CC(C)[C@@H](C[NH2+][C@H](CC[NH+](C)C)c1cccnc1)c1ccccc1 ZINC001179636701 1050745610 /nfs/dbraw/zinc/74/56/10/1050745610.db2.gz KLKVFUZTLXWNQM-NHCUHLMSSA-N 2 0 325.500 4.104 20 0 EIADRP CC[NH+]1CCC(C[N@H+](CCc2ccccc2)Cc2ccccc2)CC1 ZINC001180103231 1050888350 /nfs/dbraw/zinc/88/83/50/1050888350.db2.gz HMGXNLGLAIDEHT-UHFFFAOYSA-N 2 0 336.523 4.463 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccccc2NC)CC1)CC1CC1 ZINC001180323286 1050968284 /nfs/dbraw/zinc/96/82/84/1050968284.db2.gz YFBONVAOYPPSTO-UHFFFAOYSA-N 2 0 329.532 4.062 20 0 EIADRP Cc1ccc(CN2CCC(C[NH+]3CCCCCC3)CC2)nc1Cl ZINC001190318223 1051148558 /nfs/dbraw/zinc/14/85/58/1051148558.db2.gz LOWYSHWJQQJNGB-UHFFFAOYSA-N 2 0 335.923 4.131 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000775378985 1051170294 /nfs/dbraw/zinc/17/02/94/1051170294.db2.gz OTMRNVPXJFQJPN-CXAGYDPISA-N 2 0 340.483 4.310 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@H]1CCCc2cc(SC(F)F)ccc21 ZINC000775382353 1051174714 /nfs/dbraw/zinc/17/47/14/1051174714.db2.gz NWIZBATVOKYOLZ-INIZCTEOSA-N 2 0 328.472 4.310 20 0 EIADRP C(CCC[NH2+][C@@H]1CC[C@@H]2SCCS[C@H]12)CCC[NH+]1CCCC1 ZINC000775385085 1051176118 /nfs/dbraw/zinc/17/61/18/1051176118.db2.gz IXZRFYXGVGZKRO-FGTMMUONSA-N 2 0 342.618 4.002 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000775388772 1051187026 /nfs/dbraw/zinc/18/70/26/1051187026.db2.gz TVIZAXSSTPSNNB-CXAGYDPISA-N 2 0 340.483 4.310 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@@H]2CCO[C@H](C)C2)ccc1OC ZINC000775398524 1051228150 /nfs/dbraw/zinc/22/81/50/1051228150.db2.gz AKWVPSSFMLKQPC-FGTMMUONSA-N 2 0 348.531 4.003 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC001181514338 1051245762 /nfs/dbraw/zinc/24/57/62/1051245762.db2.gz GCADNEFXOKPYPC-KRWDZBQOSA-N 2 0 340.433 4.178 20 0 EIADRP CCCN(CCC[NH+](C)C)Cc1ccc(-c2cccc(F)c2F)o1 ZINC001181515645 1051252678 /nfs/dbraw/zinc/25/26/78/1051252678.db2.gz VRQPHMVRWXPZQR-UHFFFAOYSA-N 2 0 336.426 4.389 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@@H]2CCCC(C)(C)O2)CC1 ZINC001190790909 1051280172 /nfs/dbraw/zinc/28/01/72/1051280172.db2.gz GASYBQCUTZOJIJ-NRFANRHFSA-N 2 0 344.543 4.178 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(N(C)c3ccccc3)cc2)C1 ZINC000620762236 1051285799 /nfs/dbraw/zinc/28/57/99/1051285799.db2.gz WAZYHKJJEHUQPP-FQEVSTJZSA-N 2 0 337.511 4.274 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccc[nH]2)ccc1OC ZINC000775425329 1051316972 /nfs/dbraw/zinc/31/69/72/1051316972.db2.gz XTDBTCFPNWNQAY-HOTGVXAUSA-N 2 0 329.488 4.277 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cccc3ncccc23)C1 ZINC001191048958 1051349745 /nfs/dbraw/zinc/34/97/45/1051349745.db2.gz VLVCRMHDWSLVHU-RBUKOAKNSA-N 2 0 337.511 4.321 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+](CCSc1ccc(Cl)cc1)CC2 ZINC001175211042 1051444115 /nfs/dbraw/zinc/44/41/15/1051444115.db2.gz IUCUPNDWLLWGLY-UHFFFAOYSA-N 2 0 338.948 4.240 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000774272124 1051541235 /nfs/dbraw/zinc/54/12/35/1051541235.db2.gz NJPRFZIJDVZKJF-BRIRTLKKSA-N 2 0 327.516 4.098 20 0 EIADRP Cc1csc2sc(C[N@@H+]3CCC[C@](F)(C[NH3+])CC3)c(C)c12 ZINC001205571609 1051555394 /nfs/dbraw/zinc/55/53/94/1051555394.db2.gz VYEMVODJFJPIQO-MRXNPFEDSA-N 2 0 326.506 4.233 20 0 EIADRP C[C@@]1(Cc2ccc(F)c(F)c2)CCC[N@@H+]1CCC[NH+]1CCCCC1 ZINC001175492710 1051617943 /nfs/dbraw/zinc/61/79/43/1051617943.db2.gz QOPDDQYDEPIVLX-FQEVSTJZSA-N 2 0 336.470 4.238 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(SCC(F)F)cc1 ZINC000158102938 1051709676 /nfs/dbraw/zinc/70/96/76/1051709676.db2.gz BFFSAQLGOJJYKT-KBPBESRZSA-N 2 0 328.472 4.036 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc2cc(OC)ccc2c1 ZINC000158162195 1051721608 /nfs/dbraw/zinc/72/16/08/1051721608.db2.gz HJHWZLDLJJYTKR-IERDGZPVSA-N 2 0 326.484 4.231 20 0 EIADRP C[C@H](CC(C)(C)c1ccccc1)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC001183094091 1051785519 /nfs/dbraw/zinc/78/55/19/1051785519.db2.gz HAORXWSGVHPCMQ-UYAOXDASSA-N 2 0 328.544 4.454 20 0 EIADRP C[C@H](CC(C)(C)c1ccccc1)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC001183094090 1051786779 /nfs/dbraw/zinc/78/67/79/1051786779.db2.gz HAORXWSGVHPCMQ-QUCCMNQESA-N 2 0 328.544 4.454 20 0 EIADRP CCc1noc(C)c1C[NH+]1CCC(CC[N@@H+]2CCCC[C@H]2C)CC1 ZINC000158979129 1051803824 /nfs/dbraw/zinc/80/38/24/1051803824.db2.gz JONILGCIXCHSLZ-MRXNPFEDSA-N 2 0 333.520 4.022 20 0 EIADRP C[C@H]1CC(C)(C)CC[C@@H]1[NH2+]CC1(c2ccccc2)CC[NH+](C)CC1 ZINC001183354473 1051826681 /nfs/dbraw/zinc/82/66/81/1051826681.db2.gz CQZLDHRJJWBQRZ-ICSRJNTNSA-N 2 0 328.544 4.454 20 0 EIADRP Cc1ccc(C[N@@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@@]3(C)C2)cc1C ZINC001175973579 1051856399 /nfs/dbraw/zinc/85/63/99/1051856399.db2.gz ODFPASIWGDUIEQ-PKTZIBPZSA-N 2 0 334.507 4.257 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCC(C)(C)CO1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001184045762 1051944608 /nfs/dbraw/zinc/94/46/08/1051944608.db2.gz QCTHVMYNINRUCM-TYPHKJRUSA-N 2 0 344.543 4.082 20 0 EIADRP FC1(F)C[C@@H]1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000621768926 1051944894 /nfs/dbraw/zinc/94/48/94/1051944894.db2.gz WRLQDDHEMYHMCH-MANSERQUSA-N 2 0 334.454 4.065 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2)CC1 ZINC001184135357 1051953245 /nfs/dbraw/zinc/95/32/45/1051953245.db2.gz OYSOAFKRABOLOK-XZFTYKLISA-N 2 0 326.528 4.394 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CC[C@H]2CCC(F)(F)C2)CC1 ZINC001184238698 1051977117 /nfs/dbraw/zinc/97/71/17/1051977117.db2.gz FANRHIHDPDPSER-JFIYKMOQSA-N 2 0 328.491 4.445 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000166070808 1052080813 /nfs/dbraw/zinc/08/08/13/1052080813.db2.gz VWBXYYKZJJVMQK-IRLDBZIGSA-N 2 0 338.495 4.006 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccc(C(C)(C)O)cc1 ZINC000296680146 1052091259 /nfs/dbraw/zinc/09/12/59/1052091259.db2.gz IDKCSJMJXKRKCW-UHFFFAOYSA-N 2 0 340.511 4.046 20 0 EIADRP CC(C)Oc1cccc([C@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000298229877 1052110017 /nfs/dbraw/zinc/11/00/17/1052110017.db2.gz BEGWVYFKOZRRCD-KRWDZBQOSA-N 2 0 339.483 4.188 20 0 EIADRP CC(C)c1ccc(CC[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cc1 ZINC001177117473 1052227854 /nfs/dbraw/zinc/22/78/54/1052227854.db2.gz WJTUTXZMUBLKAE-UHFFFAOYSA-N 2 0 340.511 4.083 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cc(Cl)ccc1O ZINC000184901164 1052297560 /nfs/dbraw/zinc/29/75/60/1052297560.db2.gz PGSKSQCAYGIBEG-HNNXBMFYSA-N 2 0 344.886 4.492 20 0 EIADRP C[C@@H]([NH2+]C1(CN[C@@H]2CC[N@H+](C)C(C)(C)C2)CCCC1)c1ccccc1 ZINC000623427616 1052654317 /nfs/dbraw/zinc/65/43/17/1052654317.db2.gz FTQLKYLPBODQAX-UYAOXDASSA-N 2 0 343.559 4.112 20 0 EIADRP COc1ccc(-c2csc(C[NH2+][C@H]3CC[N@H+](C)C(C)(C)C3)c2)cc1 ZINC000623439007 1052656481 /nfs/dbraw/zinc/65/64/81/1052656481.db2.gz SEUQGNJERSEKGH-KRWDZBQOSA-N 2 0 344.524 4.386 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCOc1ccccc1-c1ccccc1 ZINC000177933374 1052694916 /nfs/dbraw/zinc/69/49/16/1052694916.db2.gz RGILGGXUTLPYBU-LVCYWYKZSA-N 2 0 338.495 4.051 20 0 EIADRP C/C(=C/c1ccccc1OC(F)F)C[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC000623656913 1052697992 /nfs/dbraw/zinc/69/79/92/1052697992.db2.gz FMWKFQBMRXWOLV-QZFKAFNDSA-N 2 0 338.442 4.013 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCCc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000178094102 1052699120 /nfs/dbraw/zinc/69/91/20/1052699120.db2.gz NWFGJEJPICMCCM-VGOFRKELSA-N 2 0 338.495 4.355 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCCc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000178094086 1052699259 /nfs/dbraw/zinc/69/92/59/1052699259.db2.gz NWFGJEJPICMCCM-HTAPYJJXSA-N 2 0 338.495 4.355 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1cccs1 ZINC000178698523 1052711424 /nfs/dbraw/zinc/71/14/24/1052711424.db2.gz PGDGIGPXNNMYNO-SFHVURJKSA-N 2 0 343.540 4.001 20 0 EIADRP C[C@@H]([NH2+]C1(c2ccccc2)CCC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000180347063 1052795842 /nfs/dbraw/zinc/79/58/42/1052795842.db2.gz LRJDQPQXBRAWDV-GOSISDBHSA-N 2 0 338.495 4.357 20 0 EIADRP Fc1ccc(S[C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000623866515 1052824992 /nfs/dbraw/zinc/82/49/92/1052824992.db2.gz YQOTVWTZTDGIBY-LCLWPZTBSA-N 2 0 348.531 4.445 20 0 EIADRP CC[C@H](C)c1ccc([C@H](C)[NH2+][C@H]2CCN(C3CC[NH+](C)CC3)C2)cc1 ZINC000623893127 1052830757 /nfs/dbraw/zinc/83/07/57/1052830757.db2.gz GANPGBCJOPKCKM-WFXMLNOXSA-N 2 0 343.559 4.019 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CCc2csc(-c3ccc(Cl)cc3)n2)CC[N@@H+]1C ZINC000181798911 1052898345 /nfs/dbraw/zinc/89/83/45/1052898345.db2.gz KQODMOVTXGVFBR-BBRMVZONSA-N 2 0 349.931 4.078 20 0 EIADRP c1ccc(C[N@H+]2CC[C@@H](C[NH2+][C@@H]3CCCNc4ccccc43)C2)cc1 ZINC000195138984 1053052516 /nfs/dbraw/zinc/05/25/16/1053052516.db2.gz HNOFEUCVUDALQA-SIKLNZKXSA-N 2 0 335.495 4.045 20 0 EIADRP CC(C)[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)CCO1 ZINC000381195274 1053057546 /nfs/dbraw/zinc/05/75/46/1053057546.db2.gz ZVBSNEPYWJPDKP-FKBYEOEOSA-N 2 0 344.543 4.082 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2cc3ccccc3c(Cl)n2)CC1 ZINC000794550416 1053068417 /nfs/dbraw/zinc/06/84/17/1053068417.db2.gz XAJQFKVIZGFNLC-UHFFFAOYSA-N 2 0 331.891 4.052 20 0 EIADRP Cc1c([C@H](C)NCCC[N@@H+]2CCCC[C@@H]2C)cnn1-c1ccccc1 ZINC000764627581 1053236692 /nfs/dbraw/zinc/23/66/92/1053236692.db2.gz JKQFUUUMTAZEOM-ROUUACIJSA-N 2 0 340.515 4.096 20 0 EIADRP c1cc(C[NH+]2CCC(C[NH2+][C@@H]3CC[C@H]4CCCC[C@@H]4C3)CC2)ccn1 ZINC000850516353 1053279101 /nfs/dbraw/zinc/27/91/01/1053279101.db2.gz BTOSQUNGOSPLGX-YPAWHYETSA-N 2 0 341.543 4.242 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CCc2ccoc2)ccc1OC ZINC000850532320 1053294949 /nfs/dbraw/zinc/29/49/49/1053294949.db2.gz SJCDDAPECJLKGG-INIZCTEOSA-N 2 0 330.472 4.023 20 0 EIADRP COc1ccc(CC[C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000764961017 1053397671 /nfs/dbraw/zinc/39/76/71/1053397671.db2.gz GJEVUWXMXUFTJL-RBUKOAKNSA-N 2 0 332.532 4.118 20 0 EIADRP CCOc1cccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000794829648 1053441439 /nfs/dbraw/zinc/44/14/39/1053441439.db2.gz VOZNHRGEJZUUDX-QUCCMNQESA-N 2 0 338.495 4.258 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccnc(Cl)c1 ZINC000765327366 1053503093 /nfs/dbraw/zinc/50/30/93/1053503093.db2.gz OTHXRPWERPQDGU-INIZCTEOSA-N 2 0 343.902 4.298 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2cnc(-c3cccs3)s2)CC1 ZINC000865765474 1053588063 /nfs/dbraw/zinc/58/80/63/1053588063.db2.gz WPLDSQDDALHBRI-UHFFFAOYSA-N 2 0 335.542 4.224 20 0 EIADRP Fc1ccccc1C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccccc1 ZINC000429509932 1053617386 /nfs/dbraw/zinc/61/73/86/1053617386.db2.gz GSPVDARRPKWYRD-VWPQPMDRSA-N 2 0 338.470 4.326 20 0 EIADRP C[C@@H](CCc1c[nH]c2ccccc12)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000866290671 1053680497 /nfs/dbraw/zinc/68/04/97/1053680497.db2.gz WLIDSJJUTGBMPT-INIZCTEOSA-N 2 0 327.516 4.342 20 0 EIADRP C[C@@H](CCc1cncc2ccccc21)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000866310822 1053687416 /nfs/dbraw/zinc/68/74/16/1053687416.db2.gz WHIIBWLSMWCGNR-XPQZIERPSA-N 2 0 339.527 4.266 20 0 EIADRP CCOc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000386416531 1053713687 /nfs/dbraw/zinc/71/36/87/1053713687.db2.gz YTOLFOWGZUAATJ-WIYYLYMNSA-N 2 0 338.495 4.086 20 0 EIADRP C[C@@H]([NH2+]CCC1CC[NH+](Cc2ccccc2)CC1)c1cncs1 ZINC000866469733 1053741630 /nfs/dbraw/zinc/74/16/30/1053741630.db2.gz KRDHXIZBDZCDSH-MRXNPFEDSA-N 2 0 329.513 4.096 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@@H](c2ccccc2)C2CCOCC2)CC1 ZINC000866516772 1053764244 /nfs/dbraw/zinc/76/42/44/1053764244.db2.gz UHIBSZRPSIEVDE-KBWCOIMZSA-N 2 0 330.516 4.007 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCc2ccccc2C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386546131 1053771143 /nfs/dbraw/zinc/77/11/43/1053771143.db2.gz SFZXELNJKSBGRT-CDNPAEQRSA-N 2 0 334.507 4.044 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+][C@@H](Cc2cccnc2)C2CCCC2)CC1 ZINC000866607110 1053802496 /nfs/dbraw/zinc/80/24/96/1053802496.db2.gz AKASGGHJTNLTLW-FQEVSTJZSA-N 2 0 329.532 4.035 20 0 EIADRP CC(C)C[N@H+](CCSC1CCCCC1)CC1CC[NH+](C)CC1 ZINC001197194709 1053850904 /nfs/dbraw/zinc/85/09/04/1053850904.db2.gz SUSAQDPOSFCHBE-UHFFFAOYSA-N 2 0 326.594 4.352 20 0 EIADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1csc(-c2ccc(F)cc2)n1 ZINC000387363695 1053892471 /nfs/dbraw/zinc/89/24/71/1053892471.db2.gz VGWIXOSNDKQINH-UHFFFAOYSA-N 2 0 335.492 4.159 20 0 EIADRP CC(C)C[C@@H](C)C[N@@H+]1CC[C@@H](Oc2ccnc(C[NH+](C)C(C)C)c2)C1 ZINC000856559698 1054084256 /nfs/dbraw/zinc/08/42/56/1054084256.db2.gz SMUOPAJPWAIMNW-WIYYLYMNSA-N 2 0 347.547 4.057 20 0 EIADRP C[NH+](C)[C@H]1CCC[N@H+](CCCSc2ccccc2Cl)CC1 ZINC000429554335 1054125493 /nfs/dbraw/zinc/12/54/93/1054125493.db2.gz SDDVXVCBIWHKAO-HNNXBMFYSA-N 2 0 326.937 4.238 20 0 EIADRP CC(C)(C)[C@H]1CC[N@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CCO1 ZINC001198799942 1054272182 /nfs/dbraw/zinc/27/21/82/1054272182.db2.gz GFCOXHSTTMXWMR-OAQYLSRUSA-N 2 0 344.543 4.310 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H]2CC(C)(C)Sc3ccccc32)CC1 ZINC000872030332 1054348183 /nfs/dbraw/zinc/34/81/83/1054348183.db2.gz DAJMBWUMJPBVKW-GOSISDBHSA-N 2 0 348.556 4.093 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2c(Cl)ccc3cccnc32)c1 ZINC001199219300 1054366646 /nfs/dbraw/zinc/36/66/46/1054366646.db2.gz LNVMBIVEXSBXBP-UHFFFAOYSA-N 2 0 339.870 4.240 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cc(F)ccc1OC(F)F ZINC001199336845 1054388734 /nfs/dbraw/zinc/38/87/34/1054388734.db2.gz YJBHKSNGDUFIBC-CQSZACIVSA-N 2 0 344.421 4.171 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CC[C@H](C)[C@H](C)C1 ZINC001199329097 1054392352 /nfs/dbraw/zinc/39/23/52/1054392352.db2.gz NEAYVFVJFIKHQO-NLWGTHIKSA-N 2 0 332.532 4.322 20 0 EIADRP CC(C)C1CCC(C[NH2+]Cc2cccc(OCC[NH+](C)C)c2)CC1 ZINC001199384487 1054402418 /nfs/dbraw/zinc/40/24/18/1054402418.db2.gz SKZHRIKEPPHWEX-UHFFFAOYSA-N 2 0 332.532 4.179 20 0 EIADRP CC(C)(C)[C@H](Cn1ccnc1)[NH2+]Cc1cccc(-c2ccccn2)c1 ZINC001199608474 1054431513 /nfs/dbraw/zinc/43/15/13/1054431513.db2.gz HQMYIPIYBRMYQE-FQEVSTJZSA-N 2 0 334.467 4.150 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CCO1 ZINC001199629671 1054435321 /nfs/dbraw/zinc/43/53/21/1054435321.db2.gz LRCRXIZUNPPZKK-XLIONFOSSA-N 2 0 330.516 4.108 20 0 EIADRP CC[C@@H]1C[C@@H](C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)CCO1 ZINC001199896511 1054484154 /nfs/dbraw/zinc/48/41/54/1054484154.db2.gz MXEGSAHROKSQOJ-RBBKRZOGSA-N 2 0 344.543 4.357 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccc(SC(F)F)cc1 ZINC000858490897 1054499464 /nfs/dbraw/zinc/49/94/64/1054499464.db2.gz RUNKDZPYWUVZSI-UONOGXRCSA-N 2 0 328.472 4.384 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@H](C)c2ccns2)ccc1OC ZINC000858577438 1054525746 /nfs/dbraw/zinc/52/57/46/1054525746.db2.gz PWPNVXZKHVHODR-LSDHHAIUSA-N 2 0 347.528 4.405 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(OC(F)F)cc2)CC1 ZINC000057754826 1054540399 /nfs/dbraw/zinc/54/03/99/1054540399.db2.gz AYWISPRWTJUHNT-UHFFFAOYSA-N 2 0 340.458 4.232 20 0 EIADRP CC(C)Cc1ccc(C[NH2+]C2CCC([NH+]3CCCCC3)CC2)cn1 ZINC001200879870 1054566220 /nfs/dbraw/zinc/56/62/20/1054566220.db2.gz OPTITHSOYQUJGP-UHFFFAOYSA-N 2 0 329.532 4.167 20 0 EIADRP CC(CC[NH2+][C@H](C)c1ccns1)CC[NH2+][C@H](C)c1ccns1 ZINC000860058839 1054765892 /nfs/dbraw/zinc/76/58/92/1054765892.db2.gz JFRFOWVOXJXYRD-ZIAGYGMSSA-N 2 0 338.546 4.017 20 0 EIADRP CCC[C@@H](C)C[NH+]1CCC2(C[C@H]([N@H+](C)Cc3ccccc3)CO2)CC1 ZINC001201544392 1054837538 /nfs/dbraw/zinc/83/75/38/1054837538.db2.gz PNPPYTVQIIHOSQ-CTNGQTDRSA-N 2 0 344.543 4.178 20 0 EIADRP CCC[C@H](C)C[NH+]1CCC2(CC1)C[N@H+](Cc1ccc(C)cc1)CCO2 ZINC001201544137 1054837581 /nfs/dbraw/zinc/83/75/81/1054837581.db2.gz NJJNBRABSAJMRM-FQEVSTJZSA-N 2 0 344.543 4.098 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(F)c3ccccc23)C1 ZINC001201566524 1054850468 /nfs/dbraw/zinc/85/04/68/1054850468.db2.gz JHYRYDIQIJKFEY-QGZVFWFLSA-N 2 0 328.475 4.437 20 0 EIADRP CSCCC[NH+]1CCC2(CC1)CC[NH+](Cc1cccs1)CC2 ZINC001201688123 1054888721 /nfs/dbraw/zinc/88/87/21/1054888721.db2.gz GGBNCCRZRWIAHH-UHFFFAOYSA-N 2 0 338.586 4.179 20 0 EIADRP CCCCCC[NH+]1CCC2(C[C@@H]([N@H+](C)Cc3ccccc3)CO2)CC1 ZINC001201750112 1054894441 /nfs/dbraw/zinc/89/44/41/1054894441.db2.gz HMHZMZAGCHOEKC-OAQYLSRUSA-N 2 0 344.543 4.322 20 0 EIADRP Nc1c(Cl)cccc1C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000876901247 1054980470 /nfs/dbraw/zinc/98/04/70/1054980470.db2.gz AMGXMKTXVWKYEQ-UHFFFAOYSA-N 2 0 343.902 4.198 20 0 EIADRP COc1cccc(C[N@@H+]2CCC3(C2)CC[NH+](CC2CCCC2)CC3)c1 ZINC001202161526 1055063756 /nfs/dbraw/zinc/06/37/56/1055063756.db2.gz URFSUXSPJNEEFM-UHFFFAOYSA-N 2 0 342.527 4.173 20 0 EIADRP COc1cc([C@H](C)[NH2+]CC[C@H]2CCC[N@@H+]2C)ccc1OCCC(C)C ZINC001168604131 1055152512 /nfs/dbraw/zinc/15/25/12/1055152512.db2.gz KYBQANZSVTWHHW-PKOBYXMFSA-N 2 0 348.531 4.255 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]C[C@@H]2CCCC[N@H+](C)C2)sc1Br ZINC000623657313 1055533903 /nfs/dbraw/zinc/53/39/03/1055533903.db2.gz NKFOECRTFJJQEL-OLZOCXBDSA-N 2 0 345.350 4.202 20 0 EIADRP C[C@@H]([NH2+]C1CCC(C(F)F)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000282300150 1055790756 /nfs/dbraw/zinc/79/07/56/1055790756.db2.gz MGAHYHHSXLHRKX-ZTRSQXPZSA-N 2 0 336.470 4.311 20 0 EIADRP CC(C)c1nn(-c2ccccc2)c(Cl)c1C[NH2+]CCCC[NH+](C)C ZINC000742734056 1058747618 /nfs/dbraw/zinc/74/76/18/1058747618.db2.gz CPCNCAINWLMUNS-UHFFFAOYSA-N 2 0 348.922 4.081 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cccc3cnccc32)c1 ZINC000181505680 1059473367 /nfs/dbraw/zinc/47/33/67/1059473367.db2.gz FSBKCYSHFYPLTL-UHFFFAOYSA-N 2 0 333.479 4.365 20 0 EIADRP COc1ccc2c(c1)CCC[C@H]2[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000766511280 1060426812 /nfs/dbraw/zinc/42/68/12/1060426812.db2.gz CNSMLNMVMBVDBP-OBFZPWGMSA-N 2 0 342.527 4.459 20 0 EIADRP CC[C@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1ccc2c(c1)CCO2 ZINC000766512438 1060455763 /nfs/dbraw/zinc/45/57/63/1060455763.db2.gz KOEWDNMQSNKCBX-CBNMVNINSA-N 2 0 342.527 4.459 20 0 EIADRP c1ccc(N2CCC([NH2+]C3CCC([NH+]4CCCCC4)CC3)CC2)cc1 ZINC000766511695 1060482381 /nfs/dbraw/zinc/48/23/81/1060482381.db2.gz GCAHFYKCGVLJNW-UHFFFAOYSA-N 2 0 341.543 4.042 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccc(SC(F)(F)F)cc2)CCC[C@@H]1C[NH3+] ZINC001205996031 1060564298 /nfs/dbraw/zinc/56/42/98/1060564298.db2.gz UBOWPPKEPATJCA-GXTWGEPZSA-N 2 0 332.435 4.105 20 0 EIADRP CC(C)C[C@@H](Cc1ccccc1)[NH2+]C1CC[NH+](CC2CCC2)CC1 ZINC001169067610 1060626063 /nfs/dbraw/zinc/62/60/63/1060626063.db2.gz IRMLIRFMECQORI-QFIPXVFZSA-N 2 0 328.544 4.498 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CCc1cccc(Oc3ccccc3)c1)C2 ZINC001169095666 1060632375 /nfs/dbraw/zinc/63/23/75/1060632375.db2.gz QRTOBSZNGOHMRE-OWZKRDHZSA-N 2 0 336.479 4.236 20 0 EIADRP CCCC[C@H]([NH3+])Cc1cn([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc12 ZINC001169109482 1060657381 /nfs/dbraw/zinc/65/73/81/1060657381.db2.gz JDNYHUBZMNHQQG-VNTMZGSJSA-N 2 0 339.527 4.499 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1(c3ccc(C(F)(F)F)cc3)CCC1)C2 ZINC001169109523 1060657560 /nfs/dbraw/zinc/65/75/60/1060657560.db2.gz CPGSXIHONXHGHA-BJWYYQGGSA-N 2 0 338.417 4.299 20 0 EIADRP Cc1ccc(C[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc2)cc1 ZINC001169109014 1060657620 /nfs/dbraw/zinc/65/76/20/1060657620.db2.gz GCLNYHFHOLMSNX-BJESRGMDSA-N 2 0 334.507 4.494 20 0 EIADRP CC1(C)C[C@@H](Nc2cc(C[NH+]3CCCCC3)ccn2)C[C@](C)(C[NH3+])C1 ZINC001169140942 1060659784 /nfs/dbraw/zinc/65/97/84/1060659784.db2.gz ICECNJSBYUWCRV-NQIIRXRSSA-N 2 0 344.547 4.023 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc(Br)cc1 ZINC000019914657 212084092 /nfs/dbraw/zinc/08/40/92/212084092.db2.gz PRLZQUFZQRIPCL-AWEZNQCLSA-N 2 0 327.310 4.049 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2ccccc2C(F)(F)F)CC1 ZINC000532236111 1032116109 /nfs/dbraw/zinc/11/61/09/1032116109.db2.gz UDWJCXUIKCBMHB-CQSZACIVSA-N 2 0 328.422 4.478 20 0 EIADRP CC[C@H]1C[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)CCO1 ZINC000648438668 1032309158 /nfs/dbraw/zinc/30/91/58/1032309158.db2.gz YRVYQQCHBGBGSC-SFTDATJTSA-N 2 0 330.516 4.110 20 0 EIADRP C[C@H]1C[C@H]([NH2+]Cc2ccc(Sc3ccccc3)cc2)CC[N@@H+]1C ZINC000532804322 1032322819 /nfs/dbraw/zinc/32/28/19/1032322819.db2.gz BEVNNXQPISFUKI-FUHWJXTLSA-N 2 0 326.509 4.410 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CSCCc3ccccc32)ccc1F ZINC000120957675 1032481366 /nfs/dbraw/zinc/48/13/66/1032481366.db2.gz PWKYXWZYBHAACV-FQEVSTJZSA-N 2 0 344.499 4.008 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc(Cl)c(N)c(Cl)c2)C1 ZINC000760161691 1032484666 /nfs/dbraw/zinc/48/46/66/1032484666.db2.gz ZDVFOMBJNWWUQH-OLZOCXBDSA-N 2 0 344.330 4.347 20 0 EIADRP CC(C)Oc1ccc2[nH+]ccc(N3CCC4(CCC[N@@H+]4C)CC3)c2c1 ZINC000450422179 1032492651 /nfs/dbraw/zinc/49/26/51/1032492651.db2.gz UPGACUYKNWQYTH-UHFFFAOYSA-N 2 0 339.483 4.087 20 0 EIADRP C[N@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)C[C@@H]1CCCCC1(F)F ZINC000450455629 1032511407 /nfs/dbraw/zinc/51/14/07/1032511407.db2.gz OFYUOHGZROAWRC-MOPGFXCFSA-N 2 0 336.470 4.266 20 0 EIADRP CC[N@H+](C)C[C@@H]1CCN(Cc2ccc([C@@H](C)C(F)(F)F)cc2)C1 ZINC000450475825 1032521463 /nfs/dbraw/zinc/52/14/63/1032521463.db2.gz ZYOYMCQNFCPKTR-ZBFHGGJFSA-N 2 0 328.422 4.126 20 0 EIADRP FC1(F)CC(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000450499640 1032540399 /nfs/dbraw/zinc/54/03/99/1032540399.db2.gz JJFKJTIQZGGCHZ-MOPGFXCFSA-N 2 0 334.454 4.018 20 0 EIADRP C[N@H+](CC1CCN(c2cc[nH+]cc2)CC1)C[C@@H]1CCCCC1(F)F ZINC000450638615 1032609909 /nfs/dbraw/zinc/60/99/09/1032609909.db2.gz JDSGJXDHLPXBLI-KRWDZBQOSA-N 2 0 337.458 4.055 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(C(C)=O)cc2)CC1)CC1CC1 ZINC000450654973 1032624059 /nfs/dbraw/zinc/62/40/59/1032624059.db2.gz SLSXARYVDGNLSW-UHFFFAOYSA-N 2 0 342.527 4.223 20 0 EIADRP C[C@H]([NH2+]CC1(c2cccc(F)c2F)CCCC1)C1CC[NH+](C)CC1 ZINC000683158780 1019013821 /nfs/dbraw/zinc/01/38/21/1019013821.db2.gz MXYNUBWSXATHKU-HNNXBMFYSA-N 2 0 336.470 4.097 20 0 EIADRP C[NH+](C)[C@H]1CCCN(Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000432796643 1032818700 /nfs/dbraw/zinc/81/87/00/1032818700.db2.gz BCWQPGKTSHRLIP-INIZCTEOSA-N 2 0 332.488 4.470 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(Cl)cn2)c1 ZINC000274945398 1019875300 /nfs/dbraw/zinc/87/53/00/1019875300.db2.gz UJNUDPJXELPALK-OAHLLOKOSA-N 2 0 331.891 4.426 20 0 EIADRP c1ccc(CSCCC[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000535627063 1020013604 /nfs/dbraw/zinc/01/36/04/1020013604.db2.gz RPBWSOVUWQQMQL-FPOVZHCZSA-N 2 0 344.568 4.259 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cnc(-c3ccccc3)[nH]2)CC1 ZINC000180122735 1020063130 /nfs/dbraw/zinc/06/31/30/1020063130.db2.gz HBULNHDZYBLIAO-UHFFFAOYSA-N 2 0 340.515 4.021 20 0 EIADRP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)CC1=Cc2ccccc2OC1 ZINC000579892900 1020507831 /nfs/dbraw/zinc/50/78/31/1020507831.db2.gz JGYRPIYZDNERMQ-UHFFFAOYSA-N 2 0 336.479 4.046 20 0 EIADRP COc1cc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)ccc1C ZINC000237212175 1020758287 /nfs/dbraw/zinc/75/82/87/1020758287.db2.gz ZGRQELOKVJEPSY-UHFFFAOYSA-N 2 0 338.495 4.279 20 0 EIADRP O[C@H]1CCC[C@@H]1[NH+]1CCC([NH2+]C2CCC(C3CCCCC3)CC2)CC1 ZINC000683470520 1020849111 /nfs/dbraw/zinc/84/91/11/1020849111.db2.gz QNZQRJBTXDCTRT-NZUHHQEFSA-N 2 0 348.575 4.093 20 0 EIADRP C[C@H]1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CS1 ZINC000655710804 1020908673 /nfs/dbraw/zinc/90/86/73/1020908673.db2.gz FSTUBCMALRSBBL-VJAOCGABSA-N 2 0 330.541 4.056 20 0 EIADRP CC(C)n1ccc(C[C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)n1 ZINC000543993052 1020944779 /nfs/dbraw/zinc/94/47/79/1020944779.db2.gz SRGFQMDQNGKURV-GOSISDBHSA-N 2 0 342.531 4.025 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(SCC(F)F)cc1 ZINC000655805808 1020971995 /nfs/dbraw/zinc/97/19/95/1020971995.db2.gz LTKBPVBPUZLALB-KCQAQPDRSA-N 2 0 328.472 4.035 20 0 EIADRP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805292 1020972339 /nfs/dbraw/zinc/97/23/39/1020972339.db2.gz FPFMXIXGGWLJFC-BMFZPTHFSA-N 2 0 326.937 4.141 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000655805437 1020972398 /nfs/dbraw/zinc/97/23/98/1020972398.db2.gz OBVYUNFJRJXSLM-NBMRYCAZSA-N 2 0 340.433 4.271 20 0 EIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655804894 1020972804 /nfs/dbraw/zinc/97/28/04/1020972804.db2.gz FIMKTEUHPVYZJL-CEXWTWQISA-N 2 0 328.525 4.270 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)C1 ZINC000655804273 1020974684 /nfs/dbraw/zinc/97/46/84/1020974684.db2.gz RNWGZFKFHWKIJU-HNONPPJISA-N 2 0 340.433 4.271 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000655806113 1020975616 /nfs/dbraw/zinc/97/56/16/1020975616.db2.gz ZGEJRYRIHVRDHH-BEVDRBHNSA-N 2 0 328.887 4.359 20 0 EIADRP CCC[NH+]1CCC(N[C@H](C)c2ccc(OCC3CC3)c(F)c2)CC1 ZINC000121637484 1020983039 /nfs/dbraw/zinc/98/30/39/1020983039.db2.gz ACPRSNZCNKKXLO-OAHLLOKOSA-N 2 0 334.479 4.140 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccc(-c3ccccc3Cl)s2)C1 ZINC000655826101 1020992463 /nfs/dbraw/zinc/99/24/63/1020992463.db2.gz FTQUFFZUAYIWMS-OKILXGFUSA-N 2 0 334.916 4.498 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000397554274 1020996862 /nfs/dbraw/zinc/99/68/62/1020996862.db2.gz JZGKPWCBXSMIDS-GOSISDBHSA-N 2 0 340.486 4.259 20 0 EIADRP c1ccc2c(c1)OC1(CCC1)C[C@H]2[NH2+]CCCCC[NH+]1CCCC1 ZINC000340480145 1021102436 /nfs/dbraw/zinc/10/24/36/1021102436.db2.gz OQCVZKIABWUNHX-LJQANCHMSA-N 2 0 328.500 4.289 20 0 EIADRP CCc1cnc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)s1 ZINC000340492278 1021137443 /nfs/dbraw/zinc/13/74/43/1021137443.db2.gz YMOHLYXJBKKDMV-UHFFFAOYSA-N 2 0 343.540 4.238 20 0 EIADRP C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCC[N@@H+]2Cc1ccc(C2CCCC2)cc1 ZINC000570197195 1021227894 /nfs/dbraw/zinc/22/78/94/1021227894.db2.gz VTZAKIKXBVUOMT-FSSWDIPSSA-N 2 0 342.527 4.028 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cccc(OC(F)F)c2)C1 ZINC000125826724 1021310810 /nfs/dbraw/zinc/31/08/10/1021310810.db2.gz UOBHUIYPOZZHSX-LSDHHAIUSA-N 2 0 326.431 4.059 20 0 EIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1cc2ccccc2[nH]1 ZINC000683929141 1021995486 /nfs/dbraw/zinc/99/54/86/1021995486.db2.gz OVRPRCKFIYRXOS-CYGODWOOSA-N 2 0 347.506 4.414 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1nc(-c2ccccc2)cs1 ZINC000414184742 1022060864 /nfs/dbraw/zinc/06/08/64/1022060864.db2.gz OGHHKRXIAGNJHC-HOTGVXAUSA-N 2 0 329.513 4.193 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccccc1F ZINC000171126606 1022075569 /nfs/dbraw/zinc/07/55/69/1022075569.db2.gz ZFMRGNWIDRRSGC-INIZCTEOSA-N 2 0 330.447 4.007 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccccc1Cl ZINC000069645251 1022143500 /nfs/dbraw/zinc/14/35/00/1022143500.db2.gz LPACGUOYONGMAY-HNNXBMFYSA-N 2 0 332.875 4.131 20 0 EIADRP Cc1sccc1C[NH+]1CCC(C[N@@H+](C)Cc2ccccc2)CC1 ZINC001204543043 1022189931 /nfs/dbraw/zinc/18/99/31/1022189931.db2.gz LFDPRQYGRKAMQQ-UHFFFAOYSA-N 2 0 328.525 4.401 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000414219483 1022189826 /nfs/dbraw/zinc/18/98/26/1022189826.db2.gz HLPYLPSYNBSXTF-UWJYYQICSA-N 2 0 326.484 4.429 20 0 EIADRP Cc1cc(OCCC[C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)ccc1Cl ZINC000549041205 1022249281 /nfs/dbraw/zinc/24/92/81/1022249281.db2.gz FVLSDSUTFTYVOX-IRXDYDNUSA-N 2 0 338.923 4.127 20 0 EIADRP CCc1onc(C)c1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000892575070 1022266886 /nfs/dbraw/zinc/26/68/86/1022266886.db2.gz RHEOKXRNUOHWQV-MRXNPFEDSA-N 2 0 341.499 4.067 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCc2ccc(Cl)cc2)C1 ZINC001167424315 1022317510 /nfs/dbraw/zinc/31/75/10/1022317510.db2.gz HDRVFCXYGZVGRE-HKUYNNGSSA-N 2 0 334.935 4.469 20 0 EIADRP CCOc1ccccc1C1=CCN(CC[C@H]2CCCC[N@@H+]2C)CC1 ZINC000472591799 1022631821 /nfs/dbraw/zinc/63/18/21/1022631821.db2.gz YQLXOWQJPCZVPG-LJQANCHMSA-N 2 0 328.500 4.049 20 0 EIADRP Cc1cc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)ccc1C(F)(F)F ZINC000414359613 1022731257 /nfs/dbraw/zinc/73/12/57/1022731257.db2.gz OWJVVWVKFNZWBT-MQVJKMGUSA-N 2 0 326.406 4.119 20 0 EIADRP c1sc(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)nc1-c1ccccc1 ZINC000647542954 1022779212 /nfs/dbraw/zinc/77/92/12/1022779212.db2.gz FGGLESDVRQDVKT-QZTJIDSGSA-N 2 0 341.524 4.022 20 0 EIADRP C[C@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(-n2ccnc2)cc1 ZINC000378389941 1022784780 /nfs/dbraw/zinc/78/47/80/1022784780.db2.gz BFWWKEGMRKPNMR-WEYGHZABSA-N 2 0 347.462 4.301 20 0 EIADRP C[C@H](CC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1cccc(C(F)(F)F)c1 ZINC000647548785 1022808968 /nfs/dbraw/zinc/80/89/68/1022808968.db2.gz UAIZCGJBNHEPJF-NOVWEMISSA-N 2 0 340.433 4.177 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)CSC)cc1C[NH+]1CCCCC1 ZINC000182995937 1022839146 /nfs/dbraw/zinc/83/91/46/1022839146.db2.gz RIBHBZONMAPQAY-HOTGVXAUSA-N 2 0 336.545 4.083 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)ccc1Br ZINC000378489591 1022843222 /nfs/dbraw/zinc/84/32/22/1022843222.db2.gz CTXBTYNBLSYSPU-CWRNSKLLSA-N 2 0 337.305 4.035 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](C)[C@H]1c1ccccc1)c1ccc(Cl)nc1 ZINC000378513145 1022852712 /nfs/dbraw/zinc/85/27/12/1022852712.db2.gz AGOMEDHCRQTWOU-YJLNNSPDSA-N 2 0 329.875 4.079 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCCC[NH+]1CCCC1 ZINC000581146371 1022855301 /nfs/dbraw/zinc/85/53/01/1022855301.db2.gz SAFJNQWUQFQKLX-MRXNPFEDSA-N 2 0 342.449 4.492 20 0 EIADRP C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548154388 1022873962 /nfs/dbraw/zinc/87/39/62/1022873962.db2.gz NZNDNIVPHMBIEU-WTOYTKOKSA-N 2 0 335.495 4.033 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(OC)CCC(c3ccccc3)CC2)[C@H](C)C1 ZINC000581292417 1022970401 /nfs/dbraw/zinc/97/04/01/1022970401.db2.gz HVJXTFYSGNRFTE-DWOCFRCJSA-N 2 0 344.543 4.049 20 0 EIADRP C[C@H]([NH2+][C@@H](c1ccccc1)c1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC000396436949 1023016376 /nfs/dbraw/zinc/01/63/76/1023016376.db2.gz HBHBPEYWSNXXNA-KKSFZXQISA-N 2 0 326.459 4.235 20 0 EIADRP CN1CC[C@H]([NH2+][C@H]2CCCN(c3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000584581443 1023036424 /nfs/dbraw/zinc/03/64/24/1023036424.db2.gz VNRAMWUDGAKDEF-FUDKSRODSA-N 2 0 349.522 4.081 20 0 EIADRP C[C@H]([NH2+]CCCOC1CCCCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548162960 1023097790 /nfs/dbraw/zinc/09/77/90/1023097790.db2.gz GGJHBQXIDWBDBC-PZJWPPBQSA-N 2 0 344.543 4.226 20 0 EIADRP CCC[C@H]([NH2+]CC1CCN(Cc2nc(C)c(C)o2)CC1)[C@@H]1CC1(C)C ZINC000417300618 1023249206 /nfs/dbraw/zinc/24/92/06/1023249206.db2.gz APGZBZMGTMJZCR-OALUTQOASA-N 2 0 347.547 4.308 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)[C@@H]1C[C@H]1c1cccs1 ZINC000417313204 1023258101 /nfs/dbraw/zinc/25/81/01/1023258101.db2.gz PAIGSCQSEJMLLE-XOKHGSTOSA-N 2 0 332.488 4.231 20 0 EIADRP C[C@@H]([NH2+][C@@H](Cc1ccccc1)c1cccs1)C1CC[NH+](C)CC1 ZINC000090015774 1023262406 /nfs/dbraw/zinc/26/24/06/1023262406.db2.gz SWZVLKGEOMJOQA-APWZRJJASA-N 2 0 328.525 4.352 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)cnc1F ZINC000892743355 1023361039 /nfs/dbraw/zinc/36/10/39/1023361039.db2.gz VVORSBCKTQIDRI-UHFFFAOYSA-N 2 0 341.474 4.195 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@@H]2CC2(Cl)Cl)CC1 ZINC000728688750 1023394359 /nfs/dbraw/zinc/39/43/59/1023394359.db2.gz TZHBVXBJPKFBRT-KRWDZBQOSA-N 2 0 341.326 4.024 20 0 EIADRP COc1cccc(SCC[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000660257465 1023396070 /nfs/dbraw/zinc/39/60/70/1023396070.db2.gz TZZSCRKNKKBFNG-SJORKVTESA-N 2 0 348.556 4.030 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+]Cc1cn(-c2ccccc2Cl)nc1C(C)(C)C ZINC000415026423 1023397470 /nfs/dbraw/zinc/39/74/70/1023397470.db2.gz UIAPYGMSXINTQC-AWEZNQCLSA-N 2 0 348.922 4.040 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1cc(Br)cs1)c1ccccc1 ZINC000415067452 1023415557 /nfs/dbraw/zinc/41/55/57/1023415557.db2.gz PIMPFYNRVGAKAA-HNNXBMFYSA-N 2 0 339.302 4.080 20 0 EIADRP C[C@@H](C[C@@H]1CCC[NH2+]1)[NH2+]Cc1cccc(COCc2ccccc2)c1 ZINC000415082729 1023431722 /nfs/dbraw/zinc/43/17/22/1023431722.db2.gz OSJVMIPGIYEDCR-AVRDEDQJSA-N 2 0 338.495 4.024 20 0 EIADRP c1ccc([C@H]2C[C@@H](NCc3ccccc3OC3CCC3)CC[NH2+]2)cc1 ZINC000415090444 1023431801 /nfs/dbraw/zinc/43/18/01/1023431801.db2.gz OUKHZILLHDSRJB-PZJWPPBQSA-N 2 0 336.479 4.201 20 0 EIADRP c1ccc([C@H]2C[C@H](NCc3ccccc3OC3CCC3)CC[NH2+]2)cc1 ZINC000415090445 1023433466 /nfs/dbraw/zinc/43/34/66/1023433466.db2.gz OUKHZILLHDSRJB-TZIWHRDSSA-N 2 0 336.479 4.201 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000415089947 1023434515 /nfs/dbraw/zinc/43/45/15/1023434515.db2.gz ZJKNXLXKIQGKLN-MPGHIAIKSA-N 2 0 343.540 4.466 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]C1CC[NH2+]CC1 ZINC000415086597 1023436577 /nfs/dbraw/zinc/43/65/77/1023436577.db2.gz UVFIKILYRXYUFC-NSHDSACASA-N 2 0 335.904 4.175 20 0 EIADRP Fc1ccc([C@H]([NH2+]CC2CC[NH2+]CC2)c2ccccc2Cl)cc1 ZINC000415087965 1023437151 /nfs/dbraw/zinc/43/71/51/1023437151.db2.gz WSADBPQYNAQLQC-IBGZPJMESA-N 2 0 332.850 4.158 20 0 EIADRP CCOc1ccc([C@@H]([NH2+]C2CCC(C[NH3+])CC2)c2ccccc2)cc1 ZINC000415105429 1023445955 /nfs/dbraw/zinc/44/59/55/1023445955.db2.gz MFNOQIQGXXNHAP-QVHXHXEWSA-N 2 0 338.495 4.282 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C[C@H]1C ZINC000341271649 1023485447 /nfs/dbraw/zinc/48/54/47/1023485447.db2.gz ONFUDJDZTKXOEE-LMMKCTJWSA-N 2 0 330.516 4.074 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C[C@H]1C ZINC000341271657 1023485736 /nfs/dbraw/zinc/48/57/36/1023485736.db2.gz ONFUDJDZTKXOEE-ZHALLVOQSA-N 2 0 330.516 4.074 20 0 EIADRP C[C@H](C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500118178 1023517001 /nfs/dbraw/zinc/51/70/01/1023517001.db2.gz SNSVTIFQPIFYKD-KYJSFNMBSA-N 2 0 340.433 4.225 20 0 EIADRP c1nc(C2CCCC2)sc1C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656782691 1023518088 /nfs/dbraw/zinc/51/80/88/1023518088.db2.gz ILSXHWJFFWQFLA-QGZVFWFLSA-N 2 0 333.545 4.012 20 0 EIADRP [NH3+][C@@H]1CCO[C@@H](C2CC[NH+](Cc3cccc(C4CCCC4)c3)CC2)C1 ZINC000656786179 1023526603 /nfs/dbraw/zinc/52/66/03/1023526603.db2.gz LWBYXUAVPOHDKZ-FGZHOGPDSA-N 2 0 342.527 4.063 20 0 EIADRP c1nc(-c2ccccc2)sc1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000656785968 1023536810 /nfs/dbraw/zinc/53/68/10/1023536810.db2.gz OMPUKQUGCOIHLW-GOSISDBHSA-N 2 0 341.524 4.022 20 0 EIADRP Clc1ccc(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)c2ncccc12 ZINC000656787456 1023537100 /nfs/dbraw/zinc/53/71/00/1023537100.db2.gz YWUKLSWAPXPGRP-MRXNPFEDSA-N 2 0 343.902 4.100 20 0 EIADRP Clc1ccc(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)c2ncccc12 ZINC000656787455 1023537432 /nfs/dbraw/zinc/53/74/32/1023537432.db2.gz YWUKLSWAPXPGRP-INIZCTEOSA-N 2 0 343.902 4.100 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H](C)c1ccc(C2CC2)cc1 ZINC000418111966 1023543031 /nfs/dbraw/zinc/54/30/31/1023543031.db2.gz GIAPIEMFFODIMO-OAHLLOKOSA-N 2 0 332.451 4.304 20 0 EIADRP C[C@H]1CCCC[NH+]1Cc1ccc(NCCC[N@H+]2CCCC[C@@H]2C)nc1 ZINC001167750758 1023617554 /nfs/dbraw/zinc/61/75/54/1023617554.db2.gz BHEUNUPTUGBTLM-OALUTQOASA-N 2 0 344.547 4.132 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCNc1cccc2c1C1(C=C2)CC[NH2+]CC1 ZINC001167751962 1023623377 /nfs/dbraw/zinc/62/33/77/1023623377.db2.gz QCYHWIXMLNZNMU-SFHVURJKSA-N 2 0 339.527 4.011 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cccc(Br)c1 ZINC000019914671 1023632604 /nfs/dbraw/zinc/63/26/04/1023632604.db2.gz OMHXOTNRYSDTPG-CQSZACIVSA-N 2 0 327.310 4.049 20 0 EIADRP CCCn1ccnc1CCC[N@H+](C)CCc1nsc2ccccc21 ZINC000660416498 1023742476 /nfs/dbraw/zinc/74/24/76/1023742476.db2.gz JNYSICVNDWFCEJ-UHFFFAOYSA-N 2 0 342.512 4.010 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1cnn(C)c1 ZINC000164176495 1023775291 /nfs/dbraw/zinc/77/52/91/1023775291.db2.gz HLDNETSCVZPAGE-OAQYLSRUSA-N 2 0 340.515 4.037 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+]CC[C@H]3CCC[N@@H+]3C)cc2)cs1 ZINC000341588621 1023895654 /nfs/dbraw/zinc/89/56/54/1023895654.db2.gz BXJBIMBPUBSSLY-KBXCAEBGSA-N 2 0 329.513 4.253 20 0 EIADRP Cc1nc(-c2ccc([C@@H](C)[NH2+]CC[C@@H]3CCC[N@@H+]3C)cc2)cs1 ZINC000341588622 1023895793 /nfs/dbraw/zinc/89/57/93/1023895793.db2.gz BXJBIMBPUBSSLY-KDOFPFPSSA-N 2 0 329.513 4.253 20 0 EIADRP CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(Br)cc1 ZINC000130245360 1023931976 /nfs/dbraw/zinc/93/19/76/1023931976.db2.gz TXOITUSPGAUTNC-BBWFWOEESA-N 2 0 337.305 4.117 20 0 EIADRP Cc1ccc2[nH]c(C[NH+]3CCC(C[NH+]4CCCC4)CC3)cc2c1C ZINC000473137034 1024368135 /nfs/dbraw/zinc/36/81/35/1024368135.db2.gz FZUOAKUNNJAPEO-UHFFFAOYSA-N 2 0 325.500 4.093 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1cncs1 ZINC000164500763 1024466180 /nfs/dbraw/zinc/46/61/80/1024466180.db2.gz CPDDZYTXPJIGSV-HNNXBMFYSA-N 2 0 341.480 4.219 20 0 EIADRP COc1ccccc1-c1ccc(C[N@H+](C)C[C@@H]2CCC[NH+](C)C2)cc1 ZINC000092253699 1024760198 /nfs/dbraw/zinc/76/01/98/1024760198.db2.gz MUHOICKYTPWBRQ-LJQANCHMSA-N 2 0 338.495 4.136 20 0 EIADRP CCc1nc(C(C)C)ccc1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000549806856 1033237689 /nfs/dbraw/zinc/23/76/89/1033237689.db2.gz WKZZVYHZWWCGCF-UHFFFAOYSA-N 2 0 331.548 4.320 20 0 EIADRP C[NH+](C)CC1CCC([NH2+]Cc2ccc(F)c(Cl)c2Cl)CC1 ZINC000432255621 1024775971 /nfs/dbraw/zinc/77/59/71/1024775971.db2.gz CHOSGLSCUKOFDY-UHFFFAOYSA-N 2 0 333.278 4.343 20 0 EIADRP CCc1cnccc1[C@H](C)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548481308 1024825220 /nfs/dbraw/zinc/82/52/20/1024825220.db2.gz MWFKQSDJOWAXQU-LQWHRVPQSA-N 2 0 337.511 4.205 20 0 EIADRP CCC[C@H]([NH2+][C@@H](Cn1ccnc1)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000326661145 1025000389 /nfs/dbraw/zinc/00/03/89/1025000389.db2.gz JBASGJMEORUEGF-ROUUACIJSA-N 2 0 344.459 4.337 20 0 EIADRP Clc1ccc([C@@H]([NH2+]Cc2cccc3c2CC[NH2+]C3)C2CC2)cc1 ZINC000662281993 1025030058 /nfs/dbraw/zinc/03/00/58/1025030058.db2.gz NFWMTIJDWRIWBQ-FQEVSTJZSA-N 2 0 326.871 4.227 20 0 EIADRP CCC[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc(F)cc1F ZINC000662283840 1025033138 /nfs/dbraw/zinc/03/31/38/1025033138.db2.gz VQUMGOAVYAXLIU-FQEVSTJZSA-N 2 0 330.422 4.242 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2csc(-c3cccs3)n2)[C@@H]1CCC[NH3+] ZINC000662312390 1025067381 /nfs/dbraw/zinc/06/73/81/1025067381.db2.gz FTCQKGBBHYNHCV-UKRRQHHQSA-N 2 0 335.542 4.211 20 0 EIADRP C[C@@H](Cc1coc2ccccc12)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663466259 1025390942 /nfs/dbraw/zinc/39/09/42/1025390942.db2.gz QDVIOSJHQTXFLR-FUHWJXTLSA-N 2 0 326.484 4.075 20 0 EIADRP C[C@H](Cc1coc2ccccc12)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663466260 1025392571 /nfs/dbraw/zinc/39/25/71/1025392571.db2.gz QDVIOSJHQTXFLR-SJLPKXTDSA-N 2 0 326.484 4.075 20 0 EIADRP c1cncc([C@H]([NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)C2CCCCC2)c1 ZINC000663467019 1025401242 /nfs/dbraw/zinc/40/12/42/1025401242.db2.gz YZWZURYEBFPYEW-SIKLNZKXSA-N 2 0 341.543 4.415 20 0 EIADRP CC(C)n1c2ccccc2nc1[C@@H]1CCC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000892034302 1025454789 /nfs/dbraw/zinc/45/47/89/1025454789.db2.gz LUSDRTKUXYCPCT-FQEVSTJZSA-N 2 0 340.515 4.096 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)CC(F)(F)F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000663478482 1025468583 /nfs/dbraw/zinc/46/85/83/1025468583.db2.gz RENAFAOTWRLTKD-WBVHZDCISA-N 2 0 342.449 4.465 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1C[C@H](c2ccc(C)cc2)C[C@@H]1C ZINC000426539582 1025492322 /nfs/dbraw/zinc/49/23/22/1025492322.db2.gz NEHVQJLHHAYKKK-FXAWDEMLSA-N 2 0 346.478 4.262 20 0 EIADRP C[C@@H]1CN(CCC[NH2+]Cc2cc(-c3ccccc3)cs2)CCCO1 ZINC000432352163 1025729819 /nfs/dbraw/zinc/72/98/19/1025729819.db2.gz WCXDNBAKLIFWEO-QGZVFWFLSA-N 2 0 344.524 4.006 20 0 EIADRP CC[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1cccc(Cl)c1 ZINC000319750398 1025817016 /nfs/dbraw/zinc/81/70/16/1025817016.db2.gz UMMWUJZGBKYPIA-LJQANCHMSA-N 2 0 329.875 4.445 20 0 EIADRP Clc1ccc2c(c1)CC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167966701 1025839906 /nfs/dbraw/zinc/83/99/06/1025839906.db2.gz ZYOPGBDRJNYJLV-DLZDZTESSA-N 2 0 330.903 4.322 20 0 EIADRP Cc1cccc([C@H](NCc2ncc(CN(C)C)s2)C(C)(C)C)c1 ZINC000512050890 1025847261 /nfs/dbraw/zinc/84/72/61/1025847261.db2.gz FJNYJVCJQKLGIH-SFHVURJKSA-N 2 0 331.529 4.390 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCO[C@](C)(c2ccc(C)cc2)C1 ZINC001167837434 1025848701 /nfs/dbraw/zinc/84/87/01/1025848701.db2.gz KBKWXNQPJWVJCD-FPOVZHCZSA-N 2 0 332.532 4.053 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CCCc2ccc(C)cc21 ZINC000342328845 1025858534 /nfs/dbraw/zinc/85/85/34/1025858534.db2.gz YCPFSPBZNDKDER-OAQYLSRUSA-N 2 0 332.451 4.051 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)n1c2ccc(F)cc2c2c1C[NH2+]CC2 ZINC001167841880 1025889613 /nfs/dbraw/zinc/88/96/13/1025889613.db2.gz SYHBZTSRSRWQQX-OAHLLOKOSA-N 2 0 331.479 4.109 20 0 EIADRP c1cc2cc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)ccc2s1 ZINC001167967907 1025889586 /nfs/dbraw/zinc/88/95/86/1025889586.db2.gz KXAHHWHOILVYPW-YQQQUEKLSA-N 2 0 326.509 4.396 20 0 EIADRP Clc1cccc([C@@H]2C[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167968567 1025904391 /nfs/dbraw/zinc/90/43/91/1025904391.db2.gz RNEQODQCZMQXSI-OLPBJYBYSA-N 2 0 330.903 4.191 20 0 EIADRP Clc1cccc([C@H]2C[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167968564 1025905527 /nfs/dbraw/zinc/90/55/27/1025905527.db2.gz RNEQODQCZMQXSI-DGDSNLKDSA-N 2 0 330.903 4.191 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2csc(-c3ccc(F)cc3)n2)CC1 ZINC000056523562 1025910066 /nfs/dbraw/zinc/91/00/66/1025910066.db2.gz LCOBLEDRVNPILQ-UHFFFAOYSA-N 2 0 347.503 4.113 20 0 EIADRP C[C@@H]([NH2+]CCCN1CCCO[C@@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000432447187 1026025802 /nfs/dbraw/zinc/02/58/02/1026025802.db2.gz OKURUDITGZEMKQ-UONOGXRCSA-N 2 0 345.314 4.145 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(Cn2ccnc2)cc1)c1cc(F)cc(F)c1 ZINC000152109066 1026095952 /nfs/dbraw/zinc/09/59/52/1026095952.db2.gz LVHFXMVKMVAVEU-CQSZACIVSA-N 2 0 327.378 4.060 20 0 EIADRP CC1CC[NH+](CCC[C@@H]([NH2+]C[C@@H]2CCCO2)c2ccc(F)cc2)CC1 ZINC000344182323 1026103918 /nfs/dbraw/zinc/10/39/18/1026103918.db2.gz HBEQBOARFGLJLE-LEWJYISDSA-N 2 0 348.506 4.148 20 0 EIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(Oc2cccnc2)cc1 ZINC000894521699 1026124583 /nfs/dbraw/zinc/12/45/83/1026124583.db2.gz ZYQGRPBNQJSYJC-UXDRXVOSSA-N 2 0 337.467 4.150 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2sccc2OC)cc1 ZINC000472166113 1026167240 /nfs/dbraw/zinc/16/72/40/1026167240.db2.gz TXOWQLRABKVKSG-HNNXBMFYSA-N 2 0 332.513 4.449 20 0 EIADRP COc1ccc(CC(C)(C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167975122 1026222388 /nfs/dbraw/zinc/22/23/88/1026222388.db2.gz HWNNVURRPKKIAU-IHWFROFDSA-N 2 0 342.527 4.011 20 0 EIADRP Cc1ccc(CC2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)cc1 ZINC001167975414 1026255829 /nfs/dbraw/zinc/25/58/29/1026255829.db2.gz OTGMNEYOTQPEPW-FRIKZZABSA-N 2 0 338.539 4.313 20 0 EIADRP C[NH+](C)CC1CC[NH+](Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000506852561 1026267908 /nfs/dbraw/zinc/26/79/08/1026267908.db2.gz XDOCWTVBENELIU-UHFFFAOYSA-N 2 0 332.488 4.328 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2csc(-c3csc(C)n3)c2)C1 ZINC000163260647 1026361733 /nfs/dbraw/zinc/36/17/33/1026361733.db2.gz FQFHKBRGBWPGMZ-GXTWGEPZSA-N 2 0 335.542 4.172 20 0 EIADRP Cc1ccc2cccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)c2n1 ZINC001167981920 1026367379 /nfs/dbraw/zinc/36/73/79/1026367379.db2.gz PHVIEDVDVOQYFR-SEJPIABJSA-N 2 0 335.495 4.038 20 0 EIADRP FC(F)(F)[C@H]1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167982120 1026385230 /nfs/dbraw/zinc/38/52/30/1026385230.db2.gz XNDFWDURSKPDRT-ZZCJBCQWSA-N 2 0 330.438 4.103 20 0 EIADRP C[C@H](c1ccccc1)N1CCC([NH2+][C@@H](C)Cc2ccc(O)cc2)CC1 ZINC000511095822 1026389429 /nfs/dbraw/zinc/38/94/29/1026389429.db2.gz XHRJHKSRFHVXPO-ZWKOTPCHSA-N 2 0 338.495 4.138 20 0 EIADRP Clc1ccc([C@@H]2C[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167982177 1026389644 /nfs/dbraw/zinc/38/96/44/1026389644.db2.gz ZLDWSDAWESBIHG-OLPBJYBYSA-N 2 0 330.903 4.191 20 0 EIADRP CCC(CC)[N@H+](CC(C)C)C[C@H]1CN(Cc2ccccc2)CCCO1 ZINC001167562661 1026435814 /nfs/dbraw/zinc/43/58/14/1026435814.db2.gz OJUXEPQJLHZRJY-JOCHJYFZSA-N 2 0 346.559 4.424 20 0 EIADRP CN1CCC([NH2+]C2CCC(c3cccc(C(F)(F)F)c3)CC2)CC1 ZINC000432535038 1026436618 /nfs/dbraw/zinc/43/66/18/1026436618.db2.gz IUFXSAZCMMGXII-UHFFFAOYSA-N 2 0 340.433 4.415 20 0 EIADRP c1cc(Sc2ccccn2)oc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000550265749 1026445421 /nfs/dbraw/zinc/44/54/21/1026445421.db2.gz CCMYSDUYFLTLQW-UHFFFAOYSA-N 2 0 345.512 4.182 20 0 EIADRP Cc1ccncc1C[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000279546391 1026502337 /nfs/dbraw/zinc/50/23/37/1026502337.db2.gz AVKFHHNQEBVPHL-UHFFFAOYSA-N 2 0 345.490 4.408 20 0 EIADRP Cc1ccc2cc(C[NH2+][C@@H](C)[C@@H]3CCC[N@@H+](C4CCC4)C3)[nH]c2c1 ZINC000657429841 1026640705 /nfs/dbraw/zinc/64/07/05/1026640705.db2.gz LMEDEXIBHHNPJC-FUHWJXTLSA-N 2 0 325.500 4.219 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](C/C(C)=C/c2ccccc2COC)CC1 ZINC000507207545 1026689310 /nfs/dbraw/zinc/68/93/10/1026689310.db2.gz DPGRLEAYUKSFFH-XDJHFCHBSA-N 2 0 344.543 4.290 20 0 EIADRP CC[C@H]1C[C@@]1([NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C)c1cccc(C)c1 ZINC000500493367 1026792794 /nfs/dbraw/zinc/79/27/94/1026792794.db2.gz YAASJKYNYHQDQY-UGKGYDQZSA-N 2 0 346.478 4.299 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+]CC2(C)CC[NH+](C)CC2)cc1 ZINC000507452887 1026798603 /nfs/dbraw/zinc/79/86/03/1026798603.db2.gz YNGSAWSXKFWHSF-SFTDATJTSA-N 2 0 344.543 4.431 20 0 EIADRP CCc1cccnc1[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000507497246 1026810981 /nfs/dbraw/zinc/81/09/81/1026810981.db2.gz RGKICKCOZBNIOA-GOSISDBHSA-N 2 0 337.511 4.207 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)[C@H]1CCCOC1 ZINC000507513044 1026822331 /nfs/dbraw/zinc/82/23/31/1026822331.db2.gz QNKHQFOOXBDKMS-MOXWOTFGSA-N 2 0 344.543 4.069 20 0 EIADRP CCc1cccnc1[C@@H](C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000507511100 1026822850 /nfs/dbraw/zinc/82/28/50/1026822850.db2.gz NRTCBSYXNIAIMR-MRXNPFEDSA-N 2 0 343.540 4.268 20 0 EIADRP CC[NH+](CC)CCO[C@@H]1CC[N@@H+]([C@@H](C)c2c(C)cc(C)cc2C)C1 ZINC001167603780 1026993575 /nfs/dbraw/zinc/99/35/75/1026993575.db2.gz ZQDGHSMBHIROQW-VQTJNVASSA-N 2 0 332.532 4.106 20 0 EIADRP CC(C)(C)C1CCC([NH2+]CC2CC[NH+](C3CCOCC3)CC2)CC1 ZINC000657536991 1026999336 /nfs/dbraw/zinc/99/93/36/1026999336.db2.gz XJSKYBXTEMKTTR-UHFFFAOYSA-N 2 0 336.564 4.072 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000519818982 1027013974 /nfs/dbraw/zinc/01/39/74/1027013974.db2.gz FSPUSGGCZZAEDC-UPKQVVFYSA-N 2 0 349.453 4.180 20 0 EIADRP C[C@H]([NH2+]CCC[NH+]1CCCCC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474477234 1027109686 /nfs/dbraw/zinc/10/96/86/1027109686.db2.gz RGPKSSGINSTXSZ-SOUVJXGZSA-N 2 0 326.937 4.359 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000474477198 1027110340 /nfs/dbraw/zinc/11/03/40/1027110340.db2.gz RCBBSSSKCCLRQH-IPMKNSEASA-N 2 0 332.532 4.431 20 0 EIADRP CCc1cccc(F)c1C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000474485274 1027123486 /nfs/dbraw/zinc/12/34/86/1027123486.db2.gz PNBJDFUMTMPIGA-UHFFFAOYSA-N 2 0 326.459 4.274 20 0 EIADRP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474600111 1027289584 /nfs/dbraw/zinc/28/95/84/1027289584.db2.gz UIQPZCKZDSNJLO-LJISPDSOSA-N 2 0 326.937 4.215 20 0 EIADRP C[C@@H](c1ccc(OC(F)F)cc1)[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000441331237 1027467918 /nfs/dbraw/zinc/46/79/18/1027467918.db2.gz NMXPITKARPHRJM-GOEBONIOSA-N 2 0 326.431 4.155 20 0 EIADRP CC(=O)c1c(C)cc(C)c(CN(C)CC[C@H]2CCCC[N@@H+]2C)c1C ZINC000441367423 1027490517 /nfs/dbraw/zinc/49/05/17/1027490517.db2.gz IBXZXZAUCUGHQG-LJQANCHMSA-N 2 0 330.516 4.121 20 0 EIADRP C[C@H](C[NH2+][C@H](C)c1ccc(OC(F)F)cc1)C[NH+]1CCCCC1 ZINC000320904089 1027543392 /nfs/dbraw/zinc/54/33/92/1027543392.db2.gz CLRMOYYJAYHBIG-HUUCEWRRSA-N 2 0 326.431 4.061 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cc(F)ccc1F ZINC000112518296 1027579131 /nfs/dbraw/zinc/57/91/31/1027579131.db2.gz IGCLSWLMNYQJDA-HNNXBMFYSA-N 2 0 330.422 4.411 20 0 EIADRP CC(C)OC1CCC([NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)CC1 ZINC000090772059 1027583380 /nfs/dbraw/zinc/58/33/80/1027583380.db2.gz YHNWNNLOVFKNPK-QXWDQEIOSA-N 2 0 336.564 4.355 20 0 EIADRP Clc1cccc(C2CC([NH2+]CC3CC[NH+](CC4CC4)CC3)C2)c1 ZINC000658354557 1027585033 /nfs/dbraw/zinc/58/50/33/1027585033.db2.gz DPHHDLKFJVAJEB-UHFFFAOYSA-N 2 0 332.919 4.298 20 0 EIADRP CC(C)OC1CCC([NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)CC1 ZINC000090771514 1027593582 /nfs/dbraw/zinc/59/35/82/1027593582.db2.gz AHSNWPQVUIUGER-SDEKRAFDSA-N 2 0 336.564 4.355 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1OC ZINC000152466046 1027661412 /nfs/dbraw/zinc/66/14/12/1027661412.db2.gz LGEWIZXJLJYNJQ-DLBZAZTESA-N 2 0 346.515 4.009 20 0 EIADRP Oc1ccc(C2CCC([NH2+]C3CC([NH+]4CCCCC4)C3)CC2)cc1 ZINC000475580753 1027706574 /nfs/dbraw/zinc/70/65/74/1027706574.db2.gz DCTQUOSSLLKJOW-UHFFFAOYSA-N 2 0 328.500 4.025 20 0 EIADRP CCOC[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000474874642 1027717335 /nfs/dbraw/zinc/71/73/35/1027717335.db2.gz BVESUQMUTGBEAR-QESAQDPVSA-N 2 0 344.543 4.082 20 0 EIADRP c1ccc(C[C@@H]2CCC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)C2)cc1 ZINC001167995500 1027775181 /nfs/dbraw/zinc/77/51/81/1027775181.db2.gz HTIJQYCABLVOIZ-JYEDNEFCSA-N 2 0 338.539 4.347 20 0 EIADRP FC(F)(F)c1cc(Cl)cc(CNC2CC[NH+](CC3CC3)CC2)c1 ZINC000189053709 1028061459 /nfs/dbraw/zinc/06/14/59/1028061459.db2.gz IMXIIJQMCBVGEC-UHFFFAOYSA-N 2 0 346.824 4.323 20 0 EIADRP Cc1ccc2cc(C[NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)ccc2n1 ZINC000189236027 1028090380 /nfs/dbraw/zinc/09/03/80/1028090380.db2.gz JCGMRZXXQIFNMK-UHFFFAOYSA-N 2 0 345.490 4.429 20 0 EIADRP COc1ccc2cc(C[NH2+]CCC[N@@H+]3CCCC[C@H]3C)ccc2c1 ZINC000324195688 1028191369 /nfs/dbraw/zinc/19/13/69/1028191369.db2.gz RZXBLTGKBSYICQ-QGZVFWFLSA-N 2 0 326.484 4.203 20 0 EIADRP FC(F)(F)CC[N@@H+](Cc1cc(-n2ccnc2)cs1)CC1CC1 ZINC000346167464 1028299491 /nfs/dbraw/zinc/29/94/91/1028299491.db2.gz KQDUXQITDHYSMJ-UHFFFAOYSA-N 2 0 329.391 4.098 20 0 EIADRP Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cn(-c3cc[nH+]cc3)nc2C)s1 ZINC000346205299 1028330135 /nfs/dbraw/zinc/33/01/35/1028330135.db2.gz LYPRIIGMRSXBAQ-SFHVURJKSA-N 2 0 338.480 4.283 20 0 EIADRP CCC[NH+]1CCC(C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)CC1 ZINC000523739931 1028345175 /nfs/dbraw/zinc/34/51/75/1028345175.db2.gz OLQZIUQKSVLIHL-UHFFFAOYSA-N 2 0 348.437 4.436 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](c1cncc(F)c1)C1CC1 ZINC000281380517 1028553121 /nfs/dbraw/zinc/55/31/21/1028553121.db2.gz XERIULIHOLIKLO-NRFANRHFSA-N 2 0 341.474 4.303 20 0 EIADRP CC[NH+]1CCC([NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)CC1 ZINC000443978789 1028664296 /nfs/dbraw/zinc/66/42/96/1028664296.db2.gz MIOSUBYNLZTAJW-UHFFFAOYSA-N 2 0 328.431 4.192 20 0 EIADRP CC[C@H]([NH2+]CC[C@@H](C)[NH+]1CCCCC1)c1ccc(OC)c(OC)c1 ZINC000346860193 1028796722 /nfs/dbraw/zinc/79/67/22/1028796722.db2.gz JASNXCIVUBDZEX-AEFFLSMTSA-N 2 0 334.504 4.009 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CC[C@H](C)[NH+]2CCCCC2)cc1 ZINC000346870255 1028802732 /nfs/dbraw/zinc/80/27/32/1028802732.db2.gz LSLLFWLRJBCPSN-ZWKOTPCHSA-N 2 0 340.515 4.096 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+][C@H]1CC[NH2+]CC(C)(C)C1 ZINC000635009890 1028816962 /nfs/dbraw/zinc/81/69/62/1028816962.db2.gz IFQGDPFMGZPDMO-ILXRZTDVSA-N 2 0 331.529 4.156 20 0 EIADRP COCCC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccc(F)cc1 ZINC000281880157 1028906295 /nfs/dbraw/zinc/90/62/95/1028906295.db2.gz GDLNGWTXJXLZPT-FXAWDEMLSA-N 2 0 336.495 4.003 20 0 EIADRP Cc1nc(C(C)C)oc1CN[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000428430026 1029125542 /nfs/dbraw/zinc/12/55/42/1029125542.db2.gz GUEYEGXSAWATCT-APWZRJJASA-N 2 0 341.499 4.107 20 0 EIADRP C[C@H]([NH2+]CCCn1ccnc1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000151131553 1029142446 /nfs/dbraw/zinc/14/24/46/1029142446.db2.gz JIHSUXGPHNCCPC-STQMWFEESA-N 2 0 342.270 4.026 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@H](c3cccnc3)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168053368 1029160528 /nfs/dbraw/zinc/16/05/28/1029160528.db2.gz OEOPTENAXNXTEN-YDLSIGKMSA-N 2 0 349.522 4.313 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](c1ccccc1OC)C1CCCC1 ZINC000650756968 1029199233 /nfs/dbraw/zinc/19/92/33/1029199233.db2.gz LFLVUYHBHNHSRR-JOCHJYFZSA-N 2 0 338.495 4.436 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CCCc2c(C)cccc21 ZINC000657796321 1029200801 /nfs/dbraw/zinc/20/08/01/1029200801.db2.gz FHDOITCJIOBKOC-NRFANRHFSA-N 2 0 332.451 4.051 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1ccc2cc(OC)ccc2c1 ZINC000650757972 1029203420 /nfs/dbraw/zinc/20/34/20/1029203420.db2.gz FVGFSEKIYTVKRQ-MRXNPFEDSA-N 2 0 334.463 4.419 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[NH2+]C)c1cccc(Br)c1 ZINC000650757799 1029209783 /nfs/dbraw/zinc/20/97/83/1029209783.db2.gz BAAPLFRIRBECAP-SFHVURJKSA-N 2 0 347.300 4.409 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[NH2+]C)c1ccccc1OC(F)F ZINC000650758662 1029214758 /nfs/dbraw/zinc/21/47/58/1029214758.db2.gz VERWNNJBQMIZDK-KRWDZBQOSA-N 2 0 334.410 4.248 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1cccc(OC(F)(F)F)c1 ZINC000650758655 1029216384 /nfs/dbraw/zinc/21/63/84/1029216384.db2.gz UYIQNVRYUWZZJF-ZDUSSCGKSA-N 2 0 338.373 4.155 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(Br)s1 ZINC000278460525 1029280516 /nfs/dbraw/zinc/28/05/16/1029280516.db2.gz MMRHBOIUXFQSPK-LLVKDONJSA-N 2 0 343.334 4.036 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(-n2ccnc2)cc1 ZINC000157935968 1029287844 /nfs/dbraw/zinc/28/78/44/1029287844.db2.gz WIKYXDQVCGRQDY-MOPGFXCFSA-N 3 0 340.515 4.035 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)[C@@H](C)c1nc2ccccc2s1 ZINC000278480448 1029326444 /nfs/dbraw/zinc/32/64/44/1029326444.db2.gz OPJIILKYDKCCCB-HUUCEWRRSA-N 2 0 343.540 4.252 20 0 EIADRP C(c1nc2c(s1)C[NH2+]CC2)[NH+](C1CCCCC1)C1CCCCC1 ZINC001204611484 1029356588 /nfs/dbraw/zinc/35/65/88/1029356588.db2.gz NXXSKIHMPGSEFC-UHFFFAOYSA-N 2 0 333.545 4.256 20 0 EIADRP CSC1(C[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)CC[NH+](C)CC1 ZINC000583964735 1029431130 /nfs/dbraw/zinc/43/11/30/1029431130.db2.gz ZMZLGFIBJLDMHO-IBGZPJMESA-N 2 0 348.531 4.179 20 0 EIADRP COC1CCC(C)(C[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)CC1 ZINC000475202326 1029433426 /nfs/dbraw/zinc/43/34/26/1029433426.db2.gz MBDIVHRJQGANHW-AFVILVPDSA-N 2 0 336.564 4.214 20 0 EIADRP CCC[N@H+](C1CCOCC1)C1C[C@@H](C)N(Cc2ccccc2)[C@H](C)C1 ZINC001168059634 1029437712 /nfs/dbraw/zinc/43/77/12/1029437712.db2.gz USQPLUTXAFCUSS-RTBURBONSA-N 2 0 344.543 4.319 20 0 EIADRP CC(C)CCn1cccc1C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475218836 1029451486 /nfs/dbraw/zinc/45/14/86/1029451486.db2.gz HDWPIZNTEYGBSX-OAQYLSRUSA-N 2 0 339.527 4.146 20 0 EIADRP COCCC1(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)CCCCC1 ZINC000475269210 1029477869 /nfs/dbraw/zinc/47/78/69/1029477869.db2.gz MSANAWAJAARJPF-OAQYLSRUSA-N 2 0 344.543 4.085 20 0 EIADRP Cc1cc2[nH]c(C[NH2+]C[C@H]3CC[N@H+](Cc4ccccc4)C3)cc2c(C)c1 ZINC000475278363 1029484357 /nfs/dbraw/zinc/48/43/57/1029484357.db2.gz VNCOKMLBNHDFRW-HXUWFJFHSA-N 2 0 347.506 4.396 20 0 EIADRP Cc1cc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc2cccnc12 ZINC000475282813 1029495818 /nfs/dbraw/zinc/49/58/18/1029495818.db2.gz HCVUGGKCSCYXAX-HXUWFJFHSA-N 2 0 345.490 4.155 20 0 EIADRP CCCC[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)c1ccc(F)cc1 ZINC000133028123 1029541200 /nfs/dbraw/zinc/54/12/00/1029541200.db2.gz KGEINMZDFLTEKZ-UWJYYQICSA-N 2 0 348.506 4.148 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cc2ccccc2s1 ZINC000446817221 1029580433 /nfs/dbraw/zinc/58/04/33/1029580433.db2.gz GYDWWPGMKKJUJB-IXDOHACOSA-N 2 0 346.540 4.441 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1cccc(OC(F)F)c1 ZINC000584067847 1029587970 /nfs/dbraw/zinc/58/79/70/1029587970.db2.gz KDWOYMCPZIDYJA-HNNXBMFYSA-N 2 0 326.431 4.205 20 0 EIADRP CC[C@@H]([NH2+]CCCC[NH+](C)C)c1ccc(Br)cc1Cl ZINC000446842182 1029607699 /nfs/dbraw/zinc/60/76/99/1029607699.db2.gz UZUBOWUUYHFQTP-OAHLLOKOSA-N 2 0 347.728 4.485 20 0 EIADRP C[C@@H]([N@H+](C)Cc1cncc(C[NH+](C)[C@@H](C)C2(C)CC2)c1)C1(C)CC1 ZINC000584094448 1029613259 /nfs/dbraw/zinc/61/32/59/1029613259.db2.gz PTPUIXZKJKSSLE-CALCHBBNSA-N 2 0 329.532 4.322 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)CCCS2 ZINC000446935335 1029645145 /nfs/dbraw/zinc/64/51/45/1029645145.db2.gz ZLBYZKDPEYRHCF-RLFYNMQTSA-N 2 0 334.529 4.085 20 0 EIADRP CSc1ccc([C@H](C)[NH2+]CC2(SC)CC[NH+](C)CC2)cc1F ZINC000584261687 1029698324 /nfs/dbraw/zinc/69/83/24/1029698324.db2.gz PTWLUZCZXSGWJP-ZDUSSCGKSA-N 2 0 342.549 4.026 20 0 EIADRP Cc1cc(NC2CC[NH+](C3CC3)CC2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000301361942 1029717440 /nfs/dbraw/zinc/71/74/40/1029717440.db2.gz OXPWMYOGLJBZLM-UHFFFAOYSA-N 2 0 347.409 4.183 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1cc2cnccc2o1 ZINC000657839674 1029733182 /nfs/dbraw/zinc/73/31/82/1029733182.db2.gz YJQALDRHKRUTQW-BRWVUGGUSA-N 2 0 329.488 4.237 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1CNCc1ccc(Cl)cc1F ZINC000708519309 1029743096 /nfs/dbraw/zinc/74/30/96/1029743096.db2.gz HNRPWTURFWUPRO-YJBOKZPZSA-N 2 0 346.877 4.337 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)C1CCOCC1 ZINC000584380786 1029794888 /nfs/dbraw/zinc/79/48/88/1029794888.db2.gz SDKIMIKXQCNPAK-IRLDBZIGSA-N 2 0 344.543 4.084 20 0 EIADRP C[N@@H+]1CC[C@@H](C[NH2+]C/C=C/c2ccc(F)c(F)c2)[C@H]1c1cccs1 ZINC000375751957 1029859888 /nfs/dbraw/zinc/85/98/88/1029859888.db2.gz YWUBBPJFJMGRDR-WKSODWKVSA-N 2 0 348.462 4.322 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](c1cccnc1)C(C)C ZINC000091267501 1029882205 /nfs/dbraw/zinc/88/22/05/1029882205.db2.gz AYBHOYDVJADNOQ-OAQYLSRUSA-N 2 0 325.500 4.410 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](c2cccnc2)C(C)C)c1 ZINC000091287805 1029883191 /nfs/dbraw/zinc/88/31/91/1029883191.db2.gz VPZVMLOQTJAYCD-OAQYLSRUSA-N 2 0 325.500 4.410 20 0 EIADRP C[C@@H](C[N@@H+]1CCC[C@H](c2ncc[nH]2)C1)c1cccc(Br)c1 ZINC000092073653 1029899084 /nfs/dbraw/zinc/89/90/84/1029899084.db2.gz HSOJHHPLCPHDLW-ZFWWWQNUSA-N 2 0 348.288 4.155 20 0 EIADRP Cc1c(F)cccc1-c1ccc(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)o1 ZINC000092071840 1029899574 /nfs/dbraw/zinc/89/95/74/1029899574.db2.gz WRPQTTZCAISSLK-OAHLLOKOSA-N 2 0 339.414 4.497 20 0 EIADRP Cc1nc(C)c([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)s1 ZINC000181663824 1029908622 /nfs/dbraw/zinc/90/86/22/1029908622.db2.gz JIGBOBSNMXSLPU-ZLPCBKJTSA-N 2 0 335.561 4.454 20 0 EIADRP Fc1ccc(C[C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000447536257 1030142353 /nfs/dbraw/zinc/14/23/53/1030142353.db2.gz LZPUEEIWBHOTNO-GCJKJVERSA-N 2 0 338.470 4.183 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(c2c(Cl)cccc2Cl)CCC1 ZINC000447571372 1030156755 /nfs/dbraw/zinc/15/67/55/1030156755.db2.gz XXIAANBZCJNINZ-BBRMVZONSA-N 2 0 341.326 4.345 20 0 EIADRP Fc1ccc(C[C@H]([NH2+]C2CCN(C3CC3)CC2)c2ccccc2)cc1 ZINC000447560908 1030167027 /nfs/dbraw/zinc/16/70/27/1030167027.db2.gz GDIRCYTUHRQVBV-QFIPXVFZSA-N 2 0 338.470 4.326 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1cc2ccncc2s1 ZINC000657884051 1030189102 /nfs/dbraw/zinc/18/91/02/1030189102.db2.gz IPZFTXUYNGJIMK-ZDUSSCGKSA-N 2 0 343.471 4.348 20 0 EIADRP C[C@H](C[NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccccc1 ZINC000447822796 1030347821 /nfs/dbraw/zinc/34/78/21/1030347821.db2.gz RMUOWKREZQNQLU-QGZVFWFLSA-N 2 0 328.525 4.353 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+]CCCCc2ccc(Cl)c(Cl)c2)C1 ZINC000526978240 1030358915 /nfs/dbraw/zinc/35/89/15/1030358915.db2.gz KANQTKUOZUCMIC-OAHLLOKOSA-N 2 0 329.315 4.248 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)nc1 ZINC000179112947 1030430346 /nfs/dbraw/zinc/43/03/46/1030430346.db2.gz YMALFSJHDGNNBQ-MRXNPFEDSA-N 2 0 343.902 4.298 20 0 EIADRP FCC1CC[NH+](Cc2ccc(C[NH+]3CCC(CF)CC3)cc2)CC1 ZINC000451392351 1030462323 /nfs/dbraw/zinc/46/23/23/1030462323.db2.gz IVOSVSGZYCHEOO-UHFFFAOYSA-N 2 0 336.470 4.050 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2cscc2C(F)(F)F)C1 ZINC000685612953 1030574559 /nfs/dbraw/zinc/57/45/59/1030574559.db2.gz KPKXMVMKUWTVPN-ZDUSSCGKSA-N 2 0 334.451 4.369 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc3ccncc3s2)C1 ZINC000657932151 1030637451 /nfs/dbraw/zinc/63/74/51/1030637451.db2.gz UQPQMHBWDDNADY-HOTGVXAUSA-N 2 0 331.529 4.315 20 0 EIADRP Cc1nccn1CCCC[N@@H+]1CCCC[C@H]1c1nc2ccccc2[nH]1 ZINC000451878311 1030757480 /nfs/dbraw/zinc/75/74/80/1030757480.db2.gz MJVXPJVWZFUZCY-IBGZPJMESA-N 2 0 337.471 4.075 20 0 EIADRP C[NH+](C)Cc1cc(CNCc2c(F)ccc(F)c2Cl)ccc1F ZINC000527660895 1030804622 /nfs/dbraw/zinc/80/46/22/1030804622.db2.gz JZQYUMMHEBICAS-UHFFFAOYSA-N 2 0 342.792 4.109 20 0 EIADRP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000658048369 1030806097 /nfs/dbraw/zinc/80/60/97/1030806097.db2.gz VYRJVXUQHMMWDO-BNOWGMLFSA-N 2 0 348.840 4.220 20 0 EIADRP C[C@@H](CCC1CCCCC1)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658066733 1030812593 /nfs/dbraw/zinc/81/25/93/1030812593.db2.gz DIGLYBWNPXWVHK-SFHVURJKSA-N 2 0 336.564 4.216 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+]C[C@@H]2CCN(c3ccccc3Cl)C2)CC1 ZINC000658069669 1030816240 /nfs/dbraw/zinc/81/62/40/1030816240.db2.gz QDGQQZVPZPUWFK-INIZCTEOSA-N 2 0 349.950 4.019 20 0 EIADRP CCc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658166699 1030863177 /nfs/dbraw/zinc/86/31/77/1030863177.db2.gz OCUIZAOQUFEQRY-SFHVURJKSA-N 2 0 337.511 4.207 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccsc1 ZINC000658166902 1030863346 /nfs/dbraw/zinc/86/33/46/1030863346.db2.gz WCFZTIYSXBLIOX-IBGZPJMESA-N 2 0 329.513 4.096 20 0 EIADRP CC(C)[C@@H]1CCCC[C@@H]1[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658168351 1030866076 /nfs/dbraw/zinc/86/60/76/1030866076.db2.gz WFJMFANYZRDFMI-SFTDATJTSA-N 2 0 329.532 4.098 20 0 EIADRP Cc1cc(C)cc(C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000658177705 1030869108 /nfs/dbraw/zinc/86/91/08/1030869108.db2.gz WZISXOUDKUOXLV-GOSISDBHSA-N 2 0 326.484 4.095 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCOc2cccc3ccccc32)C[C@H]1C ZINC000531140874 1030912496 /nfs/dbraw/zinc/91/24/96/1030912496.db2.gz MCHAGDIHZULHQR-IEBWSBKVSA-N 2 0 326.484 4.023 20 0 EIADRP Cc1ccncc1[C@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658320001 1030978215 /nfs/dbraw/zinc/97/82/15/1030978215.db2.gz LPPXBLLDTCDEFJ-FPOVZHCZSA-N 2 0 349.522 4.343 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cncs1 ZINC000658319530 1030980822 /nfs/dbraw/zinc/98/08/22/1030980822.db2.gz FYEQZJAXPOQXRL-AEFFLSMTSA-N 2 0 341.524 4.096 20 0 EIADRP c1cncc([C@@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)C2CCCCC2)c1 ZINC000658353544 1031026138 /nfs/dbraw/zinc/02/61/38/1031026138.db2.gz OMONMQFCDZFRJU-QFIPXVFZSA-N 2 0 341.543 4.415 20 0 EIADRP CC(C)C[NH+]1CCC(N[C@H](C)c2sccc2Br)CC1 ZINC000532451612 1031086599 /nfs/dbraw/zinc/08/65/99/1031086599.db2.gz DPDZYDMZNJSTIH-GFCCVEGCSA-N 2 0 345.350 4.282 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2ccccc2n1)c1cccc(OCC[NH+](C)C)c1 ZINC000532463285 1031127426 /nfs/dbraw/zinc/12/74/26/1031127426.db2.gz MRMFWAKVBVJOAR-KRWDZBQOSA-N 2 0 349.478 4.026 20 0 EIADRP Cc1cc(C)c(C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)c(C)c1 ZINC000532463596 1031129797 /nfs/dbraw/zinc/12/97/97/1031129797.db2.gz VUZSLQVEOVLXMV-LJQANCHMSA-N 2 0 340.511 4.403 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(Sc2ccccc2)CCCC1 ZINC000532506785 1031230155 /nfs/dbraw/zinc/23/01/55/1031230155.db2.gz FXUMAODPFZMWOV-ZIFCJYIRSA-N 2 0 332.557 4.410 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(-n2cccn2)cc1 ZINC000532511015 1031244900 /nfs/dbraw/zinc/24/49/00/1031244900.db2.gz OMYNLLSSPZAERI-LJQANCHMSA-N 2 0 340.515 4.179 20 0 EIADRP C[C@H](CCc1ccco1)[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449059246 1031389872 /nfs/dbraw/zinc/38/98/72/1031389872.db2.gz PDRWXWFVJPCYFN-RTBURBONSA-N 2 0 340.511 4.286 20 0 EIADRP CC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCOC4(CCC4)C3)cc2)CC1 ZINC000449073224 1031425133 /nfs/dbraw/zinc/42/51/33/1031425133.db2.gz RRTWOZOUYWJPNF-OAQYLSRUSA-N 2 0 342.527 4.110 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCOC3(CCC3)C2)C1 ZINC000449082169 1031436650 /nfs/dbraw/zinc/43/66/50/1031436650.db2.gz LFFHJTMAZISQNL-RXVVDRJESA-N 2 0 342.527 4.110 20 0 EIADRP COc1cccc2c(C[NH2+]C[C@H]3CCC[N@@H+](C(C)C)C3)cccc12 ZINC000449133311 1031469867 /nfs/dbraw/zinc/46/98/67/1031469867.db2.gz XXYBMWXJHQAYMA-QGZVFWFLSA-N 2 0 326.484 4.058 20 0 EIADRP CCC[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(OC)cc1 ZINC000123603750 1031474331 /nfs/dbraw/zinc/47/43/31/1031474331.db2.gz IRVFMAMBEJKZMO-NRFANRHFSA-N 2 0 326.484 4.388 20 0 EIADRP Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)CCCO2 ZINC000123660552 1031477999 /nfs/dbraw/zinc/47/79/99/1031477999.db2.gz QWBNFKILVCRLGK-NRFANRHFSA-N 2 0 338.495 4.369 20 0 EIADRP CS[C@@H]1CCC[C@@H]([NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)C1 ZINC000449143941 1031478881 /nfs/dbraw/zinc/47/88/81/1031478881.db2.gz RNBYESBIVXZLAG-DUXKGJEZSA-N 2 0 346.584 4.346 20 0 EIADRP C[C@H](Cc1ccoc1)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000449157071 1031488407 /nfs/dbraw/zinc/48/84/07/1031488407.db2.gz FTWIANXPTUIMGD-QGZVFWFLSA-N 2 0 338.451 4.225 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000531705063 1031491338 /nfs/dbraw/zinc/49/13/38/1031491338.db2.gz YZMWSDQJKPJMRE-OAQYLSRUSA-N 2 0 344.474 4.397 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCCc1ccc(Cl)cc1Cl ZINC000531738281 1031515918 /nfs/dbraw/zinc/51/59/18/1031515918.db2.gz FUHJTXZAAOBUOM-IIYDPXPESA-N 2 0 329.315 4.244 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1cc(-c2ccccc2)nn1C ZINC000453067199 1031530638 /nfs/dbraw/zinc/53/06/38/1031530638.db2.gz YVKUSOHWJMQNMW-MSOLQXFVSA-N 2 0 342.531 4.248 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21 ZINC000449217891 1031551721 /nfs/dbraw/zinc/55/17/21/1031551721.db2.gz COBKHGBOAJWTIG-SWLSCSKDSA-N 2 0 328.422 4.191 20 0 EIADRP COCCC(C)(C)C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449243628 1031578424 /nfs/dbraw/zinc/57/84/24/1031578424.db2.gz MBSUAJUBKCCUKE-UHFFFAOYSA-N 2 0 326.569 4.318 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CCCN(C)[C@H]1c1cccs1)c1ccncc1 ZINC000453116541 1031606932 /nfs/dbraw/zinc/60/69/32/1031606932.db2.gz HRQXXIQHTXNLLN-ZIFCJYIRSA-N 2 0 329.513 4.267 20 0 EIADRP FC(F)(F)CCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000453122745 1031616056 /nfs/dbraw/zinc/61/60/56/1031616056.db2.gz PKDYFHQYRJQBTC-KURKYZTESA-N 2 0 340.433 4.362 20 0 EIADRP C1CCC([NH+]2CCC([NH2+][C@H]3CCOC4(CCCCC4)C3)CC2)CC1 ZINC000127370871 1031687912 /nfs/dbraw/zinc/68/79/12/1031687912.db2.gz VXTUOKZDZKSZBV-IBGZPJMESA-N 2 0 334.548 4.255 20 0 EIADRP CC(C)[C@@H]1C[C@H](C[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)CCO1 ZINC000449495662 1031803334 /nfs/dbraw/zinc/80/33/34/1031803334.db2.gz OVXXVEOFDORXDN-YHELAOLJSA-N 2 0 336.564 4.070 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000531944455 1031825832 /nfs/dbraw/zinc/82/58/32/1031825832.db2.gz NNOXLFJNYMCUOK-SJORKVTESA-N 2 0 326.484 4.039 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2CCCC2(F)F)CC1 ZINC000453317176 1031844234 /nfs/dbraw/zinc/84/42/34/1031844234.db2.gz JNDUPHDVMAWPPT-VIQWUECVSA-N 2 0 336.470 4.455 20 0 EIADRP Cc1cc2c(cc1C)[C@@H](NC1CC[NH+](CC(C)C)CC1)CCCO2 ZINC000531941888 1031852180 /nfs/dbraw/zinc/85/21/80/1031852180.db2.gz PLSIPKRFGQALHB-FQEVSTJZSA-N 2 0 330.516 4.227 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)C1CCOCC1 ZINC000531947151 1031859118 /nfs/dbraw/zinc/85/91/18/1031859118.db2.gz HNGSHGJGTZTUDG-GCJKJVERSA-N 2 0 344.543 4.213 20 0 EIADRP CC(C)CCOc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000453349731 1031876547 /nfs/dbraw/zinc/87/65/47/1031876547.db2.gz LWPZXBKNKPUGJH-VOBGVNJCSA-N 2 0 330.516 4.387 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(Br)cc2)CC1 ZINC000531959159 1031878599 /nfs/dbraw/zinc/87/85/99/1031878599.db2.gz APSJPMIPYZDYLI-CQSZACIVSA-N 2 0 339.321 4.222 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1F ZINC000453359690 1031888820 /nfs/dbraw/zinc/88/88/20/1031888820.db2.gz QFNHWAAPNACHMS-OQVRHKMJSA-N 2 0 346.490 4.075 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2cccc(Br)c21 ZINC000453366824 1031908251 /nfs/dbraw/zinc/90/82/51/1031908251.db2.gz SWLNWJYQITZZPD-XRBJRZNLSA-N 2 0 349.316 4.212 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]C1CCC2(CCOCC2)CC1 ZINC000531979784 1031924781 /nfs/dbraw/zinc/92/47/81/1031924781.db2.gz VSVWPYQAUCIGFK-ICSRJNTNSA-N 2 0 336.564 4.216 20 0 EIADRP COc1ccc(C2CCC([NH2+]CCCC[N@H+](C)C3CC3)CC2)cc1 ZINC000453403752 1031938304 /nfs/dbraw/zinc/93/83/04/1031938304.db2.gz OSIHSDDDYUNJFU-UHFFFAOYSA-N 2 0 330.516 4.185 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C[C@@H]2CCOC(C)(C)C2)CC1 ZINC000453405130 1031941142 /nfs/dbraw/zinc/94/11/42/1031941142.db2.gz DWKVYFZWBCSQFQ-QGZVFWFLSA-N 2 0 338.580 4.460 20 0 EIADRP FC1(F)CC(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000453416163 1031952677 /nfs/dbraw/zinc/95/26/77/1031952677.db2.gz JYGYILBCTVHSHX-YQQQUEKLSA-N 2 0 334.454 4.207 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@](C)(Cc1ccccc1)C1CC1 ZINC000449782355 1032006264 /nfs/dbraw/zinc/00/62/64/1032006264.db2.gz ZCBKERZFSFTHKD-QFIPXVFZSA-N 2 0 346.478 4.077 20 0 EIADRP FC(F)(F)Oc1ccc(C[NH2+]CCCCC[NH+]2CCCCC2)cc1 ZINC000500884199 1033873233 /nfs/dbraw/zinc/87/32/33/1033873233.db2.gz AQLGYJFGOKFHAF-UHFFFAOYSA-N 2 0 344.421 4.331 20 0 EIADRP COc1cc(-c2ccccc2)ccc1C[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000512772674 1033903986 /nfs/dbraw/zinc/90/39/86/1033903986.db2.gz CWTVGMGTGQYLTH-HXUWFJFHSA-N 2 0 347.462 4.465 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+]Cc2cc3ccnc(Cl)c3s2)CC1 ZINC000894165847 1034453458 /nfs/dbraw/zinc/45/34/58/1034453458.db2.gz IFTRUDAZZJQFSF-UHFFFAOYSA-N 2 0 337.920 4.160 20 0 EIADRP Cc1ccc([C@H]2OCCC[C@@H]2[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1 ZINC000513341441 1034888943 /nfs/dbraw/zinc/88/89/43/1034888943.db2.gz VFNUQEBZCUELAX-VQTJNVASSA-N 2 0 330.516 4.068 20 0 EIADRP CC(C)c1ncc(CN2CCC[C@@H](C[NH+]3CCCCCC3)C2)s1 ZINC000513406224 1034919068 /nfs/dbraw/zinc/91/90/68/1034919068.db2.gz OKUZVLNIOWZRMC-KRWDZBQOSA-N 2 0 335.561 4.355 20 0 EIADRP COc1ccccc1C[NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000513500092 1034995427 /nfs/dbraw/zinc/99/54/27/1034995427.db2.gz KMYKOPSBVDGDAS-UYAOXDASSA-N 2 0 338.495 4.086 20 0 EIADRP CCc1ncc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)s1 ZINC000513500611 1034998163 /nfs/dbraw/zinc/99/81/63/1034998163.db2.gz NMKKXRFBVBDCFV-AEFFLSMTSA-N 2 0 343.540 4.096 20 0 EIADRP COc1ccc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000513513009 1035008177 /nfs/dbraw/zinc/00/81/77/1035008177.db2.gz QZNFYGCYPMSIMR-NQIIRXRSSA-N 2 0 338.495 4.086 20 0 EIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@H]([NH2+]C4CCSCC4)[C@@H]3C2)cc1 ZINC000513683639 1035100827 /nfs/dbraw/zinc/10/08/27/1035100827.db2.gz LUBPYKMVIWMFOB-TYPHKJRUSA-N 2 0 344.568 4.162 20 0 EIADRP Cc1cccc(CCC[N@@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000501019802 1035350732 /nfs/dbraw/zinc/35/07/32/1035350732.db2.gz ABKYCKKMZUKQKI-UHFFFAOYSA-N 2 0 337.511 4.171 20 0 EIADRP C[C@@H]1CCCN(C(C)(C)C[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000501417428 1035437513 /nfs/dbraw/zinc/43/75/13/1035437513.db2.gz AYCWEIYDUWCEIA-QWFCFKBJSA-N 2 0 329.532 4.208 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[N@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000420326869 1035530187 /nfs/dbraw/zinc/53/01/87/1035530187.db2.gz XSWMONHUSDQKKZ-SJORKVTESA-N 2 0 343.540 4.419 20 0 EIADRP CSCC1(CC[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)CC1 ZINC000595066768 1035553130 /nfs/dbraw/zinc/55/31/30/1035553130.db2.gz DZVPCTRWFJHDTB-SFHVURJKSA-N 2 0 346.584 4.205 20 0 EIADRP CC(C)c1ccc([C@H](C)[NH+]2CCC([C@@H]3OCCC[C@@H]3[NH3+])CC2)cc1 ZINC000420388711 1035563803 /nfs/dbraw/zinc/56/38/03/1035563803.db2.gz XIPPFYBOQCYDQM-NDXORKPFSA-N 2 0 330.516 4.089 20 0 EIADRP FC(F)(F)c1cccc([C@@H]([NH2+]CCC2CC[NH2+]CC2)C2CC2)c1 ZINC000420397979 1035567007 /nfs/dbraw/zinc/56/70/07/1035567007.db2.gz GQWJHCRFORTPGC-KRWDZBQOSA-N 2 0 326.406 4.136 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]C[C@H]1CC[NH2+]C1 ZINC000420396458 1035567935 /nfs/dbraw/zinc/56/79/35/1035567935.db2.gz FHHSTOMFRSSHQP-AAEUAGOBSA-N 2 0 335.904 4.032 20 0 EIADRP Fc1cc(C[NH2+]Cc2ccc3c(c2)CCCC3)ccc1-n1ccnc1 ZINC000490806124 1035669266 /nfs/dbraw/zinc/66/92/66/1035669266.db2.gz YIBMMRZGKDZPPD-UHFFFAOYSA-N 2 0 335.426 4.180 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)CC3 ZINC000491043100 1035794311 /nfs/dbraw/zinc/79/43/11/1035794311.db2.gz YZIYFYSDOWEDAL-ZWKOTPCHSA-N 2 0 339.527 4.044 20 0 EIADRP Cc1cc(C)c([C@H](C)[N@@H+]2CC[C@@H](C(F)(F)F)[C@@H](C[NH3+])C2)c(C)c1 ZINC000629561697 1035826604 /nfs/dbraw/zinc/82/66/04/1035826604.db2.gz KKJWUZKTAKQDHN-HRCADAONSA-N 2 0 328.422 4.132 20 0 EIADRP Fc1ccccc1C[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000485480909 1035944880 /nfs/dbraw/zinc/94/48/80/1035944880.db2.gz ZLVRHAPOSSBUAV-UHFFFAOYSA-N 2 0 338.470 4.314 20 0 EIADRP CC[C@H](NCc1nc2c(s1)C[N@@H+](C(C)C)CC2)c1ccccc1 ZINC000414497288 1036043992 /nfs/dbraw/zinc/04/39/92/1036043992.db2.gz SJZNJGNPWQTXMA-INIZCTEOSA-N 2 0 329.513 4.151 20 0 EIADRP Cc1c(F)cccc1-c1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)o1 ZINC000513741038 1036057692 /nfs/dbraw/zinc/05/76/92/1036057692.db2.gz DGWJDPIBTSRAKY-UHFFFAOYSA-N 2 0 330.447 4.168 20 0 EIADRP FC(F)C1CCC([NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000669614285 1036243811 /nfs/dbraw/zinc/24/38/11/1036243811.db2.gz ZGNMGWXMSNSPFP-VIQWUECVSA-N 2 0 336.470 4.312 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@H]3CC34CCSCC4)CC2)C1 ZINC000421391660 1036356443 /nfs/dbraw/zinc/35/64/43/1036356443.db2.gz WNRBBSBCMWZPIM-ZHALLVOQSA-N 2 0 336.589 4.152 20 0 EIADRP Cc1cc(N(C)C[C@@H]2CC[N@H+](C)[C@H]2c2cccnc2)c2ccccc2[nH+]1 ZINC000486002176 1036416854 /nfs/dbraw/zinc/41/68/54/1036416854.db2.gz JDSIUOKJWWLKQU-AVRDEDQJSA-N 2 0 346.478 4.067 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2ccc(F)cc2F)CCCC1 ZINC000486079830 1036465574 /nfs/dbraw/zinc/46/55/74/1036465574.db2.gz QGLMYQLUFRVJFR-ZRGWGRIASA-N 2 0 336.470 4.095 20 0 EIADRP CCc1cccc2c(C3CC[NH+](CC[C@H]4CCC[N@@H+]4C)CC3)c[nH]c21 ZINC000502690548 1036485987 /nfs/dbraw/zinc/48/59/87/1036485987.db2.gz VCMZQHYAALZGDH-LJQANCHMSA-N 2 0 339.527 4.394 20 0 EIADRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000502696675 1036508243 /nfs/dbraw/zinc/50/82/43/1036508243.db2.gz LIEJEAAXIPKRNQ-FCHUYYIVSA-N 2 0 344.543 4.357 20 0 EIADRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000502696049 1036513628 /nfs/dbraw/zinc/51/36/28/1036513628.db2.gz BMJSLHZGLUHBPA-YUXAGFNASA-N 2 0 344.543 4.213 20 0 EIADRP COCC[C@H]1CCC[C@H]1[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000502696881 1036514982 /nfs/dbraw/zinc/51/49/82/1036514982.db2.gz MFQOATVOKHOPOL-FGZHOGPDSA-N 2 0 344.543 4.357 20 0 EIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+][C@@H]2CCC23CCC3)CC1 ZINC000502722506 1036559118 /nfs/dbraw/zinc/55/91/18/1036559118.db2.gz KLQBCSGZAJVHIM-LJQANCHMSA-N 2 0 332.919 4.474 20 0 EIADRP COCC[C@H]1CCC[C@H]1[NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000502708754 1036564574 /nfs/dbraw/zinc/56/45/74/1036564574.db2.gz LJXCKWWHDNEXGD-FGZHOGPDSA-N 2 0 344.543 4.213 20 0 EIADRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000502725581 1036582402 /nfs/dbraw/zinc/58/24/02/1036582402.db2.gz XUVKLZSTDGHCGE-CNNODRBYSA-N 2 0 344.543 4.213 20 0 EIADRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC000502723871 1036587613 /nfs/dbraw/zinc/58/76/13/1036587613.db2.gz RZINJQFLCBFOSQ-XQBPLPMBSA-N 2 0 344.543 4.356 20 0 EIADRP Fc1ccc(CC2CC[NH+](C3CC[NH+](CC4CC4)CC3)CC2)c(F)c1 ZINC001168389156 1036736697 /nfs/dbraw/zinc/73/66/97/1036736697.db2.gz KOBHHNCKOMDBAQ-UHFFFAOYSA-N 2 0 348.481 4.094 20 0 EIADRP Fc1ccc2cc(C[NH2+]Cc3cccc(C[NH+]4CCCC4)c3)[nH]c2c1 ZINC000486681617 1036815717 /nfs/dbraw/zinc/81/57/17/1036815717.db2.gz OGOGWUSZNFFHNJ-UHFFFAOYSA-N 2 0 337.442 4.193 20 0 EIADRP COc1cccc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c1F ZINC000192662954 1036869930 /nfs/dbraw/zinc/86/99/30/1036869930.db2.gz REFCUQKSGBLAOF-UHFFFAOYSA-N 2 0 342.458 4.110 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2c(F)cccc2Cl)C1 ZINC000589837218 1036880756 /nfs/dbraw/zinc/88/07/56/1036880756.db2.gz LPDHIDUHXQWPSJ-HUUCEWRRSA-N 2 0 326.887 4.327 20 0 EIADRP c1ccc(CC[C@H]2CCC[N@@H+](C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC001168395181 1036881721 /nfs/dbraw/zinc/88/17/21/1036881721.db2.gz PGHKRSPUAWGNJU-HXUWFJFHSA-N 2 0 326.528 4.206 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+]C[C@H]3C[C@@H]3c3ccccc3)CC2)c1 ZINC000503035708 1036882628 /nfs/dbraw/zinc/88/26/28/1036882628.db2.gz PDNHCJVNFVQKCZ-TZIWHRDSSA-N 2 0 340.536 4.353 20 0 EIADRP CCOc1ccc(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cc1F ZINC000486962090 1036921439 /nfs/dbraw/zinc/92/14/39/1036921439.db2.gz CMUMPEBXECDNMS-UHFFFAOYSA-N 2 0 344.474 4.354 20 0 EIADRP CC(C)n1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cn1 ZINC000272298752 1037152867 /nfs/dbraw/zinc/15/28/67/1037152867.db2.gz GNLATBODLQRPQL-CMKODMSKSA-N 2 0 340.515 4.025 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CNC(=[NH2+])Nc2ccccc2)C1 ZINC000057887186 1037288308 /nfs/dbraw/zinc/28/83/08/1037288308.db2.gz UJXKHDAUKSJDSQ-QGZVFWFLSA-N 2 0 336.483 4.055 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccnc(Cl)c2)CC1 ZINC000171384277 1037365735 /nfs/dbraw/zinc/36/57/35/1037365735.db2.gz JINLNWGAZOTIIC-UHFFFAOYSA-N 2 0 343.902 4.079 20 0 EIADRP CC(C)[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)CS1 ZINC000488412614 1037580874 /nfs/dbraw/zinc/58/08/74/1037580874.db2.gz OZIFVYLVFCZPIW-AEFFLSMTSA-N 2 0 338.586 4.080 20 0 EIADRP CC(C)(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)CS1 ZINC000488434579 1037591804 /nfs/dbraw/zinc/59/18/04/1037591804.db2.gz JEAZSXIEQXQFOE-UFYCRDLUSA-N 2 0 346.584 4.061 20 0 EIADRP Fc1ccc2c(c1)CC[C@H]([NH2+]C1CC[NH+](C[C@H]3CC=CCC3)CC1)C2 ZINC001168420166 1037718791 /nfs/dbraw/zinc/71/87/91/1037718791.db2.gz JTBWVIILSAUBRS-JTSKRJEESA-N 2 0 342.502 4.093 20 0 EIADRP [NH3+][C@H]1C[C@@H](NCc2ccccc2C[NH+]2CCCCCC2)c2ccccc21 ZINC000422711487 1037804381 /nfs/dbraw/zinc/80/43/81/1037804381.db2.gz NESNNARUBIRPFE-XZOQPEGZSA-N 2 0 349.522 4.297 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c(C)c1 ZINC000422713322 1037811731 /nfs/dbraw/zinc/81/17/31/1037811731.db2.gz PNLPDRHYECLCMQ-RBDMOPTHSA-N 2 0 336.479 4.210 20 0 EIADRP C[C@H](C[C@H]1CCCCC[NH2+]1)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000422740254 1037821623 /nfs/dbraw/zinc/82/16/23/1037821623.db2.gz BJZHZMNFODVQQN-XQBPLPMBSA-N 2 0 343.559 4.112 20 0 EIADRP Cc1cccc([C@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1C ZINC000422747214 1037823351 /nfs/dbraw/zinc/82/33/51/1037823351.db2.gz PMTVXJZNPUUBNG-UCNVEGJOSA-N 2 0 336.479 4.210 20 0 EIADRP CCCOc1ccc([C@@H](C)[NH2+][C@H]2CCC[NH2+]CC2)cc1OCCC ZINC000422766494 1037827670 /nfs/dbraw/zinc/82/76/70/1037827670.db2.gz QDXPOICHKFEDPS-AEFFLSMTSA-N 2 0 334.504 4.057 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000422774242 1037829853 /nfs/dbraw/zinc/82/98/53/1037829853.db2.gz WFGGEMQKJCLCFW-RDTXWAMCSA-N 2 0 334.410 4.094 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCCc1ccc(C(C)C)cc1 ZINC000422771327 1037831383 /nfs/dbraw/zinc/83/13/83/1037831383.db2.gz XYRKCYQSUAMGAZ-INIZCTEOSA-N 2 0 325.500 4.256 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@H+](C)C[C@H]1CC[NH2+][C@H](C)C1 ZINC000414690884 1037832108 /nfs/dbraw/zinc/83/21/08/1037832108.db2.gz AXIFKXRPEDTUOG-PVAVHDDUSA-N 2 0 343.540 4.499 20 0 EIADRP COC[C@H](CCC[NH3+])[NH2+][C@H](c1cccs1)c1ccc(C(C)C)cc1 ZINC000422785206 1037832868 /nfs/dbraw/zinc/83/28/68/1037832868.db2.gz MWOZTSTVDIHXGJ-ICSRJNTNSA-N 2 0 346.540 4.304 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H]3CC[NH2+]CC[C@@H]3C)cc2)cs1 ZINC000422800630 1037835901 /nfs/dbraw/zinc/83/59/01/1037835901.db2.gz CLWURUFELMMDFY-SUNYJGFJSA-N 2 0 329.513 4.157 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCc1cccc(-c2ccccc2)c1 ZINC000422882149 1037852207 /nfs/dbraw/zinc/85/22/07/1037852207.db2.gz AIEACCXUAHPHTI-KRWDZBQOSA-N 2 0 345.490 4.409 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422884761 1037854748 /nfs/dbraw/zinc/85/47/48/1037854748.db2.gz FPUPXQDLMHQYHL-BXEVVDMOSA-N 2 0 341.524 4.361 20 0 EIADRP CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422873364 1037861634 /nfs/dbraw/zinc/86/16/34/1037861634.db2.gz LDRJDSACROUMPI-HOTGVXAUSA-N 2 0 341.499 4.185 20 0 EIADRP CC(C)Oc1ccc(C[NH2+][C@H](C)CCCC[NH3+])c(C(F)(F)F)c1 ZINC000422902772 1037863123 /nfs/dbraw/zinc/86/31/23/1037863123.db2.gz NMCPUSJGPQGTDA-CYBMUJFWSA-N 2 0 332.410 4.100 20 0 EIADRP COC[C@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1ccc2ccccc2c1 ZINC000422906305 1037863961 /nfs/dbraw/zinc/86/39/61/1037863961.db2.gz JNSOPAOGYZHLPB-XZOQPEGZSA-N 2 0 348.490 4.273 20 0 EIADRP c1ccc([C@@H]2OCCC[C@@H]2C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000422908795 1037864006 /nfs/dbraw/zinc/86/40/06/1037864006.db2.gz ZIADPJLVGMZWPH-CTWRKMMKSA-N 2 0 342.527 4.055 20 0 EIADRP c1sc(CC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)nc1C1CCCCC1 ZINC000422914468 1037868301 /nfs/dbraw/zinc/86/83/01/1037868301.db2.gz UHXUVEMTMONYPW-KZNAEPCWSA-N 2 0 347.572 4.244 20 0 EIADRP COc1cc([C@H](C)[NH2+]C2CCC([NH3+])CC2)ccc1OCCC(C)C ZINC000422942945 1037877860 /nfs/dbraw/zinc/87/78/60/1037877860.db2.gz KZKKLVWRFGMWPE-ZLPCBKJTSA-N 2 0 334.504 4.041 20 0 EIADRP c1ccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422965834 1037880379 /nfs/dbraw/zinc/88/03/79/1037880379.db2.gz MBUKKSSYJFDNPG-NQAVQENRSA-N 2 0 348.490 4.168 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1ccc(Br)cc1 ZINC000422943514 1037883276 /nfs/dbraw/zinc/88/32/76/1037883276.db2.gz KOJJMGYTDFNCMK-KSSFIOAISA-N 2 0 347.300 4.256 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1c(C)c(C)c(C)c(C)c1C ZINC000422993811 1037890951 /nfs/dbraw/zinc/89/09/51/1037890951.db2.gz GIIMKFLOJCHRTA-KRWDZBQOSA-N 2 0 325.500 4.242 20 0 EIADRP Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422974245 1037892797 /nfs/dbraw/zinc/89/27/97/1037892797.db2.gz QQCCNPFJCGUWQA-KDOFPFPSSA-N 2 0 327.472 4.114 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)C[N@@H+]1Cc1ccccc1 ZINC000423007046 1037899303 /nfs/dbraw/zinc/89/93/03/1037899303.db2.gz XCIZUZMXZAGSDI-ANEJOOLBSA-N 3 0 349.522 4.022 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000423027918 1037911841 /nfs/dbraw/zinc/91/18/41/1037911841.db2.gz RWASDEKHCUODHC-HNAYVOBHSA-N 2 0 331.891 4.126 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000423045182 1037925662 /nfs/dbraw/zinc/92/56/62/1037925662.db2.gz CLHNNTKZMYAKJK-CJNGLKHVSA-N 2 0 347.503 4.434 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]C1CC(c2cc(F)cc(F)c2)C1 ZINC000574199214 1037947604 /nfs/dbraw/zinc/94/76/04/1037947604.db2.gz ROVNTTFYHIBVOQ-FVWXCPNNSA-N 2 0 336.470 4.455 20 0 EIADRP [NH3+]CC1CCC([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC1 ZINC000423094747 1037952798 /nfs/dbraw/zinc/95/27/98/1037952798.db2.gz KRVVELHGMBDMQK-ZDKDBBBSSA-N 2 0 326.406 4.059 20 0 EIADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000423096953 1037955159 /nfs/dbraw/zinc/95/51/59/1037955159.db2.gz QDQQPIQVEYPUSB-MUIFIZLQSA-N 2 0 326.406 4.059 20 0 EIADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@H]1CC[C@H](c2ccccc2F)C1 ZINC000423097625 1037956327 /nfs/dbraw/zinc/95/63/27/1037956327.db2.gz QXHVHTRDELUGMF-DBSRCYSRSA-N 2 0 326.459 4.010 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C1CC(F)(c2cccc(Cl)c2)C1 ZINC000423097015 1037958299 /nfs/dbraw/zinc/95/82/99/1037958299.db2.gz QJNHEDXUPGNJPC-UYCDIGJJSA-N 2 0 347.865 4.180 20 0 EIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+][C@H](C)CCCC[NH3+])cc1 ZINC000423120408 1037967806 /nfs/dbraw/zinc/96/78/06/1037967806.db2.gz GKVYNDPLAPSDEA-DYESRHJHSA-N 2 0 326.484 4.086 20 0 EIADRP c1ccc([C@H](C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C2CC2)cc1 ZINC000423121286 1037968779 /nfs/dbraw/zinc/96/87/79/1037968779.db2.gz APESPKYRCWDBOE-QNWVGRARSA-N 2 0 348.490 4.026 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@@H](C)Oc1ccc(C(C)C)cc1 ZINC000423105888 1037979777 /nfs/dbraw/zinc/97/97/77/1037979777.db2.gz JCNPTQBCQNICDJ-CVEARBPZSA-N 2 0 341.499 4.090 20 0 EIADRP COc1ccc(-c2ccccc2)cc1C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000503921098 1038001575 /nfs/dbraw/zinc/00/15/75/1038001575.db2.gz PCWVSCDJUCIOIA-UHFFFAOYSA-N 2 0 338.495 4.184 20 0 EIADRP C[C@H]([NH2+]CC1CCC(F)(F)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000503906431 1038005693 /nfs/dbraw/zinc/00/56/93/1038005693.db2.gz ZKOOACSSMHPGAJ-QFBILLFUSA-N 2 0 336.470 4.312 20 0 EIADRP C[C@@]1(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C[C@H]1c1ccccc1 ZINC000423140661 1038014399 /nfs/dbraw/zinc/01/43/99/1038014399.db2.gz ZAXCJVBHTYSIHL-SQOUVECCSA-N 2 0 348.490 4.026 20 0 EIADRP CSC[C@H]([NH2+][C@H](C)[C@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1 ZINC000423218961 1038061628 /nfs/dbraw/zinc/06/16/28/1038061628.db2.gz SQQSSTMXXXVKOX-INWMFGNUSA-N 2 0 346.462 4.087 20 0 EIADRP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[NH2+]C1)c1ccc(OC(F)(F)F)cc1 ZINC000423217806 1038062990 /nfs/dbraw/zinc/06/29/90/1038062990.db2.gz QMHYFKGHOJJRQT-INWMFGNUSA-N 2 0 330.394 4.014 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423221163 1038065484 /nfs/dbraw/zinc/06/54/84/1038065484.db2.gz WLPIYVQSFSRHBD-RLFYNMQTSA-N 2 0 343.540 4.081 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000423231089 1038070235 /nfs/dbraw/zinc/07/02/35/1038070235.db2.gz KRZHYXAKEWUKSU-ACBHZAAOSA-N 2 0 332.850 4.428 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423263422 1038073142 /nfs/dbraw/zinc/07/31/42/1038073142.db2.gz XFLRDWJTDSTGOA-HOCLYGCPSA-N 2 0 329.513 4.159 20 0 EIADRP Clc1ccccc1C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccsc1 ZINC000423243882 1038078266 /nfs/dbraw/zinc/07/82/66/1038078266.db2.gz GSOKLPGHRYLRNH-KSSFIOAISA-N 2 0 334.916 4.275 20 0 EIADRP CSC[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1 ZINC000423256464 1038086132 /nfs/dbraw/zinc/08/61/32/1038086132.db2.gz FFNYWDAPQLLFTI-CZUORRHYSA-N 2 0 346.462 4.089 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCC4)cc1 ZINC000423293338 1038097650 /nfs/dbraw/zinc/09/76/50/1038097650.db2.gz QZURVEFUAMXDHG-QVKFZJNVSA-N 2 0 336.479 4.199 20 0 EIADRP NC[C@H]([NH2+]C1CCC(c2cccc(C(F)(F)F)c2)CC1)C1CC1 ZINC000423276218 1038099041 /nfs/dbraw/zinc/09/90/41/1038099041.db2.gz MTEBAUYJQCVNCC-SEFLRBGSSA-N 2 0 326.406 4.059 20 0 EIADRP [NH3+][C@H](C[NH2+][C@@H]1CCCC[C@H]1c1ccc(C(F)(F)F)cc1)C1CC1 ZINC000423315524 1038112293 /nfs/dbraw/zinc/11/22/93/1038112293.db2.gz IWPRQOJDMRVMFA-GVDBMIGSSA-N 2 0 326.406 4.059 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423321514 1038119597 /nfs/dbraw/zinc/11/95/97/1038119597.db2.gz GHHUJMJUCWJRSB-AUUYWEPGSA-N 2 0 329.513 4.159 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1OC ZINC000423296233 1038122780 /nfs/dbraw/zinc/12/27/80/1038122780.db2.gz YPWQTYXVPALZEG-OAGGEKHMSA-N 2 0 342.483 4.005 20 0 EIADRP CS[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000593717199 1038136502 /nfs/dbraw/zinc/13/65/02/1038136502.db2.gz ZEHWZGGUOMCWNJ-FDKIHUSFSA-N 2 0 344.568 4.446 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423330354 1038140555 /nfs/dbraw/zinc/14/05/55/1038140555.db2.gz NPOILIUALLIMHE-YWZLYKJASA-N 2 0 343.540 4.467 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423337257 1038146957 /nfs/dbraw/zinc/14/69/57/1038146957.db2.gz UBIRZYYLTVSTJD-CQSZACIVSA-N 2 0 329.513 4.159 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423366808 1038181876 /nfs/dbraw/zinc/18/18/76/1038181876.db2.gz QMPBLYIDGFZABJ-MLGOLLRUSA-N 2 0 333.476 4.050 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423376907 1038188527 /nfs/dbraw/zinc/18/85/27/1038188527.db2.gz JGUMTQBSGXNWBE-CYBMUJFWSA-N 2 0 334.385 4.029 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(Br)c(F)c1 ZINC000423386069 1038196847 /nfs/dbraw/zinc/19/68/47/1038196847.db2.gz LXAYHOYJGJFISL-LLVKDONJSA-N 2 0 349.247 4.042 20 0 EIADRP COCC1(C[NH2+][C@H](C)c2ccc(-c3cccs3)cc2)CC[NH2+]CC1 ZINC000423375386 1038206550 /nfs/dbraw/zinc/20/65/50/1038206550.db2.gz AASGPMHOFMZEFK-MRXNPFEDSA-N 2 0 344.524 4.082 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000423402125 1038215800 /nfs/dbraw/zinc/21/58/00/1038215800.db2.gz WFYHXLDGNIMRJI-ZHALLVOQSA-N 2 0 346.421 4.237 20 0 EIADRP Clc1cc2c(c(Cl)c1)CC[C@@H]2[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423407280 1038219585 /nfs/dbraw/zinc/21/95/85/1038219585.db2.gz ZPRZZTYPCLXGCV-SFHVURJKSA-N 2 0 333.262 4.374 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000423446799 1038226350 /nfs/dbraw/zinc/22/63/50/1038226350.db2.gz ZCJNAFYAASLWCP-BBRMVZONSA-N 2 0 347.503 4.434 20 0 EIADRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c1 ZINC000423426978 1038231190 /nfs/dbraw/zinc/23/11/90/1038231190.db2.gz QAJMTQGIMPHRNF-KKUMJFAQSA-N 2 0 326.431 4.012 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000423431534 1038233150 /nfs/dbraw/zinc/23/31/50/1038233150.db2.gz LSKFUSPDEHOMGQ-HNAYVOBHSA-N 2 0 331.891 4.126 20 0 EIADRP CC[C@H]([NH2+][C@H](C)CCC[NH3+])c1ccc(Br)cc1Cl ZINC000423456863 1038238376 /nfs/dbraw/zinc/23/83/76/1038238376.db2.gz OHYYSHOECMKUNP-YGRLFVJLSA-N 2 0 333.701 4.271 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+]C1CCC(c2cccc(C(F)(F)F)c2)CC1 ZINC000423457385 1038240653 /nfs/dbraw/zinc/24/06/53/1038240653.db2.gz OXNNDAWILSRBHV-TUBUQKNSSA-N 2 0 328.422 4.449 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1ccc(SCC(F)F)cc1 ZINC000423460341 1038240828 /nfs/dbraw/zinc/24/08/28/1038240828.db2.gz ASMONBFCGCOFHJ-YDHLFZDLSA-N 2 0 328.472 4.212 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000423463915 1038242983 /nfs/dbraw/zinc/24/29/83/1038242983.db2.gz GAGATCUMBBFVHE-UNEWFSDZSA-N 2 0 328.422 4.134 20 0 EIADRP CCOc1ccc([C@H](CC)[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)cc1OCC ZINC000423464849 1038243177 /nfs/dbraw/zinc/24/31/77/1038243177.db2.gz RGGOQUNVPYKWGB-SZMVWBNQSA-N 2 0 334.504 4.042 20 0 EIADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(SCC(F)F)cc1 ZINC000423476711 1038246930 /nfs/dbraw/zinc/24/69/30/1038246930.db2.gz JIYOVKAAPSTNOT-ZFWWWQNUSA-N 2 0 328.472 4.227 20 0 EIADRP Cc1cc([C@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)c(C)o1 ZINC000423472291 1038247612 /nfs/dbraw/zinc/24/76/12/1038247612.db2.gz NDKNZJRFSCOKAB-UCLAIMLFSA-N 2 0 330.447 4.079 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)C1 ZINC000423499685 1038254461 /nfs/dbraw/zinc/25/44/61/1038254461.db2.gz ICMMAGCJAGHOHU-ISWURRPUSA-N 2 0 326.406 4.059 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423505350 1038256844 /nfs/dbraw/zinc/25/68/44/1038256844.db2.gz HLXCVGTWRHHQHU-DHWLSRIRSA-N 2 0 338.495 4.257 20 0 EIADRP COc1ccc([C@@H]([NH2+]CCC[C@H]2CCC[NH2+]2)c2ccc(F)cc2)cc1 ZINC000423487923 1038260553 /nfs/dbraw/zinc/26/05/53/1038260553.db2.gz UUZUYZZFOOALKS-CTNGQTDRSA-N 2 0 342.458 4.046 20 0 EIADRP FC(F)(F)c1cccc([C@@H]([NH2+]CCC[C@H]2CCC[NH2+]2)C2CC2)c1 ZINC000423487687 1038261281 /nfs/dbraw/zinc/26/12/81/1038261281.db2.gz UOCNFQPJYNJUNY-SJORKVTESA-N 2 0 326.406 4.278 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000423493043 1038263722 /nfs/dbraw/zinc/26/37/22/1038263722.db2.gz PJBPNTHSRSODBD-NORZTCDRSA-N 2 0 333.476 4.036 20 0 EIADRP Cc1c([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cnn1C(C)(C)C ZINC000423521105 1038273189 /nfs/dbraw/zinc/27/31/89/1038273189.db2.gz SDWFVKKERHJLCC-DNVCBOLYSA-N 2 0 328.504 4.077 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423562610 1038283253 /nfs/dbraw/zinc/28/32/53/1038283253.db2.gz WRNNWJRCVNMWLF-GFOCRRMGSA-N 2 0 340.433 4.004 20 0 EIADRP c1coc([C@H]2CC[NH+](CCCCC[N@@H+]3CC[C@H](c4ccco4)C3)C2)c1 ZINC000607152483 1038395393 /nfs/dbraw/zinc/39/53/93/1038395393.db2.gz YNOXRAYMXQLHBM-OALUTQOASA-N 2 0 342.483 4.322 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H]2CCCc3ccc(C)cc32)[C@@H](C)C1 ZINC000490269971 1038418638 /nfs/dbraw/zinc/41/86/38/1038418638.db2.gz FJHMJMMQTCHPLV-NYVOZVTQSA-N 2 0 344.543 4.099 20 0 EIADRP Cc1ccc(COc2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@H](C)C3)cc2)cc1 ZINC000608061371 1038444444 /nfs/dbraw/zinc/44/44/44/1038444444.db2.gz RGXOILJNFWAARJ-WIYYLYMNSA-N 2 0 338.495 4.146 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@@H](Cc1ccncc1)c1cccs1 ZINC000424266220 1038764738 /nfs/dbraw/zinc/76/47/38/1038764738.db2.gz WPYQMWFMOSTQSA-MJGOQNOKSA-N 2 0 343.540 4.281 20 0 EIADRP C[C@@H]1CC2(C[N@@H+]1Cc1csc(C3CCCCC3)n1)CC[NH2+]CC2 ZINC000424290589 1038769790 /nfs/dbraw/zinc/76/97/90/1038769790.db2.gz MXFDIYBCDUUIPA-OAHLLOKOSA-N 2 0 333.545 4.155 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@H](Cc2ccncc2)c2cccs2)CC1 ZINC000424274181 1038782568 /nfs/dbraw/zinc/78/25/68/1038782568.db2.gz YHKAWVXTIVDURS-LJQANCHMSA-N 2 0 343.540 4.137 20 0 EIADRP Cc1ccc(C[C@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C2CC2)cc1 ZINC000539038010 1038791179 /nfs/dbraw/zinc/79/11/79/1038791179.db2.gz WBHJCBHHUUUKGR-QHCPKHFHSA-N 2 0 349.522 4.217 20 0 EIADRP CC[N@H+](CCC1CCN(Cc2ccn(C(C)C)n2)CC1)CC(C)C ZINC000539100130 1038838883 /nfs/dbraw/zinc/83/88/83/1038838883.db2.gz QSPKRLOKQQJERY-UHFFFAOYSA-N 2 0 334.552 4.044 20 0 EIADRP C[C@H](c1ccc(C(C)(C)C)cc1)[N@H+](C)CCN(C)C1CC[NH+](C)CC1 ZINC000539219803 1038889452 /nfs/dbraw/zinc/88/94/52/1038889452.db2.gz RPLQFWCNJZHTPT-GOSISDBHSA-N 2 0 345.575 4.003 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](CC)c2cccc(Br)c2)C1 ZINC000481024774 1038965687 /nfs/dbraw/zinc/96/56/87/1038965687.db2.gz NJPQJONRZQKKHC-PBHICJAKSA-N 2 0 339.321 4.222 20 0 EIADRP Cc1cccc(OC[C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000481029256 1038974238 /nfs/dbraw/zinc/97/42/38/1038974238.db2.gz ZRHMMEMZDBTHSE-GOSISDBHSA-N 2 0 330.516 4.149 20 0 EIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CCC[NH2+]CC2)CCC3)cc1 ZINC000643522395 1039037019 /nfs/dbraw/zinc/03/70/19/1039037019.db2.gz MLKXBJDLBMRLCJ-HZPDHXFCSA-N 2 0 345.487 4.058 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000643522480 1039039070 /nfs/dbraw/zinc/03/90/70/1039039070.db2.gz NVHQLZXFIJFOIH-JSGCOSHPSA-N 2 0 332.435 4.134 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(F)c(C(F)(F)F)c2)cc1 ZINC000414810484 1039054799 /nfs/dbraw/zinc/05/47/99/1039054799.db2.gz OGDHSMLUOPCZDN-LLVKDONJSA-N 2 0 326.337 4.154 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCCCC[NH+]2CCCCC2)c(C)c1OC ZINC000552047535 1039070709 /nfs/dbraw/zinc/07/07/09/1039070709.db2.gz PSTXOAYUIGNVIM-GOSISDBHSA-N 2 0 348.531 4.319 20 0 EIADRP CC(C)c1nn(-c2ccccc2)cc1C[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414816084 1039099879 /nfs/dbraw/zinc/09/98/79/1039099879.db2.gz ZFVJLWDJXSDTOV-QGZVFWFLSA-N 2 0 348.494 4.305 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1ccc2c(c1)OCO2 ZINC000120448046 1039114118 /nfs/dbraw/zinc/11/41/18/1039114118.db2.gz SKYIQRDBUVPWBA-INIZCTEOSA-N 2 0 340.467 4.108 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1cc2c(s1)CCC2 ZINC000120917482 1039235724 /nfs/dbraw/zinc/23/57/24/1039235724.db2.gz GZYYRUVWGXIILV-ZDUSSCGKSA-N 2 0 332.488 4.288 20 0 EIADRP CC(C)n1cc([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cn1 ZINC000090775441 1039296999 /nfs/dbraw/zinc/29/69/99/1039296999.db2.gz DAAFHAAPIUESIF-KKXNLOMOSA-N 2 0 332.536 4.158 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1COc2ccccc21)c1ccc(-n2ccnc2)cc1 ZINC000090845070 1039306946 /nfs/dbraw/zinc/30/69/46/1039306946.db2.gz KAPKFWBBRXXMSH-FTRWYGJKSA-N 2 0 333.435 4.088 20 0 EIADRP COc1ccc(F)c(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c1 ZINC000555509985 1039318719 /nfs/dbraw/zinc/31/87/19/1039318719.db2.gz CKZOXTKOFYUOPD-UHFFFAOYSA-N 2 0 342.458 4.110 20 0 EIADRP Fc1cccc2c1CC[C@@H]2[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000513859350 1039338865 /nfs/dbraw/zinc/33/88/65/1039338865.db2.gz KUEJWUOPDPBUQZ-FQEVSTJZSA-N 2 0 344.499 4.376 20 0 EIADRP Cc1ccnc([C@H](C)[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000552277142 1039350382 /nfs/dbraw/zinc/35/03/82/1039350382.db2.gz PJUCXQMDZIZKDG-ZJOUEHCJSA-N 2 0 337.511 4.341 20 0 EIADRP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1CC[C@@]2(C1)CCC[NH+](C)C2 ZINC000555598407 1039422799 /nfs/dbraw/zinc/42/27/99/1039422799.db2.gz ZACGXEKXCIHKNQ-PBHICJAKSA-N 2 0 342.405 4.064 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000514086667 1039589223 /nfs/dbraw/zinc/58/92/23/1039589223.db2.gz CASBSTXSMUXOGX-GRTSSRMGSA-N 2 0 330.394 4.109 20 0 EIADRP CCOCCCC[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000514103471 1039611438 /nfs/dbraw/zinc/61/14/38/1039611438.db2.gz CIONWXYZOWWFHF-BHIFYINESA-N 2 0 344.543 4.084 20 0 EIADRP CO[C@@H](C[NH+]1CCC(CCC[NH+](C)C)CC1)c1ccc(Cl)cc1 ZINC000514130154 1039641739 /nfs/dbraw/zinc/64/17/39/1039641739.db2.gz HENPEHLGZOMSEN-IBGZPJMESA-N 2 0 338.923 4.081 20 0 EIADRP CCc1ccc([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)s1 ZINC000122403967 1039704822 /nfs/dbraw/zinc/70/48/22/1039704822.db2.gz YUJMMDVGSLRQSQ-HNNXBMFYSA-N 2 0 332.513 4.102 20 0 EIADRP c1cc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc(-c2ccncc2)c1 ZINC000093563941 1039715099 /nfs/dbraw/zinc/71/50/99/1039715099.db2.gz ALWGTUVAHBOEPX-QFIPXVFZSA-N 2 0 335.495 4.199 20 0 EIADRP Clc1sc(Cl)c2c1CCC[C@@H]2[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000643536948 1039747468 /nfs/dbraw/zinc/74/74/68/1039747468.db2.gz XLZAWOZYFUOROT-QWRGUYRKSA-N 2 0 331.312 4.164 20 0 EIADRP C[C@@H]1C[C@H](Nc2cc[nH+]c3cc(OC(F)(F)F)ccc23)CC[N@@H+]1C ZINC000899874949 1039754674 /nfs/dbraw/zinc/75/46/74/1039754674.db2.gz QKHDSSPNTCLBMC-VXGBXAGGSA-N 2 0 339.361 4.028 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC000122785995 1039790102 /nfs/dbraw/zinc/79/01/02/1039790102.db2.gz JQWKXCYECGYVQC-CQSZACIVSA-N 2 0 326.431 4.061 20 0 EIADRP COc1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c2ccccc12 ZINC000537646995 1039802151 /nfs/dbraw/zinc/80/21/51/1039802151.db2.gz GJHORJCAEXESPP-SFHVURJKSA-N 2 0 338.495 4.156 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccccc2N(C)C)cc1 ZINC000537651888 1039847847 /nfs/dbraw/zinc/84/78/47/1039847847.db2.gz NLZBGUXNTMHVGN-SFHVURJKSA-N 2 0 339.527 4.445 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cc(F)cc(F)c1 ZINC000123038530 1039855416 /nfs/dbraw/zinc/85/54/16/1039855416.db2.gz ZJKJYMWHPYYKPI-OAHLLOKOSA-N 2 0 330.422 4.411 20 0 EIADRP C[C@H](COc1cccc(F)c1)[NH2+][C@H]1CCN(C)[C@@H](c2ccccc2)C1 ZINC000551008625 1039860509 /nfs/dbraw/zinc/86/05/09/1039860509.db2.gz YLIHBXHXVGQXAU-LKUPVBHCSA-N 2 0 342.458 4.018 20 0 EIADRP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666954196 1039861521 /nfs/dbraw/zinc/86/15/21/1039861521.db2.gz RXQGTVLRLYFYAN-GDBMZVCRSA-N 2 0 327.299 4.046 20 0 EIADRP Cc1cccc(C)c1OCC[NH2+][C@H]1CCN(C)[C@@H](c2ccccc2)C1 ZINC000551013211 1039876846 /nfs/dbraw/zinc/87/68/46/1039876846.db2.gz GVXIAUWJKFJCRC-LEWJYISDSA-N 2 0 338.495 4.107 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000481955124 1039911629 /nfs/dbraw/zinc/91/16/29/1039911629.db2.gz SULWTDFXNQHYQV-CZUORRHYSA-N 2 0 347.503 4.256 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1 ZINC000481957763 1039912518 /nfs/dbraw/zinc/91/25/18/1039912518.db2.gz MVWZNIIRFYYGQJ-MSOLQXFVSA-N 2 0 326.484 4.256 20 0 EIADRP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000481992055 1039937318 /nfs/dbraw/zinc/93/73/18/1039937318.db2.gz NCXGELLZVLPKMP-OOHWJJMZSA-N 2 0 340.433 4.243 20 0 EIADRP CSc1ccc(CC[NH2+][C@@H]2CCN(C)[C@H](c3ccccc3)C2)cc1 ZINC000551174773 1040018331 /nfs/dbraw/zinc/01/83/31/1040018331.db2.gz DAIKOORIQDXPQY-CTNGQTDRSA-N 2 0 340.536 4.376 20 0 EIADRP COC1CCC(C)(C[NH2+][C@@H]2CCN(C)[C@H](c3ccccc3)C2)CC1 ZINC000551175565 1040019644 /nfs/dbraw/zinc/01/96/44/1040019644.db2.gz MTYKFPLPLPEVBW-OSIBBQKWSA-N 2 0 330.516 4.007 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](CC)c2ccc(OC(F)F)cc2)CC1 ZINC000482516609 1040310774 /nfs/dbraw/zinc/31/07/74/1040310774.db2.gz BDQVRXQJLHSYTM-SFHVURJKSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@H](C[N@@H+]1CCC[C@H]2C[NH+](C)CC[C@@H]21)c1ccc(C(F)(F)F)cc1 ZINC000514890640 1040327337 /nfs/dbraw/zinc/32/73/37/1040327337.db2.gz KVYNOJCNKJXPKN-HFTRVMKXSA-N 2 0 340.433 4.225 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+]CC2CC[NH+](C)CC2)c(OCCC)c1 ZINC000482545274 1040345271 /nfs/dbraw/zinc/34/52/71/1040345271.db2.gz XBFKZGLOEJRNAG-KRWDZBQOSA-N 2 0 348.531 4.257 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995348 1040405327 /nfs/dbraw/zinc/40/53/27/1040405327.db2.gz KPBCCIVWCZSQBF-RHSMWYFYSA-N 2 0 340.433 4.291 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2cnc(C(C)(C)C)nc2)CC1 ZINC000551561379 1040414046 /nfs/dbraw/zinc/41/40/46/1040414046.db2.gz ZPGGNGPCPIWHBQ-UHFFFAOYSA-N 2 0 346.563 4.108 20 0 EIADRP Fc1ccc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1-c1cccs1 ZINC000666998478 1040420330 /nfs/dbraw/zinc/42/03/30/1040420330.db2.gz WGKQASZHXFDKCD-OAHLLOKOSA-N 2 0 330.472 4.319 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH2+]Cc2ccccc2Cn2ccnc2)cc1 ZINC000515149796 1040508907 /nfs/dbraw/zinc/50/89/07/1040508907.db2.gz KLPPMLVGLNADJX-IBGZPJMESA-N 2 0 333.479 4.351 20 0 EIADRP C[N@H+](CC1CC1)C[C@H]1CC[NH+](CC(c2ccccc2)c2ccccc2)C1 ZINC000508857201 1040652962 /nfs/dbraw/zinc/65/29/62/1040652962.db2.gz CSQKTYYSKXYIST-OAQYLSRUSA-N 2 0 348.534 4.482 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CC(C)(C)c3ccccc32)ccc1F ZINC000483147263 1040735010 /nfs/dbraw/zinc/73/50/10/1040735010.db2.gz RYSKCMWGGQAZTL-FQEVSTJZSA-N 2 0 326.459 4.400 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)c1cccs1)c1ccc(OCC[NH+](C)C)cc1 ZINC000483151984 1040738428 /nfs/dbraw/zinc/73/84/28/1040738428.db2.gz QZLJFPUPHFCFKU-MRXNPFEDSA-N 2 0 346.540 4.317 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)C[NH+](C)C)c1ccc(SCC(F)F)cc1 ZINC000479877890 1040738782 /nfs/dbraw/zinc/73/87/82/1040738782.db2.gz ZUUOCJIIGVTUQS-CYBMUJFWSA-N 2 0 330.488 4.282 20 0 EIADRP C[C@@H]([NH2+]CCOC1CCCCCC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000483189798 1040766516 /nfs/dbraw/zinc/76/65/16/1040766516.db2.gz CNKPXQVKAXTIOW-GOSISDBHSA-N 2 0 348.531 4.017 20 0 EIADRP CCC[C@@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000483258620 1040795846 /nfs/dbraw/zinc/79/58/46/1040795846.db2.gz NJGSIKZABLLINO-YLJYHZDGSA-N 2 0 345.531 4.166 20 0 EIADRP Cc1ncsc1CN(C[C@H]1CC[NH2+]C1)[C@@H](C)c1cccc(Cl)c1 ZINC000436045940 1040837249 /nfs/dbraw/zinc/83/72/49/1040837249.db2.gz AAZMLIUXAPEVHS-GJZGRUSLSA-N 2 0 349.931 4.278 20 0 EIADRP Cc1ncsc1CN(Cc1ccc(C(C)C)cc1)C[C@H]1CC[NH2+]C1 ZINC000436056110 1040842451 /nfs/dbraw/zinc/84/24/51/1040842451.db2.gz YMIPFNPGQUBLBO-SFHVURJKSA-N 2 0 343.540 4.187 20 0 EIADRP Cc1ccncc1[C@H](C)[NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000537881517 1040869768 /nfs/dbraw/zinc/86/97/68/1040869768.db2.gz NZHAJUAUGYBCJP-LMVRJCEZSA-N 2 0 337.511 4.197 20 0 EIADRP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000483472226 1040870773 /nfs/dbraw/zinc/87/07/73/1040870773.db2.gz JXRLRQRQQOEODL-KMFMINBZSA-N 2 0 342.405 4.062 20 0 EIADRP CCC[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccccc1 ZINC000483514270 1040882947 /nfs/dbraw/zinc/88/29/47/1040882947.db2.gz REGPNEYTXAUVNU-OAQYLSRUSA-N 2 0 343.559 4.068 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+]C3CCC(C)(C)CC3)CC2)cc1 ZINC000462776526 1040915589 /nfs/dbraw/zinc/91/55/89/1040915589.db2.gz SUCGBYYYJGVJNW-UHFFFAOYSA-N 2 0 344.543 4.466 20 0 EIADRP CC[C@@H]1CCC[C@H]([NH2+]CC2CC[NH+](Cc3ccc(OC)cc3)CC2)C1 ZINC000462772425 1040927691 /nfs/dbraw/zinc/92/76/91/1040927691.db2.gz JZUWGSGSURZVFM-NQIIRXRSSA-N 2 0 344.543 4.466 20 0 EIADRP C[C@@H]([NH2+][C@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)C1CC(F)(F)C1 ZINC000898519771 1040975363 /nfs/dbraw/zinc/97/53/63/1040975363.db2.gz RBKNZMMVEHXVCZ-LBKNJMOBSA-N 2 0 348.481 4.311 20 0 EIADRP Fc1cccc2[nH]c(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)cc21 ZINC000436279417 1041023680 /nfs/dbraw/zinc/02/36/80/1041023680.db2.gz BDMHHCYFDTXKFC-UHFFFAOYSA-N 2 0 329.463 4.194 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)c1 ZINC000436273592 1041044491 /nfs/dbraw/zinc/04/44/91/1041044491.db2.gz JAHDMXSAQCNTMJ-LEWJYISDSA-N 2 0 338.495 4.053 20 0 EIADRP C[C@H](CCCC(F)(F)F)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000480179670 1041045270 /nfs/dbraw/zinc/04/52/70/1041045270.db2.gz KWTYVCAOSSDLTN-CQSZACIVSA-N 2 0 329.410 4.009 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)c1 ZINC000436273594 1041045703 /nfs/dbraw/zinc/04/57/03/1041045703.db2.gz JAHDMXSAQCNTMJ-NHCUHLMSSA-N 2 0 338.495 4.053 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000436306043 1041077399 /nfs/dbraw/zinc/07/73/99/1041077399.db2.gz NTILICQRBKONJP-RUEOWNRQSA-N 2 0 340.433 4.270 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1nc2c(s1)CCCC2 ZINC000540083803 1041101165 /nfs/dbraw/zinc/10/11/65/1041101165.db2.gz KBAYEMORCRGJAB-JKSUJKDBSA-N 2 0 335.561 4.327 20 0 EIADRP CC[NH+]1CCC([NH2+]CC(C)(C)c2c(Cl)cccc2Cl)CC1 ZINC000538160728 1041106327 /nfs/dbraw/zinc/10/63/27/1041106327.db2.gz OJLAATLMRBHESD-UHFFFAOYSA-N 2 0 329.315 4.345 20 0 EIADRP C[C@H](CCc1ccco1)[NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000540141005 1041159170 /nfs/dbraw/zinc/15/91/70/1041159170.db2.gz VIKRDUYHGRUDGB-SFHLNBCPSA-N 2 0 340.511 4.491 20 0 EIADRP Cc1nccn1C[C@H](C)C[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000540170095 1041211725 /nfs/dbraw/zinc/21/17/25/1041211725.db2.gz YSABVYQJEXRRNP-NEPJUHHUSA-N 2 0 326.271 4.485 20 0 EIADRP Cc1nccn1C[C@@H](C)C[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000540170102 1041212428 /nfs/dbraw/zinc/21/24/28/1041212428.db2.gz YSABVYQJEXRRNP-NWDGAFQWSA-N 2 0 326.271 4.485 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000484470337 1041245890 /nfs/dbraw/zinc/24/58/90/1041245890.db2.gz RZTYJGSHOKXDLL-NUEKZKHPSA-N 2 0 344.421 4.151 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000484470334 1041246420 /nfs/dbraw/zinc/24/64/20/1041246420.db2.gz RZTYJGSHOKXDLL-BPUTZDHNSA-N 2 0 344.421 4.151 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)c1cccc(O)c1 ZINC000194884240 1041256767 /nfs/dbraw/zinc/25/67/67/1041256767.db2.gz ZKEWYKXWASWEMD-SFHVURJKSA-N 2 0 338.495 4.475 20 0 EIADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC(c2ccc(C(F)(F)F)cc2)CC1 ZINC000540199437 1041257020 /nfs/dbraw/zinc/25/70/20/1041257020.db2.gz VIFGBWPMPRMFLN-SFHVURJKSA-N 2 0 340.433 4.369 20 0 EIADRP CC[C@@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)Oc1ccccc1F ZINC000484489359 1041262672 /nfs/dbraw/zinc/26/26/72/1041262672.db2.gz GKCQKUSUICKMGG-IBGZPJMESA-N 2 0 348.506 4.370 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+]C2CC(C)(c3ccccc3)C2)ccc1F ZINC000436470770 1041267464 /nfs/dbraw/zinc/26/74/64/1041267464.db2.gz ORXCPWXLLNBENS-UHFFFAOYSA-N 2 0 326.459 4.097 20 0 EIADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc2ccccc2c1OC(F)F ZINC000538406081 1041303100 /nfs/dbraw/zinc/30/31/00/1041303100.db2.gz ORJNPBHTLSXSSE-CQSZACIVSA-N 2 0 346.421 4.354 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CCCOC2CCCCC2)CCN1Cc1ccccc1 ZINC000463140786 1041360607 /nfs/dbraw/zinc/36/06/07/1041360607.db2.gz IILQDPBXVWTRJA-FPOVZHCZSA-N 2 0 344.543 4.369 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CC[C@H]2CCC[N@@H+]2C)ccc1OC1CCCC1 ZINC000540352020 1041391527 /nfs/dbraw/zinc/39/15/27/1041391527.db2.gz KZDFSQHVDZVDHQ-SJLPKXTDSA-N 2 0 346.515 4.152 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@@H+]2C)ccc1OC1CCCC1 ZINC000540352012 1041391648 /nfs/dbraw/zinc/39/16/48/1041391648.db2.gz KZDFSQHVDZVDHQ-AEFFLSMTSA-N 2 0 346.515 4.152 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cc(F)c(F)c(F)c1 ZINC000480606332 1041430388 /nfs/dbraw/zinc/43/03/88/1041430388.db2.gz DDHUWCMPJAZXFO-ZIAGYGMSSA-N 2 0 328.422 4.267 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccccc1OC(F)F ZINC000480618623 1041436421 /nfs/dbraw/zinc/43/64/21/1041436421.db2.gz TZBGZKUIYRRMAZ-HZPDHXFCSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cccc(OC(F)F)c1 ZINC000480622503 1041437573 /nfs/dbraw/zinc/43/75/73/1041437573.db2.gz YNWFIJDBFSTDKB-HZPDHXFCSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CCc2ccc3[nH]ccc3c2)CCN1Cc1ccccc1 ZINC000463262583 1041459525 /nfs/dbraw/zinc/45/95/25/1041459525.db2.gz ZKCOIRDQSKPOTC-AVRDEDQJSA-N 2 0 347.506 4.353 20 0 EIADRP COCCC[C@@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000480723740 1041490308 /nfs/dbraw/zinc/49/03/08/1041490308.db2.gz FCPDDIBIHIVNBU-CEXWTWQISA-N 2 0 332.532 4.069 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C)c(Br)c2)C[C@H]1C ZINC000538718944 1041490500 /nfs/dbraw/zinc/49/05/00/1041490500.db2.gz YBRDCWWMOVARIR-ZBFHGGJFSA-N 2 0 339.321 4.062 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc3[nH]cnc3c2)CC1 ZINC000538724661 1041494892 /nfs/dbraw/zinc/49/48/92/1041494892.db2.gz VKFIGKQBSGZAAY-QGZVFWFLSA-N 2 0 340.515 4.039 20 0 EIADRP Cc1cccc(COc2ccc(C[NH2+][C@H]3CC[N@H+](C)[C@@H](C)C3)cc2)c1 ZINC000480753979 1041509845 /nfs/dbraw/zinc/50/98/45/1041509845.db2.gz CPLQXMMXWSEYHZ-RXVVDRJESA-N 2 0 338.495 4.146 20 0 EIADRP CC(C)c1ccc(-c2nc(CN3CC[C@H]([C@@H](C)[NH3+])C3)cs2)cc1 ZINC000484908978 1041515478 /nfs/dbraw/zinc/51/54/78/1041515478.db2.gz SCZGAYAXZZWWMF-PBHICJAKSA-N 2 0 329.513 4.103 20 0 EIADRP c1sc2ccccc2c1C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000538799446 1041539848 /nfs/dbraw/zinc/53/98/48/1041539848.db2.gz GDYBWSBGAIJXDZ-HNAYVOBHSA-N 2 0 326.509 4.350 20 0 EIADRP [NH3+]CCCC[NH2+]Cc1ccc(-c2cccc(Br)c2)s1 ZINC000414905393 1041809630 /nfs/dbraw/zinc/80/96/30/1041809630.db2.gz ODRGOZYPMUGIBT-UHFFFAOYSA-N 2 0 339.302 4.006 20 0 EIADRP C[C@@H]([NH2+]CCCCCOc1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000437784866 1041908885 /nfs/dbraw/zinc/90/88/85/1041908885.db2.gz KZZOXKLAYQHDDO-WOJBJXKFSA-N 2 0 344.543 4.478 20 0 EIADRP CCN1CCC[C@H]1C[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000425936777 1041985057 /nfs/dbraw/zinc/98/50/57/1041985057.db2.gz JPVZDYSRRQHCGK-PMACEKPBSA-N 2 0 343.902 4.093 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2CCC[NH2+]CC2)cc1 ZINC000414918931 1041985677 /nfs/dbraw/zinc/98/56/77/1041985677.db2.gz TUEMGTYRBOOZPH-IXDOHACOSA-N 2 0 326.406 4.073 20 0 EIADRP CC[C@H]1CCC[C@H](C[N@H+](C)C2CCN(CCc3ccccn3)CC2)C1 ZINC000541536592 1041999325 /nfs/dbraw/zinc/99/93/25/1041999325.db2.gz CWDFCQMVGIDHCD-PMACEKPBSA-N 2 0 343.559 4.237 20 0 EIADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000541555755 1042011392 /nfs/dbraw/zinc/01/13/92/1042011392.db2.gz IRZJHNOWVWWJBG-VYDXJSESSA-N 2 0 328.422 4.218 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000425940902 1042017954 /nfs/dbraw/zinc/01/79/54/1042017954.db2.gz IMTSLCUOQVCUBP-OLZOCXBDSA-N 2 0 335.492 4.106 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000438087601 1042040597 /nfs/dbraw/zinc/04/05/97/1042040597.db2.gz LXNMXOLEXHIJNW-YVSFHVDLSA-N 2 0 334.470 4.455 20 0 EIADRP c1ccc(OCCCCC[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000438100029 1042049138 /nfs/dbraw/zinc/04/91/38/1042049138.db2.gz YEJNBWKHWKYFNO-HXUWFJFHSA-N 2 0 330.516 4.186 20 0 EIADRP Fc1ccc2c(c1)CC[C@@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001168438773 1042066435 /nfs/dbraw/zinc/06/64/35/1042066435.db2.gz ODZJDEQHKCYARD-NHCUHLMSSA-N 2 0 330.491 4.023 20 0 EIADRP CCCCCOc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000517547198 1042076764 /nfs/dbraw/zinc/07/67/64/1042076764.db2.gz JQOXYCWTUPIUNR-FQEVSTJZSA-N 2 0 332.532 4.466 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccc(OC(F)(F)F)cc1 ZINC000517567406 1042083011 /nfs/dbraw/zinc/08/30/11/1042083011.db2.gz LQVPNFJTBLKOJC-KRWDZBQOSA-N 2 0 338.373 4.285 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H]3CCCc4cc(N)ccc43)CC2)C1 ZINC000414928342 1042158168 /nfs/dbraw/zinc/15/81/68/1042158168.db2.gz MVGZCRAKIBUJSF-BUVFEPMLSA-N 2 0 341.543 4.279 20 0 EIADRP C[N@@H+](Cc1ccc2c(c1)CCC2)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464845031 1042193116 /nfs/dbraw/zinc/19/31/16/1042193116.db2.gz DBJBIYJEJOWZDS-NRFANRHFSA-N 2 0 334.507 4.129 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CC[NH2+]1 ZINC000414948183 1042335770 /nfs/dbraw/zinc/33/57/70/1042335770.db2.gz LSSXKIUVIMZOES-VDNDLQMASA-N 2 0 326.406 4.072 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C/C=C\c2ccc(OCc3ccccc3)cc2)CC[NH2+]1 ZINC000414962038 1042394425 /nfs/dbraw/zinc/39/44/25/1042394425.db2.gz ZMBHWQGZMHNHJL-BSPJPZBESA-N 2 0 336.479 4.009 20 0 EIADRP CC(C)CCOc1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000518274380 1042447494 /nfs/dbraw/zinc/44/74/94/1042447494.db2.gz ZAZLMROLWQWQCW-FQEVSTJZSA-N 2 0 332.532 4.322 20 0 EIADRP Cc1ccc(-c2nc(C[NH+]3CCC(CC[NH+](C)C)CC3)cs2)cc1 ZINC000172827920 1042499683 /nfs/dbraw/zinc/49/96/83/1042499683.db2.gz BPHMBYLNNJCOIC-UHFFFAOYSA-N 2 0 343.540 4.282 20 0 EIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]CC1CC[NH+](CCC(C)C)CC1 ZINC000491872511 1042510427 /nfs/dbraw/zinc/51/04/27/1042510427.db2.gz POJRRQJKEHLWNZ-NQIIRXRSSA-N 2 0 332.532 4.110 20 0 EIADRP CC(C)[N@H+](C)CCCN[C@H](c1ccc(Br)s1)C1CC1 ZINC000439142958 1042518112 /nfs/dbraw/zinc/51/81/12/1042518112.db2.gz QWNXBVYHOSVYAX-HNNXBMFYSA-N 2 0 345.350 4.282 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cccc(Br)c1 ZINC000173307045 1042563659 /nfs/dbraw/zinc/56/36/59/1042563659.db2.gz UAYWQWZNJMXBNN-CQSZACIVSA-N 2 0 347.300 4.362 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2ccc3[nH]cnc3c2)cc1 ZINC000518761412 1042679077 /nfs/dbraw/zinc/67/90/77/1042679077.db2.gz ULIJMJOASULBQZ-QGZVFWFLSA-N 2 0 348.494 4.227 20 0 EIADRP FC(F)(F)C1CCC([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167964760 1042684854 /nfs/dbraw/zinc/68/48/54/1042684854.db2.gz XNDFWDURSKPDRT-QLQQRZLESA-N 2 0 330.438 4.103 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310099003 1042827781 /nfs/dbraw/zinc/82/77/81/1042827781.db2.gz WRNMJHGYJZREEX-WIYYLYMNSA-N 2 0 326.459 4.389 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310099000 1042827989 /nfs/dbraw/zinc/82/79/89/1042827989.db2.gz WRNMJHGYJZREEX-GHTZIAJQSA-N 2 0 326.459 4.389 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310099001 1042828114 /nfs/dbraw/zinc/82/81/14/1042828114.db2.gz WRNMJHGYJZREEX-NQIIRXRSSA-N 2 0 326.459 4.389 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1OC ZINC000310985594 1042849251 /nfs/dbraw/zinc/84/92/51/1042849251.db2.gz GTHDBFODEHWHDM-CTNGQTDRSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@H]([NH2+]Cc1coc2ccccc12)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311130343 1042853963 /nfs/dbraw/zinc/85/39/63/1042853963.db2.gz WJBKMGOAOKRSBJ-PKOBYXMFSA-N 2 0 334.463 4.433 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2cccnc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311609394 1042862753 /nfs/dbraw/zinc/86/27/53/1042862753.db2.gz DZEDYWIJGNPCND-GCJKJVERSA-N 2 0 345.490 4.235 20 0 EIADRP COc1cccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)c1 ZINC000507770987 1042871105 /nfs/dbraw/zinc/87/11/05/1042871105.db2.gz FSGOVLNXDDDWOC-UHFFFAOYSA-N 2 0 338.495 4.039 20 0 EIADRP CC[C@@H]1C[C@@H](C[N@H+](CC)C[C@H]2CC[NH+](Cc3ccccc3)C2)CCO1 ZINC000507784519 1042928476 /nfs/dbraw/zinc/92/84/76/1042928476.db2.gz RNPZIUSHFZEVPR-BHDDXSALSA-N 2 0 344.543 4.036 20 0 EIADRP Fc1ccc(C[C@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001168005140 1042958127 /nfs/dbraw/zinc/95/81/27/1042958127.db2.gz GPWLLWTUNYLQMQ-IZCSPVGOSA-N 2 0 342.502 4.238 20 0 EIADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000493890811 1042972577 /nfs/dbraw/zinc/97/25/77/1042972577.db2.gz HMTGJMDJNPFGOK-PGRDOPGGSA-N 2 0 340.511 4.393 20 0 EIADRP C[C@@H]1CC([NH2+]CCc2ccc(F)cc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168006693 1043008260 /nfs/dbraw/zinc/00/82/60/1043008260.db2.gz OFAHIWAUDSCHNX-QZTJIDSGSA-N 2 0 340.486 4.399 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCCc2ccncc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168007265 1043015212 /nfs/dbraw/zinc/01/52/12/1043015212.db2.gz ACFSPNLNUWMXJK-HATOLVCRSA-N 2 0 337.511 4.045 20 0 EIADRP C[C@@H]1C[C@@H](NCc2ccccc2F)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168007810 1043023076 /nfs/dbraw/zinc/02/30/76/1043023076.db2.gz UVKKQDRYDMCEEE-XEMDLRDOSA-N 2 0 326.459 4.357 20 0 EIADRP C/C=C/COc1ccc(CC[C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000152421406 1043027136 /nfs/dbraw/zinc/02/71/36/1043027136.db2.gz OXCMLOGFHWJOTB-XCJDPYLSSA-N 2 0 342.527 4.037 20 0 EIADRP CCc1nc2c(s1)[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C3CCC3)C1)CCC2 ZINC000183186186 1043040078 /nfs/dbraw/zinc/04/00/78/1043040078.db2.gz WBEJTDBHONPFKX-BFYDXBDKSA-N 2 0 347.572 4.326 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](C)Cc2ccccc2C(F)(F)F)CC1 ZINC000162297268 1043066591 /nfs/dbraw/zinc/06/65/91/1043066591.db2.gz TWNZERNJXGCDQE-AWEZNQCLSA-N 2 0 328.422 4.100 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1cnn(-c2ccccc2)c1 ZINC000765954556 1043080795 /nfs/dbraw/zinc/08/07/95/1043080795.db2.gz SKFJRYQTQXTNJM-LJQANCHMSA-N 2 0 340.515 4.179 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]C3CCC(C(F)F)CC3)CC2)CC1 ZINC000442814661 1043104977 /nfs/dbraw/zinc/10/49/77/1043104977.db2.gz BJUWLMNDIWQXTG-UHFFFAOYSA-N 2 0 328.491 4.443 20 0 EIADRP c1ccc2c(c1)[nH]c1c2CCC[C@@H]1[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658353356 1043120838 /nfs/dbraw/zinc/12/08/38/1043120838.db2.gz MFLBCIYVFPBGRI-NRFANRHFSA-N 2 0 337.511 4.257 20 0 EIADRP FC(F)(F)c1ccc2c(NC[C@@H]3CC[N@@H+](C4CC4)C3)cc[nH+]c2c1 ZINC000516143219 1043121432 /nfs/dbraw/zinc/12/14/32/1043121432.db2.gz KOVYWBYFLJSGOA-LBPRGKRZSA-N 2 0 335.373 4.150 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cnc3ccccc3c2)c1 ZINC000727467173 1043226826 /nfs/dbraw/zinc/22/68/26/1043226826.db2.gz PDGPBBOYCSBVEX-UHFFFAOYSA-N 2 0 333.479 4.366 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]CC2=Cc3ccccc3OC2)c1 ZINC000171051735 1043414356 /nfs/dbraw/zinc/41/43/56/1043414356.db2.gz FPDHLEKKKIHOQI-UHFFFAOYSA-N 2 0 336.479 4.092 20 0 EIADRP CCCc1csc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)n1 ZINC000494340557 1043420499 /nfs/dbraw/zinc/42/04/99/1043420499.db2.gz UILZEKOVFUNUDP-UHFFFAOYSA-N 2 0 349.569 4.159 20 0 EIADRP CCC[NH+](CCC)CCNC1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168012231 1043428268 /nfs/dbraw/zinc/42/82/68/1043428268.db2.gz YKOURBMASGIMTP-PMACEKPBSA-N 2 0 345.575 4.140 20 0 EIADRP Cc1nc2ccc(C[NH2+]CCCC[N@H+]3CCCC[C@@H]3C)cc2s1 ZINC000494385262 1043459977 /nfs/dbraw/zinc/45/99/77/1043459977.db2.gz LYODQEKDDHWVOT-HNNXBMFYSA-N 2 0 331.529 4.349 20 0 EIADRP CCn1c2ccccc2c2cc(C[NH2+][C@@H]3CCn4ccnc4C3)ccc21 ZINC000494409707 1043467981 /nfs/dbraw/zinc/46/79/81/1043467981.db2.gz GZPLESFDXWKLSZ-QGZVFWFLSA-N 2 0 344.462 4.116 20 0 EIADRP Cc1cscc1C[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000494465824 1043499481 /nfs/dbraw/zinc/49/94/81/1043499481.db2.gz NYCQACMNNREOKP-DFQSSKMNSA-N 2 0 326.509 4.057 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)[C@H](C)C2 ZINC000665273491 1043510344 /nfs/dbraw/zinc/51/03/44/1043510344.db2.gz XYEDBKUSCRSIGP-LNKMKMDRSA-N 2 0 348.490 4.074 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000521860130 1043586884 /nfs/dbraw/zinc/58/68/84/1043586884.db2.gz VZQXXDFNQNMWMH-WWGRRREGSA-N 2 0 345.487 4.044 20 0 EIADRP CC(C)[C@H]([NH3+])CC[NH2+][C@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000665281333 1043670268 /nfs/dbraw/zinc/67/02/68/1043670268.db2.gz ZTJFDEFOZWIQRQ-CVEARBPZSA-N 2 0 329.513 4.151 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000474033789 1043691585 /nfs/dbraw/zinc/69/15/85/1043691585.db2.gz LUTFVOUQTQHRJI-JXFKEZNVSA-N 2 0 330.516 4.128 20 0 EIADRP CC(C)CC[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccoc1 ZINC000658069242 1043740366 /nfs/dbraw/zinc/74/03/66/1043740366.db2.gz DTDFWYOFADFOIY-NRFANRHFSA-N 2 0 348.531 4.238 20 0 EIADRP Cc1c([C@@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cnn1C(C)(C)C ZINC000191285720 1043804427 /nfs/dbraw/zinc/80/44/27/1043804427.db2.gz VIXJCXYODMEWHJ-QGZVFWFLSA-N 2 0 334.552 4.253 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2Cc3[nH]c4ccccc4c3C2)c1 ZINC000442710307 1043814876 /nfs/dbraw/zinc/81/48/76/1043814876.db2.gz PSHGICDGVSMXAO-LJQANCHMSA-N 2 0 347.506 4.267 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCc2ccsc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168014384 1043827176 /nfs/dbraw/zinc/82/71/76/1043827176.db2.gz KVFMGYFOBRQZKB-XEMDLRDOSA-N 2 0 328.525 4.322 20 0 EIADRP COCCC[C@@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1ccc(F)cc1 ZINC000442868280 1043868653 /nfs/dbraw/zinc/86/86/53/1043868653.db2.gz QDTWQJBPGXGFMR-LJQANCHMSA-N 2 0 336.495 4.005 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCCOC(C)(C)C)CC1 ZINC000674907464 1043935748 /nfs/dbraw/zinc/93/57/48/1043935748.db2.gz UIQMYSUIWFAPEE-UHFFFAOYSA-N 2 0 332.532 4.036 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]CC1=Cc2ccccc2OC1 ZINC000521822714 1044013901 /nfs/dbraw/zinc/01/39/01/1044013901.db2.gz HXIYEWYXWZMHOM-UHFFFAOYSA-N 2 0 336.479 4.094 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000521860129 1044033745 /nfs/dbraw/zinc/03/37/45/1044033745.db2.gz VZQXXDFNQNMWMH-IOASZLSFSA-N 2 0 345.487 4.044 20 0 EIADRP C[C@@H]([NH2+]CCc1ccc(F)cc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000428271202 1044064454 /nfs/dbraw/zinc/06/44/54/1044064454.db2.gz YHMKTQBJKAQMKQ-ZBFHGGJFSA-N 2 0 338.898 4.264 20 0 EIADRP C[C@H]([NH2+]C1CCC2(CC2(F)F)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000658265793 1044198204 /nfs/dbraw/zinc/19/82/04/1044198204.db2.gz PXOAUMDXURDDIG-YUKKFIBKSA-N 2 0 348.481 4.455 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000348008051 1044362119 /nfs/dbraw/zinc/36/21/19/1044362119.db2.gz OESZMOOTNXPZQK-OXJNMPFZSA-N 2 0 342.531 4.198 20 0 EIADRP C[C@H](C[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)Cc1ccccc1 ZINC000542518628 1044450628 /nfs/dbraw/zinc/45/06/28/1044450628.db2.gz YAQCJYSMFXEDPK-REWPJTCUSA-N 2 0 336.523 4.019 20 0 EIADRP Clc1ccc2c(c1Cl)CC[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000675752485 1044466285 /nfs/dbraw/zinc/46/62/85/1044466285.db2.gz XJMPTKVKZHEKCW-WQGACYEGSA-N 2 0 325.283 4.197 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@@H](C)C2CC[NH+](C)CC2)ccc1OCC(C)C ZINC000675775944 1044486904 /nfs/dbraw/zinc/48/69/04/1044486904.db2.gz BQFJLCIREQJPCD-IRXDYDNUSA-N 2 0 348.531 4.111 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+][C@@H](C)C2CC[NH+](C)CC2)cc1OC ZINC000675777144 1044489711 /nfs/dbraw/zinc/48/97/11/1044489711.db2.gz MEDLMWGLMUVRAL-IRXDYDNUSA-N 2 0 348.531 4.255 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc2ccccc2[nH]1 ZINC000675790080 1044502600 /nfs/dbraw/zinc/50/26/00/1044502600.db2.gz RCMADJNBHUDIDA-UTKZUKDTSA-N 2 0 333.479 4.168 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@@H](c2cccnc2)C2CCCCC2)CC1 ZINC000675812759 1044511823 /nfs/dbraw/zinc/51/18/23/1044511823.db2.gz XZWOCBJGCSFOIL-OAQYLSRUSA-N 2 0 329.532 4.413 20 0 EIADRP C[C@H](C[NH2+][C@@H](C[C@@H]1CCOC1)c1ccc(F)cc1)C[NH+]1CCCCC1 ZINC000494926699 1044524369 /nfs/dbraw/zinc/52/43/69/1044524369.db2.gz YSMOKHMCHGJFCK-LQWHRVPQSA-N 2 0 348.506 4.005 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](CCCc3ccc(C(F)(F)F)cc3)CC[C@@H]21 ZINC000675897599 1044543562 /nfs/dbraw/zinc/54/35/62/1044543562.db2.gz HEQAPAHQZUHIOA-WMZOPIPTSA-N 2 0 340.433 4.054 20 0 EIADRP CCC(CC)(C[NH2+][C@@H](C)C1CC[NH+](C)CC1)N[C@@H](C)c1ccccc1 ZINC000675894939 1044543472 /nfs/dbraw/zinc/54/34/72/1044543472.db2.gz WFGUGAQOFCUOOK-OALUTQOASA-N 2 0 345.575 4.216 20 0 EIADRP CS[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C(C)(C)C ZINC000543411855 1044552536 /nfs/dbraw/zinc/55/25/36/1044552536.db2.gz BZWRZFFEHJLASS-BHIYHBOVSA-N 2 0 334.573 4.407 20 0 EIADRP CS[C@H](C[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1)C(C)(C)C ZINC000543412105 1044553867 /nfs/dbraw/zinc/55/38/67/1044553867.db2.gz VQRKGHXMMJSPKU-RYQLBKOJSA-N 2 0 326.594 4.397 20 0 EIADRP Cc1nc(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)c(C)s1 ZINC000443638165 1044585527 /nfs/dbraw/zinc/58/55/27/1044585527.db2.gz LAWXCTUSWZNYIC-UHFFFAOYSA-N 2 0 343.540 4.104 20 0 EIADRP C[C@@H](C[NH2+]CC1CC[NH+](Cc2cccs2)CC1)Cc1ccccc1 ZINC000543446445 1044613782 /nfs/dbraw/zinc/61/37/82/1044613782.db2.gz HZCQLSYLHAENSS-GOSISDBHSA-N 2 0 342.552 4.429 20 0 EIADRP C[C@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)c1cccc2ccccc21 ZINC000676052754 1044618317 /nfs/dbraw/zinc/61/83/17/1044618317.db2.gz PZRJRHKQFJXQBG-KRWDZBQOSA-N 2 0 349.478 4.026 20 0 EIADRP CS[C@H]1CCC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCCC2)C1 ZINC000735324614 1044794182 /nfs/dbraw/zinc/79/41/82/1044794182.db2.gz VXTOYVODHJRUCC-PMACEKPBSA-N 2 0 332.557 4.436 20 0 EIADRP C[C@H]1CC(n2cnc3cccc(C[NH3+])c32)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168030729 1044805075 /nfs/dbraw/zinc/80/50/75/1044805075.db2.gz WZWCNBLAHDZBBJ-IRXDYDNUSA-N 2 0 348.494 4.109 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)[C@H]1CCCO1 ZINC000544362330 1044822571 /nfs/dbraw/zinc/82/25/71/1044822571.db2.gz CSIPBKRVDJOBMW-VGOFRKELSA-N 2 0 338.495 4.072 20 0 EIADRP FC(F)(F)c1ccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000676712966 1044828245 /nfs/dbraw/zinc/82/82/45/1044828245.db2.gz VLCNDTOISKYXAR-MAUKXSAKSA-N 2 0 338.417 4.154 20 0 EIADRP C[C@@H]1CC([NH2+][C@H]2CCCc3ccncc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168032460 1044839486 /nfs/dbraw/zinc/83/94/86/1044839486.db2.gz GIVAUBMIBKHGGC-PNCHPQGNSA-N 2 0 349.522 4.490 20 0 EIADRP CCCn1ccnc1CCC[N@H+](C)[C@H]1CCc2c1cccc2Cl ZINC000429259873 1044857777 /nfs/dbraw/zinc/85/77/77/1044857777.db2.gz LHFTYKPDKOOFAF-SFHVURJKSA-N 2 0 331.891 4.498 20 0 EIADRP Cc1ccc([C@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C2CCC2)o1 ZINC000543592817 1044876130 /nfs/dbraw/zinc/87/61/30/1044876130.db2.gz CZQBPNARIRTXNG-OAQYLSRUSA-N 2 0 339.483 4.330 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2ncc(-c3ccccc3)s2)CC1 ZINC000922845746 1044992568 /nfs/dbraw/zinc/99/25/68/1044992568.db2.gz SOOPZCBVRPRKBB-UHFFFAOYSA-N 2 0 341.524 4.307 20 0 EIADRP Cc1ncc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000179136475 1045045616 /nfs/dbraw/zinc/04/56/16/1045045616.db2.gz XWYFLCDQEMRICG-OAHLLOKOSA-N 2 0 329.513 4.014 20 0 EIADRP Clc1ccc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)s1 ZINC001307598434 1045049941 /nfs/dbraw/zinc/04/99/41/1045049941.db2.gz UJPTWFFULILRHK-UHFFFAOYSA-N 2 0 326.937 4.490 20 0 EIADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CCCc2ccc(C(F)(F)F)cc2)C1 ZINC000674007447 1045178094 /nfs/dbraw/zinc/17/80/94/1045178094.db2.gz JEVZLQNBDNXNOP-KRWDZBQOSA-N 2 0 342.449 4.302 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OCC(F)(F)F)cc2)CC1 ZINC000161637618 1045303942 /nfs/dbraw/zinc/30/39/42/1045303942.db2.gz RXYGGZBVYRWWQE-AWEZNQCLSA-N 2 0 344.421 4.153 20 0 EIADRP C[NH+](C)CCCC[NH2+]Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000322386866 1045477413 /nfs/dbraw/zinc/47/74/13/1045477413.db2.gz OWOCEIDWIJPVLC-UHFFFAOYSA-N 2 0 342.327 4.156 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1C[NH+](CC)CC)c1ccc(F)cn1 ZINC000326170975 1045657938 /nfs/dbraw/zinc/65/79/38/1045657938.db2.gz NXISHJGAKZAMIZ-LJQANCHMSA-N 2 0 329.463 4.303 20 0 EIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@H]2CCOC3(CCCC3)C2)c1 ZINC000767929375 1045683900 /nfs/dbraw/zinc/68/39/00/1045683900.db2.gz OJBHJEQAOXZVLZ-NRFANRHFSA-N 2 0 342.527 4.254 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+]C2CC(C(F)F)C2)C1 ZINC000768679852 1045827451 /nfs/dbraw/zinc/82/74/51/1045827451.db2.gz XLRCIWNEGNLHQD-MYMYQCDVSA-N 2 0 336.470 4.298 20 0 EIADRP C[C@H](Cc1ccccc1Cl)[NH+]1CCC([NH3+])(Cc2ccccc2)CC1 ZINC001170263897 1045961449 /nfs/dbraw/zinc/96/14/49/1045961449.db2.gz QRZTXOQZODOLHG-QGZVFWFLSA-N 2 0 342.914 4.307 20 0 EIADRP Cc1c2[nH+]c[nH]c2ccc1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001170332331 1046002528 /nfs/dbraw/zinc/00/25/28/1046002528.db2.gz CXSVLQLDIUIZFG-LDLYASANSA-N 2 0 346.478 4.479 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C(c1ccccc1)c1ccccc1 ZINC000124379668 1046233895 /nfs/dbraw/zinc/23/38/95/1046233895.db2.gz MFHDJIAQENILBZ-MOPGFXCFSA-N 2 0 334.507 4.281 20 0 EIADRP C[N@@H+](Cc1ccc2ncccc2c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000124677826 1046255056 /nfs/dbraw/zinc/25/50/56/1046255056.db2.gz CSUZSAMLOCKYFV-NRFANRHFSA-N 2 0 345.490 4.189 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1cncc(F)c1 ZINC000125102255 1046287643 /nfs/dbraw/zinc/28/76/43/1046287643.db2.gz GWALAPFXWOAXHJ-QGZVFWFLSA-N 2 0 341.474 4.448 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+]Cc2ccc(O)cc2)C1 ZINC000237686059 1046302290 /nfs/dbraw/zinc/30/22/90/1046302290.db2.gz QAPMKXJFXUSVHM-HDICACEKSA-N 2 0 338.495 4.160 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]Cc3ccc(O)cc3)cc2)C1 ZINC000237687915 1046302386 /nfs/dbraw/zinc/30/23/86/1046302386.db2.gz UEEOZPLUKWFLFZ-HDICACEKSA-N 2 0 338.495 4.160 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cc2c(s1)CCC2 ZINC000162567028 1046352176 /nfs/dbraw/zinc/35/21/76/1046352176.db2.gz JCBWJVNQGJSEBH-HNNXBMFYSA-N 2 0 344.524 4.028 20 0 EIADRP CCc1ccc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)s1 ZINC000162597592 1046381862 /nfs/dbraw/zinc/38/18/62/1046381862.db2.gz NJVUFJIWFYOUNN-HNNXBMFYSA-N 2 0 332.513 4.102 20 0 EIADRP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)cc1OCC ZINC000125985557 1046408176 /nfs/dbraw/zinc/40/81/76/1046408176.db2.gz VVTYGTIODRYDLR-QZTJIDSGSA-N 2 0 348.531 4.255 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc2cc(OC)ccc2c1 ZINC000126265398 1046466184 /nfs/dbraw/zinc/46/61/84/1046466184.db2.gz BLQOJAFISSZVSE-OAQYLSRUSA-N 2 0 326.484 4.231 20 0 EIADRP C[NH+]1C(C)(C)CC(Nc2cc[nH+]c(N3CCCCC3)c2)CC1(C)C ZINC001170451499 1046503675 /nfs/dbraw/zinc/50/36/75/1046503675.db2.gz OINAJGNKNOXHHW-UHFFFAOYSA-N 2 0 330.520 4.135 20 0 EIADRP C[N@@H+]1CC[C@H](c2ccc(NC3CC(C)(C)[NH+](C)C(C)(C)C3)cc2)C1 ZINC001170453379 1046536354 /nfs/dbraw/zinc/53/63/54/1046536354.db2.gz JSDNZSABXJSJTH-KRWDZBQOSA-N 2 0 329.532 4.169 20 0 EIADRP CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459405244 1046604689 /nfs/dbraw/zinc/60/46/89/1046604689.db2.gz DZHIBMYLHAJYAG-SFHVURJKSA-N 2 0 343.902 4.315 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(OC)c3ccccc23)C[C@H]1C ZINC000536659333 1046609251 /nfs/dbraw/zinc/60/92/51/1046609251.db2.gz WUPZOLPGGRKQMT-AEFFLSMTSA-N 2 0 326.484 4.153 20 0 EIADRP CCCOc1c(CN(C)[C@H]2CC[N@H+](CC)C[C@@H]2C)cccc1OCC ZINC000536662513 1046626944 /nfs/dbraw/zinc/62/69/44/1046626944.db2.gz HKVDGMJRQYYLMW-HKUYNNGSSA-N 2 0 348.531 4.036 20 0 EIADRP CCCOc1c(CN(C)[C@@H]2CC[N@H+](CC)C[C@H]2C)cccc1OCC ZINC000536662514 1046627536 /nfs/dbraw/zinc/62/75/36/1046627536.db2.gz HKVDGMJRQYYLMW-IEBWSBKVSA-N 2 0 348.531 4.036 20 0 EIADRP CCC[N@H+](C)C[C@@H]1CCN(Cc2cc(C)c(C)cc2OC(F)F)C1 ZINC000536663327 1046632070 /nfs/dbraw/zinc/63/20/70/1046632070.db2.gz FMSOENBCRRZMDE-INIZCTEOSA-N 2 0 340.458 4.069 20 0 EIADRP Cc1cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc(C)c1O ZINC000379615158 1046700922 /nfs/dbraw/zinc/70/09/22/1046700922.db2.gz AFXKGXWHSUNYHN-RXVVDRJESA-N 2 0 338.495 4.152 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000379641557 1046746021 /nfs/dbraw/zinc/74/60/21/1046746021.db2.gz YKEBXQKZHBLVLA-WFXMLNOXSA-N 2 0 338.495 4.399 20 0 EIADRP Cc1ccc(SC[C@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459542276 1046764138 /nfs/dbraw/zinc/76/41/38/1046764138.db2.gz XOHSOAJLPFEPHE-KRWDZBQOSA-N 2 0 341.524 4.129 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc2ccccc2c1 ZINC000536859343 1046827202 /nfs/dbraw/zinc/82/72/02/1046827202.db2.gz RZNWUVUMFNCUKQ-QRVBRYPASA-N 2 0 340.511 4.380 20 0 EIADRP CC(C)CCC[C@H](C)[NH2+]CCSCc1ccc(C[NH+](C)C)o1 ZINC001170057290 1046834464 /nfs/dbraw/zinc/83/44/64/1046834464.db2.gz HHQWXVYXOAQZRU-INIZCTEOSA-N 2 0 326.550 4.379 20 0 EIADRP COc1ccccc1[C@@H]([NH2+]CCC1CC[NH+](C)CC1)C1CCCC1 ZINC000536999898 1046891295 /nfs/dbraw/zinc/89/12/95/1046891295.db2.gz FCNWKVRJTREZIA-NRFANRHFSA-N 2 0 330.516 4.248 20 0 EIADRP COc1ccccc1[C@H]([NH2+]CCC1CC[NH+](C)CC1)C1CCCC1 ZINC000536999899 1046891916 /nfs/dbraw/zinc/89/19/16/1046891916.db2.gz FCNWKVRJTREZIA-OAQYLSRUSA-N 2 0 330.516 4.248 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCC[NH2+][C@@H](C)c2ccc(OC)cc2)cc1 ZINC000537027502 1046903431 /nfs/dbraw/zinc/90/34/31/1046903431.db2.gz AENGEHHHMVFVJX-IRXDYDNUSA-N 2 0 342.483 4.095 20 0 EIADRP COc1ccc(CC2([NH3+])CC[NH+]([C@@H](C)CCCC(C)C)CC2)cc1 ZINC001170070462 1046940452 /nfs/dbraw/zinc/94/04/52/1046940452.db2.gz FKYXRTASGNFOQD-SFHVURJKSA-N 2 0 332.532 4.246 20 0 EIADRP CC[C@H]([NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)C(C)(C)C ZINC000537197944 1047019466 /nfs/dbraw/zinc/01/94/66/1047019466.db2.gz NMYYXLDYGNPYMW-HKUYNNGSSA-N 2 0 330.516 4.389 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCc4ccc(Cl)nc43)CC2)CC1 ZINC000787764707 1047048318 /nfs/dbraw/zinc/04/83/18/1047048318.db2.gz PIKVLOCJWCKVLT-DAWZGUTISA-N 2 0 347.934 4.355 20 0 EIADRP Clc1ccc2c(n1)CC[C@H]2[NH2+]CCCCCCC[NH+]1CCCC1 ZINC000806138069 1047136029 /nfs/dbraw/zinc/13/60/29/1047136029.db2.gz QTVUOGFSYJAMOH-QGZVFWFLSA-N 2 0 335.923 4.358 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCc3nc(Cl)ccc32)cc1 ZINC000806127151 1047146909 /nfs/dbraw/zinc/14/69/09/1047146909.db2.gz ASEIAXDIUYQRAX-GOSISDBHSA-N 2 0 343.902 4.354 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1cc[nH]c(=O)c1 ZINC000788530229 1047227848 /nfs/dbraw/zinc/22/78/48/1047227848.db2.gz WQMDQLIXXPNGJY-DLBZAZTESA-N 2 0 339.483 4.012 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1cc[nH]c(=O)c1 ZINC000788582304 1047235247 /nfs/dbraw/zinc/23/52/47/1047235247.db2.gz GJFQWPYFIFWTKA-KRWDZBQOSA-N 2 0 339.483 4.014 20 0 EIADRP C(CCC[NH2+][C@@H]1CCCC[C@H]1[C@@H]1CCOC1)CCC[NH+]1CCCC1 ZINC000788988571 1047343277 /nfs/dbraw/zinc/34/32/77/1047343277.db2.gz SAOZNISVIULIRL-QHAWAJNXSA-N 2 0 336.564 4.218 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccccc1 ZINC000129396657 1047376730 /nfs/dbraw/zinc/37/67/30/1047376730.db2.gz BGJQTYQIEDKSJL-OTWHNJEPSA-N 2 0 338.495 4.147 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCCc3ccc(O)cc32)cc1 ZINC000327729804 1047393083 /nfs/dbraw/zinc/39/30/83/1047393083.db2.gz CTONRHIGORYBRN-QFIPXVFZSA-N 2 0 338.495 4.401 20 0 EIADRP COc1ccc([C@@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000327842333 1047404362 /nfs/dbraw/zinc/40/43/62/1047404362.db2.gz RQGAXNIFQIGAAS-NRFANRHFSA-N 2 0 338.495 4.106 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1ccncc1F ZINC000556119576 1047472658 /nfs/dbraw/zinc/47/26/58/1047472658.db2.gz AMKZVECWNUIPEJ-JENIJYKNSA-N 2 0 341.474 4.172 20 0 EIADRP C[C@H]1CC[C@@H]([NH+]2CCC([NH3+])(Cc3ccc(C(F)(F)F)cc3)CC2)C1 ZINC001170119751 1047474017 /nfs/dbraw/zinc/47/40/17/1047474017.db2.gz BYJRNGOHSCWNRB-WMLDXEAASA-N 2 0 340.433 4.230 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCSC2)cc1C[NH+]1CCCCC1 ZINC000790494933 1047599400 /nfs/dbraw/zinc/59/94/00/1047599400.db2.gz HHQPFBAWSPKIGF-SJORKVTESA-N 2 0 348.556 4.085 20 0 EIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@@H]3C[C@H]3c3ccccc3)CC2)C1 ZINC000556240195 1047605665 /nfs/dbraw/zinc/60/56/65/1047605665.db2.gz HEPGOVRULGYWMY-UDDWMFPDSA-N 2 0 326.528 4.423 20 0 EIADRP COc1cccc([C@H]([NH2+]C2CCC([NH+](C)C)CC2)c2ccccc2)c1 ZINC001168303906 1047734280 /nfs/dbraw/zinc/73/42/80/1047734280.db2.gz GBMLDQVTZCVDKM-QETWGEEDSA-N 2 0 338.495 4.247 20 0 EIADRP COc1ncc([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1Cl ZINC000556591830 1047835429 /nfs/dbraw/zinc/83/54/29/1047835429.db2.gz NEAROMYZHHBQKU-GJZGRUSLSA-N 2 0 339.911 4.049 20 0 EIADRP CC[C@H]1C[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CCO1 ZINC000824427275 1047867713 /nfs/dbraw/zinc/86/77/13/1047867713.db2.gz IBKWJSGEUFDBAW-HGHNDWQTSA-N 2 0 342.527 4.119 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171065208 1047921243 /nfs/dbraw/zinc/92/12/43/1047921243.db2.gz VSRRETSMIMSDTJ-INIZCTEOSA-N 2 0 341.326 4.313 20 0 EIADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001171064636 1047921899 /nfs/dbraw/zinc/92/18/99/1047921899.db2.gz SFSZBVLJPHMJNX-XJKSGUPXSA-N 2 0 341.326 4.172 20 0 EIADRP CC1(C)[C@@H]2C[C@H]([NH+]3CCC([NH3+])(Cc4cccc(Cl)c4)CC3)C[C@@H]21 ZINC001170740979 1047961554 /nfs/dbraw/zinc/96/15/54/1047961554.db2.gz WJGWLYKCHOSJFY-BCDXTJNWSA-N 2 0 332.919 4.110 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1c[nH]c2cccc(F)c12 ZINC001136985420 1048030302 /nfs/dbraw/zinc/03/03/02/1048030302.db2.gz GMUUNSGNENQQRO-IRXDYDNUSA-N 2 0 329.463 4.146 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)C1 ZINC000556857536 1048075411 /nfs/dbraw/zinc/07/54/11/1048075411.db2.gz CKSDQMAWLNNSAC-WSTZPKSXSA-N 2 0 346.563 4.379 20 0 EIADRP CC(C)c1ncc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)s1 ZINC000131690748 1048104811 /nfs/dbraw/zinc/10/48/11/1048104811.db2.gz ZOHDCPUBCPSCDM-UHFFFAOYSA-N 2 0 331.529 4.397 20 0 EIADRP CC(C)(C)[C@H]1OCCC[C@@H]1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000131736947 1048129195 /nfs/dbraw/zinc/12/91/95/1048129195.db2.gz SLCYCWBSCSUGOZ-XLIONFOSSA-N 2 0 336.564 4.214 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1Cl)c1cccc(OCC[NH+](C)C)c1 ZINC000132426883 1048292720 /nfs/dbraw/zinc/29/27/20/1048292720.db2.gz QNQIBMJNFATACZ-HNNXBMFYSA-N 2 0 332.875 4.131 20 0 EIADRP C[C@H](CC[N@@H+]1CCC[C@]2(CC2(F)F)C1)[NH+]1CCC[C@]2(CC2(F)F)C1 ZINC000844437265 1048333247 /nfs/dbraw/zinc/33/32/47/1048333247.db2.gz MTLKTALOLQNCTL-PMPSAXMXSA-N 2 0 348.428 4.007 20 0 EIADRP Cc1cccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499149813 1048357553 /nfs/dbraw/zinc/35/75/53/1048357553.db2.gz UOESPUQAFULPBK-NUNAXRQHSA-N 2 0 334.507 4.323 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@H]2CCc4ccccc4C2)C3)cc1 ZINC000499164509 1048372117 /nfs/dbraw/zinc/37/21/17/1048372117.db2.gz OFZVSRHICCXJAA-XQUALCHDSA-N 2 0 346.518 4.329 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)[C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171130194 1048382901 /nfs/dbraw/zinc/38/29/01/1048382901.db2.gz QPLHITKPJGOVEJ-FQEVSTJZSA-N 2 0 334.935 4.250 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171139306 1048419811 /nfs/dbraw/zinc/41/98/11/1048419811.db2.gz LBIXFWQMGNWATP-MRXNPFEDSA-N 2 0 341.326 4.313 20 0 EIADRP c1ccc(C[C@@H]2C[C@@H]2[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499215470 1048422212 /nfs/dbraw/zinc/42/22/12/1048422212.db2.gz QDIBNRAWADIYQP-SJSRKZJXSA-N 2 0 346.518 4.403 20 0 EIADRP CC[N@H+](C1CCN(C)CC1)[C@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171160510 1048594869 /nfs/dbraw/zinc/59/48/69/1048594869.db2.gz BUBBKHXZQIIIBM-INIZCTEOSA-N 2 0 341.326 4.267 20 0 EIADRP C[NH+]1CCC2(CCC[N@H+](CCn3ccc4cc(Cl)ccc43)C2)CC1 ZINC000810002024 1048598948 /nfs/dbraw/zinc/59/89/48/1048598948.db2.gz QLOXNTKPSCKRCQ-UHFFFAOYSA-N 2 0 345.918 4.103 20 0 EIADRP Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3ccc(C4([NH3+])CCC4)cc3)c2c1 ZINC001171167581 1048612892 /nfs/dbraw/zinc/61/28/92/1048612892.db2.gz IIVPHKHRCKLYPU-INIZCTEOSA-N 2 0 333.479 4.167 20 0 EIADRP [NH3+]CCCCCC[NH+]1CCC(c2nc3cc(Cl)ccc3o2)CC1 ZINC000846219892 1048844509 /nfs/dbraw/zinc/84/45/09/1048844509.db2.gz BDRDPSHXSKDZGE-UHFFFAOYSA-N 2 0 335.879 4.180 20 0 EIADRP C[N@@H+](Cc1cccc2cccnc21)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000076109860 1048855269 /nfs/dbraw/zinc/85/52/69/1048855269.db2.gz CCESCVNXHYZSKE-HXUWFJFHSA-N 2 0 345.490 4.189 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc3ncccc3c2)CC1 ZINC000134160045 1048888926 /nfs/dbraw/zinc/88/89/26/1048888926.db2.gz QVCQNHPHMVOVSG-UHFFFAOYSA-N 2 0 325.500 4.179 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](c1ccccc1)c1ccc2c(c1)CCCO2 ZINC000817912796 1049059510 /nfs/dbraw/zinc/05/95/10/1049059510.db2.gz XXUJGAVYBGSQDB-VGOFRKELSA-N 2 0 338.495 4.208 20 0 EIADRP c1ccc([C@@H]2CC[C@H]([NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)C2)cc1 ZINC000817913945 1049059958 /nfs/dbraw/zinc/05/99/58/1049059958.db2.gz TWJKWCBTVKPCLY-WKHFQEMYSA-N 2 0 348.490 4.168 20 0 EIADRP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000817947291 1049063129 /nfs/dbraw/zinc/06/31/29/1049063129.db2.gz BJBGXBPUNNCFNG-ZDUSSCGKSA-N 2 0 331.529 4.101 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)ccc1SC(F)F ZINC000817948345 1049064045 /nfs/dbraw/zinc/06/40/45/1049064045.db2.gz YISQGMPNGJVTSY-OUCADQQQSA-N 2 0 344.471 4.049 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(Cl)ccc1OC ZINC000817949934 1049067108 /nfs/dbraw/zinc/06/71/08/1049067108.db2.gz ULGPVYFNQPVYOA-SFHVURJKSA-N 2 0 332.875 4.091 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2cc(Cl)c(N)c(Cl)c2)cc1 ZINC000817963151 1049068384 /nfs/dbraw/zinc/06/83/84/1049068384.db2.gz ORRGITQTQWGEDJ-GHMZBOCLSA-N 2 0 338.282 4.446 20 0 EIADRP COc1c(C)cc([C@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cc1Cl ZINC000817967780 1049071898 /nfs/dbraw/zinc/07/18/98/1049071898.db2.gz BPXLIPONTLTOSM-ZDUSSCGKSA-N 2 0 330.859 4.111 20 0 EIADRP [NH3+]CCc1cc2ccccc2n1-c1ccc2c(c1)nc1cc[nH]cc2-1 ZINC001171304767 1049149873 /nfs/dbraw/zinc/14/98/73/1049149873.db2.gz XQICQOWEZKWOLG-UHFFFAOYSA-N 2 0 326.403 4.161 20 0 EIADRP CCC(CC)[NH+]1CCC([NH2+][C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170910714 1049186385 /nfs/dbraw/zinc/18/63/85/1049186385.db2.gz NRERSHJGMIKKPW-KRWDZBQOSA-N 2 0 334.935 4.440 20 0 EIADRP Fc1ccc2c(NC[C@H]3CC[N@H+](CCc4ccccc4)C3)cc[nH+]c2c1 ZINC000078695520 1049272736 /nfs/dbraw/zinc/27/27/36/1049272736.db2.gz RQLZTUKQILXIOB-GOSISDBHSA-N 2 0 349.453 4.350 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+][C@@H]1CCc2cc(F)cc(F)c2C1)c1ccccc1 ZINC001170657877 1049342579 /nfs/dbraw/zinc/34/25/79/1049342579.db2.gz HICFQHHXLDIOAL-NQIIRXRSSA-N 2 0 344.449 4.105 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]CCOCC[NH2+][C@H](C)c2cc(C)oc2C)c(C)o1 ZINC000348098007 1049416381 /nfs/dbraw/zinc/41/63/81/1049416381.db2.gz XXUGYFGNHLZWOH-HZPDHXFCSA-N 2 0 348.487 4.124 20 0 EIADRP C[C@H](CC[NH2+][C@H]1CCCNc2ccccc21)[N@H+](C)Cc1ccccc1 ZINC000348097585 1049417777 /nfs/dbraw/zinc/41/77/77/1049417777.db2.gz WQQBUJDVEKAHFB-GCJKJVERSA-N 2 0 337.511 4.434 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H](Cc2ccccc2Cl)c2ccoc2)CC1 ZINC000820810349 1049553446 /nfs/dbraw/zinc/55/34/46/1049553446.db2.gz VLIVBTUIBRZEOI-IBGZPJMESA-N 2 0 332.875 4.148 20 0 EIADRP CO[C@H](C[NH2+][C@H](C)c1cccc(C[NH+](C)C)c1)c1ccccc1Cl ZINC000820820745 1049557651 /nfs/dbraw/zinc/55/76/51/1049557651.db2.gz AZRUDBDXTMPIPS-FOIQADDNSA-N 2 0 346.902 4.440 20 0 EIADRP Cc1cc(C[NH+](C)C)cc(N[C@H](C)c2cccc(C[NH+](C)C)c2)c1 ZINC000820836126 1049566114 /nfs/dbraw/zinc/56/61/14/1049566114.db2.gz LESNXDKRCGSSOF-QGZVFWFLSA-N 2 0 325.500 4.291 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc2c(c1)CCO2 ZINC000773101502 1049584441 /nfs/dbraw/zinc/58/44/41/1049584441.db2.gz YYAKJZKQOAELAC-MDMXATFFSA-N 2 0 342.527 4.315 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](C2CC(OCc3ccccc3)C2)CC1 ZINC000821361997 1049628831 /nfs/dbraw/zinc/62/88/31/1049628831.db2.gz BCKCSBZRABEHPQ-UHFFFAOYSA-N 2 0 344.543 4.178 20 0 EIADRP CCC(CC)[NH+]1CCC(C[NH2+][C@H]2CCc3cccc(F)c3C2)CC1 ZINC001170970141 1049674536 /nfs/dbraw/zinc/67/45/36/1049674536.db2.gz KPQQGNHDNHRIEW-SFHVURJKSA-N 2 0 332.507 4.173 20 0 EIADRP C[C@H](C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)CC(F)(F)F ZINC000716680011 1049702345 /nfs/dbraw/zinc/70/23/45/1049702345.db2.gz PKASZECXGJWRAE-DKIMLUQUSA-N 2 0 340.433 4.218 20 0 EIADRP Cc1cccc2c1CC[C@@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001171550179 1049752272 /nfs/dbraw/zinc/75/22/72/1049752272.db2.gz JWLXWLVPTKPJPL-HSZRJFAPSA-N 2 0 348.534 4.354 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc(C(F)(F)F)cc2)CC1(C)C ZINC001171616869 1049766250 /nfs/dbraw/zinc/76/62/50/1049766250.db2.gz CZEMBUKOBPNJGY-UHFFFAOYSA-N 2 0 328.422 4.446 20 0 EIADRP C[NH+]1C(C)(C)CC(NC[C@H](c2ccccc2)[NH+]2CCCC2)CC1(C)C ZINC001171619506 1049766754 /nfs/dbraw/zinc/76/67/54/1049766754.db2.gz NECXGGKIWTUBJM-HXUWFJFHSA-N 2 0 343.559 4.065 20 0 EIADRP COc1ccccc1CC1([NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)CCC1 ZINC001171626909 1049769512 /nfs/dbraw/zinc/76/95/12/1049769512.db2.gz GSDMZEGATOXJFB-UHFFFAOYSA-N 2 0 344.543 4.401 20 0 EIADRP Cc1ccc(OC2CC[NH+](C3CC(C)(C)[NH+](C)C(C)(C)C3)CC2)cc1 ZINC001171635954 1049776746 /nfs/dbraw/zinc/77/67/46/1049776746.db2.gz AJFNDITWTKFJOW-UHFFFAOYSA-N 2 0 344.543 4.490 20 0 EIADRP C[NH+]1C(C)(C)CC([N@@H+]2CCC[C@@H](Sc3ccncc3)C2)CC1(C)C ZINC001171639984 1049778623 /nfs/dbraw/zinc/77/86/23/1049778623.db2.gz XPQDKCGZUGCJEG-GOSISDBHSA-N 2 0 347.572 4.290 20 0 EIADRP C[NH+]1C(C)(C)CC([NH+]2CCC(Sc3ccncc3)CC2)CC1(C)C ZINC001171640034 1049778859 /nfs/dbraw/zinc/77/88/59/1049778859.db2.gz ZWMPKWUURBPJSS-UHFFFAOYSA-N 2 0 347.572 4.290 20 0 EIADRP C[C@@H]([NH3+])Cc1cn([C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171733305 1049786896 /nfs/dbraw/zinc/78/68/96/1049786896.db2.gz QEARQCZLYKTWFO-DBXWQHBBSA-N 2 0 347.506 4.367 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)[C@H]2Cc3cccc(F)c3C2)CC1 ZINC001171786967 1049804882 /nfs/dbraw/zinc/80/48/82/1049804882.db2.gz FVDKOJJFZNUHSV-FHWLQOOXSA-N 2 0 330.491 4.055 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CCc2ccccc2F)CC[N@@H+]1Cc1ccccc1 ZINC001171963275 1049825667 /nfs/dbraw/zinc/82/56/67/1049825667.db2.gz HMSDNDGKMLSGLU-FQEVSTJZSA-N 2 0 340.486 4.401 20 0 EIADRP COc1cccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)c1 ZINC001171962431 1049825778 /nfs/dbraw/zinc/82/57/78/1049825778.db2.gz CYOVIGXDNZBAFR-HXUWFJFHSA-N 2 0 338.495 4.228 20 0 EIADRP CC1(C)C[C@H]([NH+]2CCC[C@@H](C(F)F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171988794 1049831421 /nfs/dbraw/zinc/83/14/21/1049831421.db2.gz VRFUJMDJBBDNMD-QZTJIDSGSA-N 2 0 336.470 4.407 20 0 EIADRP Fc1ccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000245697635 1049831648 /nfs/dbraw/zinc/83/16/48/1049831648.db2.gz LGIYGHUIYIOZNV-DKUWSORSSA-N 2 0 338.470 4.153 20 0 EIADRP C[C@H](CCCC(C)(C)O)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171972622 1049834687 /nfs/dbraw/zinc/83/46/87/1049834687.db2.gz RRDFWUDAAWBPHJ-QUCCMNQESA-N 2 0 346.559 4.349 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@H]2CCCc3ncccc32)CC[N@@H+]1Cc1ccccc1 ZINC001171982336 1049838750 /nfs/dbraw/zinc/83/87/50/1049838750.db2.gz HJOUFBCACLODOJ-KNQAVFIVSA-N 2 0 349.522 4.492 20 0 EIADRP CC1(C)C[C@@H]([NH2+][C@H]2CCCc3cnccc32)CC[N@@H+]1Cc1ccccc1 ZINC001171980487 1049839178 /nfs/dbraw/zinc/83/91/78/1049839178.db2.gz VNXRCFCSOBXWHF-UNMCSNQZSA-N 2 0 349.522 4.492 20 0 EIADRP CC1(C)C[C@H](N2CC[C@@H]([NH3+])c3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC001171984476 1049841094 /nfs/dbraw/zinc/84/10/94/1049841094.db2.gz WBDLPIVSTRLZID-TZIWHRDSSA-N 2 0 349.522 4.340 20 0 EIADRP CCN1CC[C@H]([NH2+]CCC[PH+](C(C)(C)C)C(C)(C)C)CC1=O ZINC001172040561 1049842931 /nfs/dbraw/zinc/84/29/31/1049842931.db2.gz YLPBJHJKPOANTA-HNNXBMFYSA-N 2 0 328.481 4.056 20 0 EIADRP FCC1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172075689 1049843971 /nfs/dbraw/zinc/84/39/71/1049843971.db2.gz SCYLYTZUTRNJBI-WKCHPHFGSA-N 2 0 330.491 4.254 20 0 EIADRP C[N@H+](CCc1ccccn1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172080068 1049846239 /nfs/dbraw/zinc/84/62/39/1049846239.db2.gz SSKHAOUFIRGTJI-JKHIJQBDSA-N 2 0 349.522 4.142 20 0 EIADRP CO[C@H]1CC[C@@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172078804 1049846457 /nfs/dbraw/zinc/84/64/57/1049846457.db2.gz IXJKXAMNDOMHJC-MRWPOJJOSA-N 2 0 342.527 4.119 20 0 EIADRP Cc1ccccc1[C@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccncc1 ZINC001172099946 1049850092 /nfs/dbraw/zinc/85/00/92/1049850092.db2.gz NVKSIITYDMAWCP-XWSHUIEDSA-N 2 0 335.495 4.084 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](NCc1cc(F)c(Cl)cc1Cl)C2 ZINC001172100426 1049850453 /nfs/dbraw/zinc/85/04/53/1049850453.db2.gz QKPBIVHEUBHRJD-CLLJXQQHSA-N 2 0 331.262 4.237 20 0 EIADRP F[C@H]1CC[C@@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172069819 1049852889 /nfs/dbraw/zinc/85/28/89/1049852889.db2.gz XVPIOUWFWIHORO-CZLMFIFXSA-N 2 0 330.491 4.442 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCc3cc(C(F)(F)F)ccc3C1)C2 ZINC001172127996 1049853318 /nfs/dbraw/zinc/85/33/18/1049853318.db2.gz NHDHFFCBBXHHQZ-BCDXTJNWSA-N 2 0 338.417 4.079 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](N[C@H](c1ccccc1)[C@H]([NH3+])c1ccccc1)C2 ZINC001172101589 1049855437 /nfs/dbraw/zinc/85/54/37/1049855437.db2.gz ZQJMJDQJRVPUSB-PFDCGNQRSA-N 2 0 349.522 4.033 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](CC1CCOCC1)c1ccccc1)C2 ZINC001172108402 1049856682 /nfs/dbraw/zinc/85/66/82/1049856682.db2.gz AAORPMLCJSBXIZ-KJJMTIBFSA-N 2 0 342.527 4.149 20 0 EIADRP CC(C)(C)[PH+](CCC[NH2+][C@@H]1CCN2C(=O)CC[C@H]2C1)C(C)(C)C ZINC001172176189 1049862497 /nfs/dbraw/zinc/86/24/97/1049862497.db2.gz UHPDFYPUZUDUPX-CVEARBPZSA-N 2 0 340.492 4.198 20 0 EIADRP c1ccc2c(c1)C[C@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)CS2 ZINC001172203693 1049863745 /nfs/dbraw/zinc/86/37/45/1049863745.db2.gz VDCHGTQUHDFXGG-OALUTQOASA-N 2 0 330.541 4.044 20 0 EIADRP c1ccc2c(c1)C[C@@H]([NH2+]C1CC[NH+](CC3CCCCC3)CC1)CS2 ZINC001172205716 1049864663 /nfs/dbraw/zinc/86/46/63/1049864663.db2.gz WXNBQBGCMKYDED-HXUWFJFHSA-N 2 0 344.568 4.338 20 0 EIADRP C[C@@]12CC3([NH3+])CC([NH2+][C@@H]4CSc5ccccc5C4)(C1)C[C@](C)(C3)C2 ZINC001172205868 1049865030 /nfs/dbraw/zinc/86/50/30/1049865030.db2.gz ZDVAMVSMMWESCX-NENHHDIKSA-N 2 0 342.552 4.123 20 0 EIADRP c1ccc2c(c1)C[C@H]([NH2+]C1CC[NH+](C[C@@H]3CC=CCC3)CC1)CS2 ZINC001172194596 1049868346 /nfs/dbraw/zinc/86/83/46/1049868346.db2.gz VMPIFZKLXLKWKE-XLIONFOSSA-N 2 0 342.552 4.114 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+][C@@H]3COC(C)(C)C3)[C@H](C)C2)CC[C@H]1[NH3+] ZINC001172277475 1049870524 /nfs/dbraw/zinc/87/05/24/1049870524.db2.gz IRTPHJZRARPLHH-PDKYLHCFSA-N 2 0 336.564 4.102 20 0 EIADRP Clc1cccc2c1CC[C@@H]([NH2+]C1CC[NH+](CC3CCC3)CC1)C2 ZINC001171029371 1049874231 /nfs/dbraw/zinc/87/42/31/1049874231.db2.gz HUQFIEPFJUQYEK-GOSISDBHSA-N 2 0 332.919 4.051 20 0 EIADRP CC[C@@H](C)OCC[C@H](C)[N@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172338331 1049888261 /nfs/dbraw/zinc/88/82/61/1049888261.db2.gz YITITDVMSAJPDY-YHELAOLJSA-N 2 0 332.532 4.352 20 0 EIADRP CC[C@@H](C)OCC[C@H](C)[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1 ZINC001172353289 1049893194 /nfs/dbraw/zinc/89/31/94/1049893194.db2.gz MRBISUBCKLSHFM-VQTJNVASSA-N 2 0 344.543 4.178 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1 ZINC001172353287 1049893525 /nfs/dbraw/zinc/89/35/25/1049893525.db2.gz MRBISUBCKLSHFM-PMACEKPBSA-N 2 0 344.543 4.178 20 0 EIADRP CC[C@@H](CC(C)C)[NH+]1CCC2(CC1)C[N@H+](Cc1ccccc1)CCO2 ZINC001172398019 1049907266 /nfs/dbraw/zinc/90/72/66/1049907266.db2.gz MTKKZRKVMGGYMO-NRFANRHFSA-N 2 0 344.543 4.178 20 0 EIADRP CC(C)OCC[C@H](C)[N@@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001172453242 1049916328 /nfs/dbraw/zinc/91/63/28/1049916328.db2.gz FRPUHDBNGXOMTI-RBBKRZOGSA-N 2 0 344.543 4.178 20 0 EIADRP CCCCCC[C@@H](CCCC)[NH+]1CCN(CCC[NH+](C)C)CC1 ZINC001172512589 1049926947 /nfs/dbraw/zinc/92/69/47/1049926947.db2.gz RHEJAMWEIIGDKS-HXUWFJFHSA-N 2 0 325.585 4.085 20 0 EIADRP [NH3+]C1(c2ccc(F)cc2)CC[NH+]([C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172558226 1049932688 /nfs/dbraw/zinc/93/26/88/1049932688.db2.gz UJPXKLNUXKGLRE-NQIIRXRSSA-N 2 0 338.470 4.412 20 0 EIADRP CC1(C)CC([NH2+]C2CC[NH+](C[C@H]3CC=CCC3)CC2)CC(C)(C)O1 ZINC001172654516 1049957138 /nfs/dbraw/zinc/95/71/38/1049957138.db2.gz FGXYRJANJSIAIT-KRWDZBQOSA-N 2 0 334.548 4.133 20 0 EIADRP c1cncc(C[NH+]2CCC(C[NH2+]C3CCC4(CCCC4)CC3)CC2)c1 ZINC001172727766 1049968056 /nfs/dbraw/zinc/96/80/56/1049968056.db2.gz PZIJTQOGUPJQAX-UHFFFAOYSA-N 2 0 341.543 4.386 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@H]1CC2(CCCC2)Oc2ccccc21 ZINC000246431116 1049972060 /nfs/dbraw/zinc/97/20/60/1049972060.db2.gz NYCFYHUGMNNSSP-RWQQGDIJSA-N 2 0 328.500 4.141 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2cccc(Br)c21 ZINC000247003844 1050009671 /nfs/dbraw/zinc/00/96/71/1050009671.db2.gz KVIRHUJTDJHUEY-XNJGSVPQSA-N 2 0 349.316 4.071 20 0 EIADRP CN1CCC[C@H](C[NH2+][C@@H]2CC(C)(C)OC2(C)C)[C@@H]1c1cccs1 ZINC000248132766 1050043574 /nfs/dbraw/zinc/04/35/74/1050043574.db2.gz ORQUBEGJEJNYEE-DJIMGWMZSA-N 2 0 336.545 4.067 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)CCS2 ZINC000248893049 1050083466 /nfs/dbraw/zinc/08/34/66/1050083466.db2.gz ZGNYFVITIOGBBW-APWZRJJASA-N 2 0 348.556 4.190 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(Br)cc1 ZINC000251109882 1050154603 /nfs/dbraw/zinc/15/46/03/1050154603.db2.gz TXOITUSPGAUTNC-IKGGRYGDSA-N 2 0 337.305 4.117 20 0 EIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+][C@@H]3CCC[C@@H](C)CC3)cc2)C[C@H](C)O1 ZINC001177245566 1050172950 /nfs/dbraw/zinc/17/29/50/1050172950.db2.gz XOEYBIJLQXZKNC-NXWNEQKCSA-N 2 0 344.543 4.354 20 0 EIADRP COC(=O)[C@@H]1CCC[C@H]([NH2+]CCCCCCCCCCC[NH3+])CC1 ZINC001172801082 1050173217 /nfs/dbraw/zinc/17/32/17/1050173217.db2.gz UATAXXRWKDLPSM-MOPGFXCFSA-N 2 0 340.552 4.168 20 0 EIADRP C[C@@H]1C[NH+](Cc2ccc(C[NH2+][C@H]3CCC[C@@H](C)CC3)cc2)C[C@@H](C)O1 ZINC001177245567 1050173978 /nfs/dbraw/zinc/17/39/78/1050173978.db2.gz XOEYBIJLQXZKNC-YXTQBTIXSA-N 2 0 344.543 4.354 20 0 EIADRP CC(C)[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccc(F)cc2Cl)[C@@H](C)C1 ZINC001172864992 1050175484 /nfs/dbraw/zinc/17/54/84/1050175484.db2.gz JFLZOMWEYHLLBZ-IYOUNJFTSA-N 2 0 326.887 4.119 20 0 EIADRP CCOc1c(Cl)cccc1C[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC001177299248 1050180796 /nfs/dbraw/zinc/18/07/96/1050180796.db2.gz METZTIGLMJEHSP-MRXNPFEDSA-N 2 0 338.923 4.340 20 0 EIADRP COc1ccc(Cl)cc1C[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC001177278359 1050188680 /nfs/dbraw/zinc/18/86/80/1050188680.db2.gz WNKBRGBRGHBMIT-UHFFFAOYSA-N 2 0 346.902 4.479 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC001172852004 1050190755 /nfs/dbraw/zinc/19/07/55/1050190755.db2.gz MWDOSMKMWVKZIY-CQSZACIVSA-N 2 0 338.898 4.407 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)n1cc(CC[NH3+])c2c[nH+]ccc21 ZINC001172851647 1050191041 /nfs/dbraw/zinc/19/10/41/1050191041.db2.gz KQXBUEMSVUPHHZ-GFCCVEGCSA-N 2 0 331.822 4.134 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@@H](C)Cc2c(F)cccc2Cl)CC1 ZINC001172852051 1050191247 /nfs/dbraw/zinc/19/12/47/1050191247.db2.gz NKUSOZHXFQEUHD-AWEZNQCLSA-N 2 0 326.887 4.120 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)Cc1c(F)cccc1Cl)CC(C)(C)CC[NH3+] ZINC001172852852 1050191440 /nfs/dbraw/zinc/19/14/40/1050191440.db2.gz VRSSJZAIHYVBHR-KGLIPLIRSA-N 2 0 328.903 4.401 20 0 EIADRP C[C@H](C[NH2+]Cc1ccc(-c2ccccc2F)s1)C[NH+]1CCCC1 ZINC001177328927 1050193020 /nfs/dbraw/zinc/19/30/20/1050193020.db2.gz VXYGVEYVVVINDZ-OAHLLOKOSA-N 2 0 332.488 4.376 20 0 EIADRP CCC[NH+]1C[C@@H]2C[NH+]([C@H](C)CSc3ccc(Cl)cc3)C[C@H]2C1 ZINC001172884351 1050226216 /nfs/dbraw/zinc/22/62/16/1050226216.db2.gz BOXRKWBGMOARQJ-BZUAXINKSA-N 2 0 338.948 4.094 20 0 EIADRP CO[C@@H]1CCC[C@H]([N@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172927991 1050238124 /nfs/dbraw/zinc/23/81/24/1050238124.db2.gz IETBPSYETATTOD-XSDIEEQYSA-N 2 0 330.516 4.025 20 0 EIADRP CO[C@@H]1CCC[C@@H]([N@H+]2C[C@H]3c4ccccc4[C@H]([NH+](C)C(C)C)[C@H]3C2)C1 ZINC001172943933 1050242948 /nfs/dbraw/zinc/24/29/48/1050242948.db2.gz VGVRMMORFWDIIV-MLMGXCOMSA-N 2 0 342.527 4.055 20 0 EIADRP CC[C@@H](C[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1 ZINC001177668758 1050274777 /nfs/dbraw/zinc/27/47/77/1050274777.db2.gz CNHNQGRCNOUQAM-VXKWHMMOSA-N 2 0 336.523 4.334 20 0 EIADRP CC[C@@H](C)CN(C)c1ccc(F)cc1C[NH2+]CC1CC[NH+](CC)CC1 ZINC001177737098 1050289264 /nfs/dbraw/zinc/28/92/64/1050289264.db2.gz KNBHLHGWGWOVMJ-QGZVFWFLSA-N 2 0 349.538 4.130 20 0 EIADRP CC(C)[C@H]1C[C@H]([NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)CCO1 ZINC001177742987 1050292108 /nfs/dbraw/zinc/29/21/08/1050292108.db2.gz KBIJZEMOHDVQPY-FGZHOGPDSA-N 2 0 344.543 4.212 20 0 EIADRP CC[NH+](CC)C1CCC(N(CC[NH3+])c2cccc3ccccc32)CC1 ZINC001173105242 1050305035 /nfs/dbraw/zinc/30/50/35/1050305035.db2.gz IUQPBBRZIXCMLI-UHFFFAOYSA-N 2 0 339.527 4.258 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CC[C@H](c3ccccc3OC)C2)CC1 ZINC001173109049 1050306947 /nfs/dbraw/zinc/30/69/47/1050306947.db2.gz VZRIYHKIDAVOMO-VIQWUECVSA-N 2 0 330.516 4.138 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](C)[C@@H](O)c2ccc(Cl)cc2)CC1 ZINC001173107846 1050306982 /nfs/dbraw/zinc/30/69/82/1050306982.db2.gz PILBQJZONHUHNN-YOODTLSXSA-N 2 0 338.923 4.005 20 0 EIADRP CC[NH+](CC)C1CCC(n2c3ccccc3c3c2C[C@H]([NH3+])CC3)CC1 ZINC001173107724 1050307455 /nfs/dbraw/zinc/30/74/55/1050307455.db2.gz KBNCLWHTUGJEMS-WWDZGPRUSA-N 2 0 339.527 4.283 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H]2CCc3ccc(Cl)cc3C2)CC1 ZINC001173107920 1050308199 /nfs/dbraw/zinc/30/81/99/1050308199.db2.gz SCFXENUWNODRSE-GPJFCIFZSA-N 2 0 334.935 4.440 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC3(CC2)OCc2ccccc23)CC1 ZINC001173112150 1050309810 /nfs/dbraw/zinc/30/98/10/1050309810.db2.gz RGLGFRQDFDQUDA-UHFFFAOYSA-N 2 0 342.527 4.161 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C(C)(C)Cc2ccccc2OC)CC1 ZINC001173110956 1050310233 /nfs/dbraw/zinc/31/02/33/1050310233.db2.gz VRWJZEQRHUJVFP-UHFFFAOYSA-N 2 0 332.532 4.259 20 0 EIADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2cc(Cl)ccc2C(F)(F)F)CC1 ZINC001206311255 1050334244 /nfs/dbraw/zinc/33/42/44/1050334244.db2.gz LHWMRYRKLHGIHB-HNNXBMFYSA-N 2 0 334.813 4.310 20 0 EIADRP CCCC[C@H](CC(C)C)n1nc(C[N@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001173262100 1050386496 /nfs/dbraw/zinc/38/64/96/1050386496.db2.gz SEYPIRMKHQGRSG-QGZVFWFLSA-N 2 0 334.552 4.146 20 0 EIADRP C[N@H+](C1CCOCC1)C1CC[NH+]([C@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173344312 1050433794 /nfs/dbraw/zinc/43/37/94/1050433794.db2.gz VAVLZDUYYSAVCA-NRFANRHFSA-N 2 0 348.575 4.455 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC001173540379 1050475764 /nfs/dbraw/zinc/47/57/64/1050475764.db2.gz WMLPRIWYNPAOML-UKRRQHHQSA-N 2 0 329.315 4.388 20 0 EIADRP CC[C@@H]1CCC[C@H]1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC001178748668 1050542502 /nfs/dbraw/zinc/54/25/02/1050542502.db2.gz WDLQUCHGRLPIKM-UXHICEINSA-N 2 0 330.516 4.077 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CS1 ZINC001179278754 1050670849 /nfs/dbraw/zinc/67/08/49/1050670849.db2.gz ZFEDYXIRDIDVRZ-XLIONFOSSA-N 2 0 332.557 4.162 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1ccccc1N(C)C ZINC000093942348 1050723181 /nfs/dbraw/zinc/72/31/81/1050723181.db2.gz KKPAILRFHCQAGF-GOSISDBHSA-N 2 0 339.527 4.444 20 0 EIADRP CCc1ccc(C[NH2+][C@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)o1 ZINC001179771408 1050768211 /nfs/dbraw/zinc/76/82/11/1050768211.db2.gz CNEBXRAPLJGOCQ-AABGKKOBSA-N 2 0 338.495 4.232 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2cccc(O)c2)ccc1OC ZINC000182746817 1050812511 /nfs/dbraw/zinc/81/25/11/1050812511.db2.gz QHTTXKCQQKUQID-INIZCTEOSA-N 2 0 342.483 4.093 20 0 EIADRP CC[NH+](CC)CCO[C@H]1CC[N@H+](C/C=C/c2cc(C)c(C)cc2C)C1 ZINC001180081740 1050877120 /nfs/dbraw/zinc/87/71/20/1050877120.db2.gz NLLAXUWXTMNCQD-UVIRAJKCSA-N 2 0 344.543 4.058 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cc3c(cccc3O)s2)CC1 ZINC001180124878 1050892961 /nfs/dbraw/zinc/89/29/61/1050892961.db2.gz NQRQACVQQWCVDD-UHFFFAOYSA-N 2 0 332.513 4.161 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCCSC)cc1C[NH+]1CCCCC1 ZINC000182993564 1050926800 /nfs/dbraw/zinc/92/68/00/1050926800.db2.gz LOJJKYWDOSDGMM-MRXNPFEDSA-N 2 0 336.545 4.085 20 0 EIADRP CO[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC001180350280 1050965057 /nfs/dbraw/zinc/96/50/57/1050965057.db2.gz XOTYMGOJWPLFAR-YUXAGFNASA-N 2 0 344.543 4.082 20 0 EIADRP C[C@H]1CCCc2ccccc2[C@@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC001180622196 1051041557 /nfs/dbraw/zinc/04/15/57/1051041557.db2.gz CLRFXDOFHRPPFK-HTAPYJJXSA-N 2 0 335.495 4.354 20 0 EIADRP CC(C)(C)[C@@]1(C[N@@H+]2CCCSCC2)CC[NH+](Cc2ccccc2)C1 ZINC001180739737 1051071148 /nfs/dbraw/zinc/07/11/48/1051071148.db2.gz GVIAHDHXLKCABX-OAQYLSRUSA-N 2 0 346.584 4.364 20 0 EIADRP C[C@H](CCC1CCCCC1)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@@H](O)C1 ZINC001180802467 1051088152 /nfs/dbraw/zinc/08/81/52/1051088152.db2.gz QWLFDKWMGRIRJH-XMSQKQJNSA-N 2 0 344.543 4.092 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@H](C)Cc2ccco2)ccc1OC ZINC000775365987 1051134903 /nfs/dbraw/zinc/13/49/03/1051134903.db2.gz RTAJJTMJTSOFIH-SJORKVTESA-N 2 0 344.499 4.412 20 0 EIADRP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1cnc2ccccc2c1 ZINC000775367594 1051137894 /nfs/dbraw/zinc/13/78/94/1051137894.db2.gz WYJLJVVKAFICQP-UHFFFAOYSA-N 2 0 325.500 4.369 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ccc(C)nc2)ccc1OC ZINC000775377075 1051157084 /nfs/dbraw/zinc/15/70/84/1051157084.db2.gz FZKKQEUTFMSUCI-QGZVFWFLSA-N 2 0 341.499 4.091 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCCc2cc(SC(F)F)ccc21 ZINC000775380437 1051175311 /nfs/dbraw/zinc/17/53/11/1051175311.db2.gz IPQFGRPCLISZLH-MLGOLLRUSA-N 2 0 328.472 4.309 20 0 EIADRP CC[NH+](CC)CCC[N@H+](Cc1ccc(Br)cc1)C(C)C ZINC001190509630 1051198323 /nfs/dbraw/zinc/19/83/23/1051198323.db2.gz GPESDWQPTXKUOA-UHFFFAOYSA-N 2 0 341.337 4.391 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)[C@@H]1CC1(C)C ZINC001181656159 1051270911 /nfs/dbraw/zinc/27/09/11/1051270911.db2.gz PJGHGOIWTFLYIA-PMACEKPBSA-N 2 0 330.516 4.074 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+]CCc2ccc3ccccc3c2)cc1 ZINC000620756323 1051275119 /nfs/dbraw/zinc/27/51/19/1051275119.db2.gz KEGOJWAJYICUEA-UHFFFAOYSA-N 2 0 348.490 4.113 20 0 EIADRP C[C@@H](C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)c1ccccc1 ZINC000716654490 1051276980 /nfs/dbraw/zinc/27/69/80/1051276980.db2.gz HYVSFXPFRWMOLX-HMNCIZAVSA-N 2 0 334.507 4.433 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@@H]2CCC[C@@H]2OC)ccc1OC ZINC000775416050 1051289228 /nfs/dbraw/zinc/28/92/28/1051289228.db2.gz CWDTYNUTRUWUJF-QRFRQXIXSA-N 2 0 348.531 4.003 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](CCc2cccc(F)c2)CC1 ZINC001191550812 1051486949 /nfs/dbraw/zinc/48/69/49/1051486949.db2.gz MFFWAIPPKWYRLV-SFHVURJKSA-N 2 0 332.507 4.345 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H]2CCc3[nH]c4ccc(Cl)cc4c3C2)CC1 ZINC001182555815 1051629480 /nfs/dbraw/zinc/62/94/80/1051629480.db2.gz RYUSPXTULILRGR-INIZCTEOSA-N 2 0 345.918 4.000 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1cnc2ccsc2c1 ZINC000158195384 1051724404 /nfs/dbraw/zinc/72/44/04/1051724404.db2.gz XQWFVUQCIQQDJO-INIZCTEOSA-N 2 0 331.529 4.459 20 0 EIADRP CC(C)[N@@H+]1CC[C@H]1C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C ZINC001182871861 1051725896 /nfs/dbraw/zinc/72/58/96/1051725896.db2.gz WFVMFXNTZNBTSN-HNNXBMFYSA-N 2 0 328.481 4.054 20 0 EIADRP CC[N@H+](CCC1CC[NH+](C[C@H](O)c2ccc(C)cc2)CC1)CC(C)C ZINC001192491050 1051745404 /nfs/dbraw/zinc/74/54/04/1051745404.db2.gz ZEAMAVZMBAOGCP-QFIPXVFZSA-N 2 0 346.559 4.108 20 0 EIADRP C[C@@H]1CC[N@H+](Cc2cccc(C(F)(F)F)c2Cl)CC[C@@H]1C[NH3+] ZINC001205602231 1051756147 /nfs/dbraw/zinc/75/61/47/1051756147.db2.gz HUAYSQCOFGMPIQ-VXGBXAGGSA-N 2 0 334.813 4.166 20 0 EIADRP Fc1ccc(C2=CC[C@@H]([NH2+]CC3CC[NH+](CC4CC4)CC3)CC2)cc1 ZINC001183074707 1051774662 /nfs/dbraw/zinc/77/46/62/1051774662.db2.gz JWPZVJLUEISGAY-JOCHJYFZSA-N 2 0 342.502 4.473 20 0 EIADRP CSC1(C[NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CCC1 ZINC001183146613 1051792316 /nfs/dbraw/zinc/79/23/16/1051792316.db2.gz XZWXAPYCXBHKPC-UHFFFAOYSA-N 2 0 332.557 4.164 20 0 EIADRP COc1cc2ccccc2cc1CN1CCC(C)([NH+]2CCCC2)CC1 ZINC001183227575 1051809235 /nfs/dbraw/zinc/80/92/35/1051809235.db2.gz UHEWSXSQPSYIRK-UHFFFAOYSA-N 2 0 338.495 4.299 20 0 EIADRP Cc1cc(C)cc(C[NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)c1 ZINC000716715832 1051831283 /nfs/dbraw/zinc/83/12/83/1051831283.db2.gz YCFMFOGATKESSX-ZRBLBEILSA-N 2 0 334.507 4.446 20 0 EIADRP C[N@H+]1Cc2c(Nc3ccc(C[NH3+])cc3)cccc2[C@@H](c2ccccc2)C1 ZINC001175971774 1051854176 /nfs/dbraw/zinc/85/41/76/1051854176.db2.gz OPKOCWNFZZHHKG-OAQYLSRUSA-N 2 0 343.474 4.466 20 0 EIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001193091731 1051874695 /nfs/dbraw/zinc/87/46/95/1051874695.db2.gz BHDIIDPAQQWFPA-CYGODWOOSA-N 2 0 347.506 4.414 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001193249483 1051890967 /nfs/dbraw/zinc/89/09/67/1051890967.db2.gz NAPLJYBWCOVLHG-HOCLYGCPSA-N 2 0 338.442 4.031 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CC(C)(C)C3CCOCC3)CC2)C1 ZINC001184046474 1051943664 /nfs/dbraw/zinc/94/36/64/1051943664.db2.gz VVWBLVSLFKLBMU-YLJYHZDGSA-N 2 0 336.564 4.072 20 0 EIADRP C[C@H]1CCCC[C@@H]1C[N@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176263196 1051986584 /nfs/dbraw/zinc/98/65/84/1051986584.db2.gz QYJJLQWTRJERCO-PDGJWGCVSA-N 2 0 326.528 4.267 20 0 EIADRP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CCCNc1ccccn1 ZINC000163841325 1052008598 /nfs/dbraw/zinc/00/85/98/1052008598.db2.gz KDNDSQRYXHSNQI-ZDUSSCGKSA-N 2 0 332.517 4.297 20 0 EIADRP CC(C)C[C@@H](C)C[C@H](C)[NH2+]CCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001184417525 1052009070 /nfs/dbraw/zinc/00/90/70/1052009070.db2.gz FJAXIIRAMSJWNT-UXHICEINSA-N 2 0 345.575 4.031 20 0 EIADRP Cc1nccn1CCCC[NH2+][C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000164696863 1052036936 /nfs/dbraw/zinc/03/69/36/1052036936.db2.gz GANOEQXCNQOOJL-HNNXBMFYSA-N 2 0 340.496 4.446 20 0 EIADRP C[N@@H+]1CC[C@]2(C1)CCC[NH+](CCCc1ccc(C(F)(F)F)cc1)C2 ZINC001194505163 1052162389 /nfs/dbraw/zinc/16/23/89/1052162389.db2.gz LPCUOZOSZNNFBC-SFHVURJKSA-N 2 0 340.433 4.056 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cc2ccccc2cc1OC ZINC001177093053 1052229104 /nfs/dbraw/zinc/22/91/04/1052229104.db2.gz NNRZOOCNMWJQNS-QGZVFWFLSA-N 2 0 328.500 4.449 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cc(C)cc(Br)c2)C[C@@H]1C ZINC000774903345 1052269305 /nfs/dbraw/zinc/26/93/05/1052269305.db2.gz MKSNUMMUCOJKBU-WMLDXEAASA-N 2 0 339.321 4.062 20 0 EIADRP CC(C)([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccccc1 ZINC000622854934 1052504570 /nfs/dbraw/zinc/50/45/70/1052504570.db2.gz HCRHMGMCXQEMGS-UHFFFAOYSA-N 2 0 338.495 4.186 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000339069032 1052551732 /nfs/dbraw/zinc/55/17/32/1052551732.db2.gz QJXPYHUQLBFOPO-SVFBPWRDSA-N 2 0 330.516 4.008 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)C1 ZINC000339069043 1052552188 /nfs/dbraw/zinc/55/21/88/1052552188.db2.gz QMTQCNBNPDQVNN-SJBKTWHCSA-N 2 0 344.543 4.256 20 0 EIADRP COc1cc([C@@H](C)N[C@H]2CC[N@H+](C)C(C)(C)C2)ccc1OC(C)C ZINC000623349599 1052629740 /nfs/dbraw/zinc/62/97/40/1052629740.db2.gz GFVBJKDFFPRKOM-WBVHZDCISA-N 2 0 334.504 4.006 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cccc3n[nH]cc32)cc1 ZINC000623357509 1052632417 /nfs/dbraw/zinc/63/24/17/1052632417.db2.gz SQSUXTHUOMPMIB-KRWDZBQOSA-N 2 0 348.494 4.227 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623382628 1052640431 /nfs/dbraw/zinc/64/04/31/1052640431.db2.gz NQGYSOUHKZLTGJ-BBRMVZONSA-N 2 0 328.422 4.099 20 0 EIADRP C[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccc(C(F)(F)F)cc3)CC2)CC1(C)C ZINC000623502764 1052668090 /nfs/dbraw/zinc/66/80/90/1052668090.db2.gz ZROXQPHMMZGAQL-MRXNPFEDSA-N 2 0 340.433 4.199 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(Oc2cccnc2)cc1 ZINC000623526033 1052672412 /nfs/dbraw/zinc/67/24/12/1052672412.db2.gz HTSDRMDCLTWKJB-FUHWJXTLSA-N 2 0 339.483 4.397 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@@H](C)[C@H](C)c2nc3ccccc3s2)CC1 ZINC000177836388 1052691458 /nfs/dbraw/zinc/69/14/58/1052691458.db2.gz MDUOHUVGOKYRQE-HOTGVXAUSA-N 2 0 345.556 4.498 20 0 EIADRP Cc1ccc(C(C)(C)C[NH2+]C2CC[NH+](C3CCCCC3)CC2)nc1 ZINC000623649504 1052696068 /nfs/dbraw/zinc/69/60/68/1052696068.db2.gz XMZFYAAONQTKLM-UHFFFAOYSA-N 2 0 329.532 4.054 20 0 EIADRP C[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000178087758 1052698024 /nfs/dbraw/zinc/69/80/24/1052698024.db2.gz FSEGMWQZFVOECQ-BTYIYWSLSA-N 2 0 342.458 4.104 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCCc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000178094519 1052699079 /nfs/dbraw/zinc/69/90/79/1052699079.db2.gz MDLFTGQJQCFNAL-HTAPYJJXSA-N 2 0 338.495 4.355 20 0 EIADRP C[C@H]([NH2+][C@@H](c1ccccc1)C1CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000178493839 1052707186 /nfs/dbraw/zinc/70/71/86/1052707186.db2.gz MBQUIRYGOZXBLS-JTSKRJEESA-N 2 0 338.495 4.429 20 0 EIADRP Cc1csc([C@H](C)[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)n1 ZINC000623924197 1052839053 /nfs/dbraw/zinc/83/90/53/1052839053.db2.gz VLRCZIRXESRYOW-LNLFQRSKSA-N 2 0 343.540 4.403 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]C[C@H]1CCCC[N@H+](C)C1 ZINC000624121279 1052867187 /nfs/dbraw/zinc/86/71/87/1052867187.db2.gz SCYUWCGFGVJXEN-OWCLPIDISA-N 2 0 331.529 4.110 20 0 EIADRP CCC(F)(F)C(C)(C)C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000624155000 1052869590 /nfs/dbraw/zinc/86/95/90/1052869590.db2.gz CFMKVZITYHUVSW-HNNXBMFYSA-N 2 0 342.474 4.349 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCc2csc(-c3ccc(Cl)cc3)n2)CC[N@@H+]1C ZINC000181798891 1052898423 /nfs/dbraw/zinc/89/84/23/1052898423.db2.gz KQODMOVTXGVFBR-CJNGLKHVSA-N 2 0 349.931 4.078 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CCc2csc(-c3ccc(Cl)cc3)n2)CC[N@@H+]1C ZINC000181798849 1052898533 /nfs/dbraw/zinc/89/85/33/1052898533.db2.gz KQODMOVTXGVFBR-CZUORRHYSA-N 2 0 349.931 4.078 20 0 EIADRP FC(F)(F)c1cccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000381184595 1053057427 /nfs/dbraw/zinc/05/74/27/1053057427.db2.gz LMHMFXSTXULEEL-SFHVURJKSA-N 2 0 348.412 4.317 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000381210906 1053058783 /nfs/dbraw/zinc/05/87/83/1053058783.db2.gz UMPYGVHSJCBSQG-FGSXEWAUSA-N 2 0 338.495 4.084 20 0 EIADRP Cc1ccc2cc(C[NH2+]C3CCC([NH+]4CCCCC4)CC3)[nH]c2c1 ZINC000850179329 1053082679 /nfs/dbraw/zinc/08/26/79/1053082679.db2.gz XKPFROKKRNOUMD-UHFFFAOYSA-N 2 0 325.500 4.363 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1cnn(-c2ccccc2)c1C ZINC000764435653 1053103501 /nfs/dbraw/zinc/10/35/01/1053103501.db2.gz RVLITPUAELMEAF-MSOLQXFVSA-N 2 0 342.531 4.342 20 0 EIADRP Cc1ccc(C[NH+](C)C)cc1N[C@@H](C)c1cccc(C[NH+](C)C)c1 ZINC000864005587 1053123977 /nfs/dbraw/zinc/12/39/77/1053123977.db2.gz CDTBKELESVDUKW-KRWDZBQOSA-N 2 0 325.500 4.291 20 0 EIADRP CO[C@@H](C)C[N@@H+]1CCCCC[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001194940899 1053190841 /nfs/dbraw/zinc/19/08/41/1053190841.db2.gz CZCUHPVLRNEPBN-SIKLNZKXSA-N 2 0 344.543 4.178 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc2c(c1)CCCO2 ZINC000850436295 1053211590 /nfs/dbraw/zinc/21/15/90/1053211590.db2.gz TUCJHSBLUMMQSA-OAHLLOKOSA-N 2 0 342.458 4.063 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc2c(c1)CCCO2 ZINC000850440024 1053214216 /nfs/dbraw/zinc/21/42/16/1053214216.db2.gz RNSHLZCYVKEMBB-MRXNPFEDSA-N 2 0 328.500 4.069 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@@]2(C)CC2(F)F)ccc1OC ZINC000850536859 1053301619 /nfs/dbraw/zinc/30/16/19/1053301619.db2.gz OIFQRZBCIHYKGG-KBXCAEBGSA-N 2 0 340.458 4.233 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)C1 ZINC000339070112 1053319931 /nfs/dbraw/zinc/31/99/31/1053319931.db2.gz WPWCKUPRTRSTIP-DYQZNNLLSA-N 2 0 344.543 4.112 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000383360170 1053329329 /nfs/dbraw/zinc/32/93/29/1053329329.db2.gz SHQAORAQKSFPSW-RDJZCZTQSA-N 2 0 330.422 4.138 20 0 EIADRP COc1ccc(CC[C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000764961020 1053399709 /nfs/dbraw/zinc/39/97/09/1053399709.db2.gz GJEVUWXMXUFTJL-RTBURBONSA-N 2 0 332.532 4.118 20 0 EIADRP CSCC1CCC([NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000385424947 1053522835 /nfs/dbraw/zinc/52/28/35/1053522835.db2.gz LCMVAGVBCYGMHR-AFVILVPDSA-N 2 0 346.584 4.408 20 0 EIADRP C[C@H](CSC(C)(C)C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000765502624 1053580973 /nfs/dbraw/zinc/58/09/73/1053580973.db2.gz MUZXOAOHJKQQKQ-OAHLLOKOSA-N 2 0 340.602 4.470 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](c2ccccn2)C(C)C)cc1 ZINC000866219473 1053654983 /nfs/dbraw/zinc/65/49/83/1053654983.db2.gz PGQHNFRVJCXAEZ-NRFANRHFSA-N 2 0 325.500 4.410 20 0 EIADRP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)CCc1cccnc1 ZINC000866233189 1053657903 /nfs/dbraw/zinc/65/79/03/1053657903.db2.gz SGRDREPNVNFFFO-SFHVURJKSA-N 2 0 325.500 4.033 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2cc3c(ccnc3Cl)o2)CC1 ZINC000866258803 1053667477 /nfs/dbraw/zinc/66/74/77/1053667477.db2.gz BDXDDARHLUFTJY-ZDUSSCGKSA-N 2 0 335.879 4.254 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CC[C@@H]2CCSC2)CC1 ZINC000866402255 1053714860 /nfs/dbraw/zinc/71/48/60/1053714860.db2.gz ISFCSLZUDDYPBF-XEVCZEQESA-N 2 0 332.557 4.162 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000866516661 1053764573 /nfs/dbraw/zinc/76/45/73/1053764573.db2.gz RWRZWJWUYPESLZ-PPXMBRMGSA-N 2 0 330.516 4.007 20 0 EIADRP Cc1c([C@H](C)[NH2+]CCCCNc2ccccn2)cnn1-c1ccccc1 ZINC000765678250 1053836903 /nfs/dbraw/zinc/83/69/03/1053836903.db2.gz UIPQETLOCGESHI-KRWDZBQOSA-N 2 0 349.482 4.119 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CC[C@H]2CC2(Cl)Cl)CC1 ZINC000857064915 1054169846 /nfs/dbraw/zinc/16/98/46/1054169846.db2.gz GEJNDEKAJRIHOY-IJEWVQPXSA-N 2 0 333.347 4.203 20 0 EIADRP Cc1nccn1C[C@H](C)C[NH2+][C@H]1CCC[C@@H]1c1ccccc1Cl ZINC000542667111 1054178858 /nfs/dbraw/zinc/17/88/58/1054178858.db2.gz WYFZVZWIYUGQNX-BJZITVGISA-N 2 0 331.891 4.407 20 0 EIADRP CC[C@H](CCC(F)(F)F)[NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC000872082696 1054383002 /nfs/dbraw/zinc/38/30/02/1054383002.db2.gz ZUBKGWYSNOZCGB-ZACQAIPSSA-N 2 0 328.422 4.043 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc3ccc(F)c(F)c3n2)C1 ZINC001199344869 1054388658 /nfs/dbraw/zinc/38/86/58/1054388658.db2.gz LSFOQKLXGCJHPL-HNNXBMFYSA-N 2 0 347.453 4.115 20 0 EIADRP CC(C)Cc1ncc(C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC001199319960 1054390194 /nfs/dbraw/zinc/39/01/94/1054390194.db2.gz GIRMPLDZZQFKRL-CALCHBBNSA-N 2 0 337.577 4.189 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]C[C@H]1CCCC[C@H]1C ZINC001199329505 1054391993 /nfs/dbraw/zinc/39/19/93/1054391993.db2.gz UFZNKQAFFSCIME-RTBURBONSA-N 2 0 332.532 4.323 20 0 EIADRP [NH3+][C@H](C[C@@H]1CCC[N@H+](Cc2csc(C3CC3)n2)C1)C1CCCC1 ZINC000872156693 1054411935 /nfs/dbraw/zinc/41/19/35/1054411935.db2.gz LFYVEBYXQZGNLJ-KBXCAEBGSA-N 2 0 333.545 4.140 20 0 EIADRP C[C@@H](C[NH2+]Cc1ccc2c(c1)CCC(C)(C)O2)C[NH+]1CCCCC1 ZINC001199582515 1054426217 /nfs/dbraw/zinc/42/62/17/1054426217.db2.gz OJTZICRQCAUFNI-KRWDZBQOSA-N 2 0 330.516 4.002 20 0 EIADRP CC(C)(C)[C@@H](Cn1ccnc1)[NH2+]Cc1cccc(-c2ccccn2)c1 ZINC001199608475 1054432226 /nfs/dbraw/zinc/43/22/26/1054432226.db2.gz HQMYIPIYBRMYQE-HXUWFJFHSA-N 2 0 334.467 4.150 20 0 EIADRP COc1ccc(CC[C@@H](C)[NH2+]CC(C)(C)[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001199760308 1054463798 /nfs/dbraw/zinc/46/37/98/1054463798.db2.gz PSZOPWJJRUCZSB-CEXWTWQISA-N 2 0 346.559 4.362 20 0 EIADRP CCCC1CCC(C[NH2+]Cc2ccccc2OCC[NH+](C)C)CC1 ZINC001199822679 1054480593 /nfs/dbraw/zinc/48/05/93/1054480593.db2.gz KGRPBVUVRFDMPH-UHFFFAOYSA-N 2 0 332.532 4.323 20 0 EIADRP C[C@@]1(CN[C@@H]2CCCc3scnc32)CC[N@H+](Cc2ccccc2)C1 ZINC000858414666 1054485484 /nfs/dbraw/zinc/48/54/84/1054485484.db2.gz FWWSCRMYXDMFKV-XLIONFOSSA-N 2 0 341.524 4.022 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CC(C)(C)C[C@H]3C)CC2)cc1 ZINC001199883382 1054490908 /nfs/dbraw/zinc/49/09/08/1054490908.db2.gz JATRSYMPUHYAAI-DYESRHJHSA-N 2 0 344.543 4.322 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CC(C)(C)C[C@@H]3C)CC2)cc1 ZINC001199883389 1054491493 /nfs/dbraw/zinc/49/14/93/1054491493.db2.gz JATRSYMPUHYAAI-UWJYYQICSA-N 2 0 344.543 4.322 20 0 EIADRP c1cc(-c2nc(C[NH2+][C@@H]3CCCCC34CC[NH2+]CC4)cs2)cs1 ZINC000873232597 1054510508 /nfs/dbraw/zinc/51/05/08/1054510508.db2.gz IEKUEMJXAACJLL-MRXNPFEDSA-N 2 0 347.553 4.274 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873268776 1054518467 /nfs/dbraw/zinc/51/84/67/1054518467.db2.gz ZWPWUYZIVMODNI-OLZOCXBDSA-N 2 0 347.503 4.296 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2c[nH]c3ccc(F)cc32)CC1 ZINC000347536462 1054534238 /nfs/dbraw/zinc/53/42/38/1054534238.db2.gz HYJJZXMJOPNMNW-GOSISDBHSA-N 2 0 343.490 4.361 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2ccccc2OCC2CC2)CC1 ZINC001200872276 1054563065 /nfs/dbraw/zinc/56/30/65/1054563065.db2.gz LRHOQEZXCJZPTG-UHFFFAOYSA-N 2 0 344.543 4.323 20 0 EIADRP CN(Cc1ccc(C[NH+](C)C)cc1)Cc1nc(Cl)ccc1Cl ZINC000859212408 1054643543 /nfs/dbraw/zinc/64/35/43/1054643543.db2.gz JDTFZXZPRQDPHH-UHFFFAOYSA-N 2 0 338.282 4.082 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2cccc(C)c2C)cc1 ZINC000061051389 1054739395 /nfs/dbraw/zinc/73/93/95/1054739395.db2.gz QZIQGPTTYGJUDL-UHFFFAOYSA-N 2 0 340.511 4.314 20 0 EIADRP C[N@H+](Cc1ccncc1)C1CC2(C1)CC[NH+](C[C@@H]1CC=CCC1)CC2 ZINC001201410351 1054803328 /nfs/dbraw/zinc/80/33/28/1054803328.db2.gz JNPWZSICIFPOQF-LJQANCHMSA-N 2 0 339.527 4.114 20 0 EIADRP Cc1ccc2[nH+]c(N)n(C3=C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)c2c1 ZINC001201470247 1054813801 /nfs/dbraw/zinc/81/38/01/1054813801.db2.gz PBYHGKIRHOYYOC-MSOLQXFVSA-N 2 0 344.462 4.205 20 0 EIADRP CCC(CC)C[NH+]1CCC2(C[C@H]([N@H+](C)Cc3ccccc3)CO2)CC1 ZINC001201525630 1054844094 /nfs/dbraw/zinc/84/40/94/1054844094.db2.gz IGBXOONESOEJPU-NRFANRHFSA-N 2 0 344.543 4.178 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001201609247 1054863696 /nfs/dbraw/zinc/86/36/96/1054863696.db2.gz FEKULCPALOKNJL-PKTZIBPZSA-N 2 0 334.507 4.073 20 0 EIADRP CC(C)Sc1ccccc1Nc1cc[nH+]c(N2CC[NH+](C)CC2)c1 ZINC001201667224 1054871048 /nfs/dbraw/zinc/87/10/48/1054871048.db2.gz NZPMLJBACKPGJN-UHFFFAOYSA-N 2 0 342.512 4.078 20 0 EIADRP c1ccc(CCC[N@@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@@H]3C2)cc1 ZINC001201672753 1054873012 /nfs/dbraw/zinc/87/30/12/1054873012.db2.gz XEWPHMPDEHYQPR-GOTSBHOMSA-N 2 0 334.507 4.073 20 0 EIADRP CSCCC[N@@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3cccs3)[C@@H]2C1 ZINC001201680820 1054875149 /nfs/dbraw/zinc/87/51/49/1054875149.db2.gz ODLXIDZCYDFOOY-CGTJXYLNSA-N 2 0 338.586 4.034 20 0 EIADRP C[C@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccncc1 ZINC000671750049 1054961850 /nfs/dbraw/zinc/96/18/50/1054961850.db2.gz OENDJDXHKZOCNO-OSFYOIPJSA-N 2 0 337.511 4.218 20 0 EIADRP COc1ccc2cc(C[NH2+]CC[C@H](C)[NH+]3CCCCC3)ccc2c1 ZINC001201963522 1054969988 /nfs/dbraw/zinc/96/99/88/1054969988.db2.gz SWCHPIZFWICYRN-KRWDZBQOSA-N 2 0 326.484 4.203 20 0 EIADRP COc1ccc(C)cc1C[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000065976553 1054980735 /nfs/dbraw/zinc/98/07/35/1054980735.db2.gz SUEBEZJMMFGPRQ-UHFFFAOYSA-N 2 0 326.484 4.134 20 0 EIADRP COCCC1(C[NH2+]C[C@H]2CCC[N@@H+]2C2CCCCC2)CCCCC1 ZINC001202185182 1055074903 /nfs/dbraw/zinc/07/49/03/1055074903.db2.gz ZHKWOSDFBULDCF-HXUWFJFHSA-N 2 0 336.564 4.360 20 0 EIADRP C[C@H]([NH2+]CC1(c2ccccc2)CC[NH+](C)CC1)c1cc2cnccc2o1 ZINC000877718579 1055112007 /nfs/dbraw/zinc/11/20/07/1055112007.db2.gz NATLYMPONMPCQI-KRWDZBQOSA-N 2 0 349.478 4.142 20 0 EIADRP CC(C)(C)Oc1cccc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000877808288 1055125980 /nfs/dbraw/zinc/12/59/80/1055125980.db2.gz XTRXHBFRBFGYLK-UHFFFAOYSA-N 2 0 339.483 4.018 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@@H+]2C)ccc1OCCC(C)C ZINC001168604129 1055151427 /nfs/dbraw/zinc/15/14/27/1055151427.db2.gz KYBQANZSVTWHHW-MJGOQNOKSA-N 2 0 348.531 4.255 20 0 EIADRP CC(C)[PH+](CC[NH2+][C@@H]1C[C@H](C)N(C(=O)OC(C)(C)C)C1)C(C)C ZINC001168840872 1060450546 /nfs/dbraw/zinc/45/05/46/1060450546.db2.gz WGEDFIZHXMPYHB-JKSUJKDBSA-N 2 0 344.480 4.273 20 0 EIADRP CCCCCC(C)(C)C[NH2+][C@H]1CCN(Cc2ccccn2)C[C@@H]1C ZINC000766551975 1060535467 /nfs/dbraw/zinc/53/54/67/1060535467.db2.gz XKBKIGQEUNBZDS-ICSRJNTNSA-N 2 0 331.548 4.488 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@H]1CCCc3c(Br)cccc31)C2 ZINC001169118260 1060646952 /nfs/dbraw/zinc/64/69/52/1060646952.db2.gz GEZJYGDACRZKHT-FLTUCWPJSA-N 2 0 349.316 4.041 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C(C)(C)Cc1ccccc1C(F)(F)F)C2 ZINC001169119391 1060647797 /nfs/dbraw/zinc/64/77/97/1060647797.db2.gz SIVRZKFGCRUFFF-MUJYYYPQSA-N 2 0 340.433 4.241 20 0 EIADRP CC1(C)C[C@@H](Nc2cc(N3CCCCC3)cc[nH+]2)C[C@](C)(C[NH3+])C1 ZINC001169147494 1060666235 /nfs/dbraw/zinc/66/62/35/1060666235.db2.gz XBRIIXYKLIQNTE-UZLBHIALSA-N 2 0 330.520 4.028 20 0 EIADRP Cc1ccc2c(c1)c(C1CC[NH2+]CC1)cn2[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169152675 1060670894 /nfs/dbraw/zinc/67/08/94/1060670894.db2.gz DFTOVYDWPSHTDL-BWTSREIZSA-N 2 0 337.511 4.214 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC(Cc3cnc4ccccc4c3)CC1)C2 ZINC001169160035 1060672576 /nfs/dbraw/zinc/67/25/76/1060672576.db2.gz AKXPXKUMCRCEOF-ZBYYUNFXSA-N 2 0 349.522 4.115 20 0 EIADRP C[C@@H](c1cccc(Br)c1)[N@H+](C)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169162477 1060673966 /nfs/dbraw/zinc/67/39/66/1060673966.db2.gz TZKBJVHQKJIXTQ-KKBVYLPWSA-N 2 0 337.305 4.067 20 0 EIADRP CCN1CCC([NH2+][C@@H]2CC[C@H](C[C@@H]3CC[C@H]([NH3+])[C@@H](C)C3)C[C@H]2C)CC1 ZINC001169233952 1060706438 /nfs/dbraw/zinc/70/64/38/1060706438.db2.gz YRCMSQTYZSKORT-TVASPAASSA-N 2 0 349.607 4.019 20 0 EIADRP Cc1cc(C[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)c(C)o1 ZINC000767352836 1061208757 /nfs/dbraw/zinc/20/87/57/1061208757.db2.gz KYYKMLQJJWQBMW-UHFFFAOYSA-N 2 0 326.484 4.418 20 0 EIADRP CC[NH+](CC)Cc1cccc(NC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000297885466 520758259 /nfs/dbraw/zinc/75/82/59/520758259.db2.gz QRDKSVBCYUUKIT-UHFFFAOYSA-N 2 0 338.499 4.004 20 0 EIADRP Cc1cc(C)c(C[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)c(C)c1 ZINC000532222170 1032099736 /nfs/dbraw/zinc/09/97/36/1032099736.db2.gz WYMHFBZMOKHNTF-IBGZPJMESA-N 2 0 340.511 4.403 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2ccc3c(c2)CC(C)(C)O3)CC1 ZINC000729678913 1032125926 /nfs/dbraw/zinc/12/59/26/1032125926.db2.gz WSWZZYCTJCRYET-UHFFFAOYSA-N 2 0 330.516 4.002 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Sc3ccccc3)cc2)CC[N@@H+]1C ZINC000532804314 1032322386 /nfs/dbraw/zinc/32/23/86/1032322386.db2.gz BEVNNXQPISFUKI-AEFFLSMTSA-N 2 0 326.509 4.410 20 0 EIADRP COc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000120962754 1032481918 /nfs/dbraw/zinc/48/19/18/1032481918.db2.gz GALUBXHGKVBCNC-NRFANRHFSA-N 2 0 342.458 4.063 20 0 EIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)CCC3=CCCCC3)CC2)CC1 ZINC000450475979 1032521820 /nfs/dbraw/zinc/52/18/20/1032521820.db2.gz LYKYFAAXAKSUNV-UHFFFAOYSA-N 2 0 347.591 4.005 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1ccnn1C1CCC1 ZINC000925229959 1032596175 /nfs/dbraw/zinc/59/61/75/1032596175.db2.gz SDIRBGFBMROAQR-WWDZGPRUSA-N 2 0 330.520 4.056 20 0 EIADRP CCC[C@H](NCC[C@H](C)[N@H+](C)Cc1ccccc1)c1ccccn1 ZINC000500619757 1032726112 /nfs/dbraw/zinc/72/61/12/1032726112.db2.gz UQRIWIGODPXZCC-ICSRJNTNSA-N 2 0 325.500 4.423 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643545976 1018896446 /nfs/dbraw/zinc/89/64/46/1018896446.db2.gz GPYFHMGWGNZZQJ-PBHICJAKSA-N 2 0 341.524 4.444 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)[C@H](C)c1nc2ccccc2s1 ZINC000643546133 1018898346 /nfs/dbraw/zinc/89/83/46/1018898346.db2.gz JEGOLFQUIZYMDL-SOUVJXGZSA-N 2 0 329.513 4.053 20 0 EIADRP CC[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(Br)cc1 ZINC000643546171 1018899620 /nfs/dbraw/zinc/89/96/20/1018899620.db2.gz JXMBMOPLNXMPFK-HOTGVXAUSA-N 2 0 337.305 4.165 20 0 EIADRP Brc1ccc([C@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)C2CC2)cc1 ZINC000643547525 1018925291 /nfs/dbraw/zinc/92/52/91/1018925291.db2.gz GOJWEXIGJMPDEH-IAGOWNOFSA-N 2 0 349.316 4.165 20 0 EIADRP Cc1cccc([C@H](N[C@@H]2CC[NH2+]C3(CCC3)C2)c2cccc(F)c2)c1 ZINC000643547869 1018930947 /nfs/dbraw/zinc/93/09/47/1018930947.db2.gz KAQYGXRDKYOTQC-RTWAWAEBSA-N 2 0 338.470 4.488 20 0 EIADRP CC[NH+]1CCC(C[NH2+]Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000520857254 1019332067 /nfs/dbraw/zinc/33/20/67/1019332067.db2.gz OOWOLKDJHGFFFL-UHFFFAOYSA-N 2 0 332.488 4.376 20 0 EIADRP c1ccc(CSCCC[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000535627065 1020012247 /nfs/dbraw/zinc/01/22/47/1020012247.db2.gz RPBWSOVUWQQMQL-TZIWHRDSSA-N 2 0 344.568 4.259 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(Br)cc1 ZINC000037786356 1020268603 /nfs/dbraw/zinc/26/86/03/1020268603.db2.gz GKXYIHWWUWSOGE-ZDUSSCGKSA-N 2 0 339.321 4.363 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655806536 1020973776 /nfs/dbraw/zinc/97/37/76/1020973776.db2.gz XYUZZTFQHZBYHN-MRRJBJDNSA-N 2 0 347.503 4.248 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)C1 ZINC000655804274 1020974568 /nfs/dbraw/zinc/97/45/68/1020974568.db2.gz RNWGZFKFHWKIJU-NBMRYCAZSA-N 2 0 340.433 4.271 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]C[C@H]3C[C@@H]([NH+](C)C)C3)cs2)cs1 ZINC000655806269 1020976151 /nfs/dbraw/zinc/97/61/51/1020976151.db2.gz TXHYYOPUMJNQAO-CORIIIEPSA-N 2 0 335.542 4.171 20 0 EIADRP C[N@H+](C[C@@H]1CN(Cc2ccccc2)CCCO1)C1CCCCCCC1 ZINC001167302630 1020979372 /nfs/dbraw/zinc/97/93/72/1020979372.db2.gz RMUKCWJRLUXUTJ-JOCHJYFZSA-N 2 0 344.543 4.322 20 0 EIADRP COc1ccc(-c2ccccc2C)cc1C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655824944 1020992700 /nfs/dbraw/zinc/99/27/00/1020992700.db2.gz RHQDUOQMQGVQIW-MSEWRSJXSA-N 2 0 338.495 4.100 20 0 EIADRP CC(C)(C)O[C@H]1C[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000655839148 1021005287 /nfs/dbraw/zinc/00/52/87/1021005287.db2.gz NXHGOVHJRSLDBU-GZYGRNMYSA-N 2 0 342.527 4.118 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000340466007 1021068688 /nfs/dbraw/zinc/06/86/88/1021068688.db2.gz KHFFKUFMLNFWLY-OAQYLSRUSA-N 2 0 338.495 4.400 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CCCCC[NH+]2CCCC2)cc1 ZINC000340473001 1021085077 /nfs/dbraw/zinc/08/50/77/1021085077.db2.gz JHCFBUZNEDBAOW-GOSISDBHSA-N 2 0 340.515 4.097 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]CCCCC[NH+]1CCCC1)CCCS2 ZINC000340480890 1021104867 /nfs/dbraw/zinc/10/48/67/1021104867.db2.gz XBLZUAPKYFTYCF-IBGZPJMESA-N 2 0 348.556 4.478 20 0 EIADRP C([C@H]1CCC[N@H+](CC2([C@@H]3CCCCO3)CCC2)C1)[NH+]1CCCCCC1 ZINC001167326742 1021129535 /nfs/dbraw/zinc/12/95/35/1021129535.db2.gz PZNQJMKXBZEGJD-RTWAWAEBSA-N 2 0 348.575 4.314 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3ccc(O)cc32)c1 ZINC000340519543 1021187617 /nfs/dbraw/zinc/18/76/17/1021187617.db2.gz MLMXSXZAJOOEDF-QFIPXVFZSA-N 2 0 338.495 4.400 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCOc2cccc3ccccc32)C[C@H]1C ZINC000531140876 1021251283 /nfs/dbraw/zinc/25/12/83/1021251283.db2.gz MCHAGDIHZULHQR-MJGOQNOKSA-N 2 0 326.484 4.023 20 0 EIADRP CC(C)(C)c1ccc(C[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000466920823 1021344127 /nfs/dbraw/zinc/34/41/27/1021344127.db2.gz SUCZMYVVZBIQPH-UHFFFAOYSA-N 2 0 344.543 4.061 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)C1 ZINC000580225597 1021779794 /nfs/dbraw/zinc/77/97/94/1021779794.db2.gz UTMDEGDQYQEHMI-HKUYNNGSSA-N 2 0 332.536 4.133 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1nc(-c2ccccc2)cs1 ZINC000089553666 1021930849 /nfs/dbraw/zinc/93/08/49/1021930849.db2.gz KRQVOGNXGQSGER-LSDHHAIUSA-N 2 0 329.513 4.191 20 0 EIADRP C[NH+](C/C=C\C[N@@H+](C)Cc1ccc(F)cc1)Cc1ccc(F)cc1 ZINC000613391078 1021938778 /nfs/dbraw/zinc/93/87/78/1021938778.db2.gz JCXIERXLPYNVKR-ARJAWSKDSA-N 2 0 330.422 4.085 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1csc(-c2ccccc2)n1 ZINC000414147440 1021966012 /nfs/dbraw/zinc/96/60/12/1021966012.db2.gz MGIWSMGSQIOFBC-OAHLLOKOSA-N 2 0 329.513 4.335 20 0 EIADRP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]Cc2ccc3c[nH+]cn3c2)c1 ZINC000414162736 1022002791 /nfs/dbraw/zinc/00/27/91/1022002791.db2.gz FAGXZVFHWDYKNJ-CYBMUJFWSA-N 2 0 331.366 4.095 20 0 EIADRP C[C@H]([NH2+][C@H]1CCc2nc[nH]c2C1)c1cc(F)c(Cl)cc1Cl ZINC000377799698 1022013384 /nfs/dbraw/zinc/01/33/84/1022013384.db2.gz YFXZWOGTRIJNDI-IUCAKERBSA-N 2 0 328.218 4.064 20 0 EIADRP C[C@@H]([NH2+]C1CCC(C(F)F)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000414173099 1022029951 /nfs/dbraw/zinc/02/99/51/1022029951.db2.gz FKTDMXKTBJFLEC-HPUBIQBYSA-N 2 0 340.458 4.102 20 0 EIADRP COc1ccc(CC[N@H+](CC[C@@H]2CCC[NH+]2C)CC(C)(C)C)cc1 ZINC001167401617 1022031747 /nfs/dbraw/zinc/03/17/47/1022031747.db2.gz BKCSBGDTZOKJNO-IBGZPJMESA-N 2 0 332.532 4.070 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cccc(C)c1 ZINC000580453512 1022038875 /nfs/dbraw/zinc/03/88/75/1022038875.db2.gz AXTKGGCYSVYMLK-HXUWFJFHSA-N 2 0 326.484 4.176 20 0 EIADRP C[NH+](C)Cc1ccc(CN[C@@H](c2ccc(F)cc2)c2ccccn2)cc1 ZINC000340693201 1022042336 /nfs/dbraw/zinc/04/23/36/1022042336.db2.gz ZQQNTRKWFJFMET-QFIPXVFZSA-N 2 0 349.453 4.162 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc2c[nH+]cn2c1)c1ccccc1OC(F)F ZINC000414181318 1022048406 /nfs/dbraw/zinc/04/84/06/1022048406.db2.gz LYQCXZLBBQTMFJ-MRXNPFEDSA-N 2 0 331.366 4.177 20 0 EIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c[nH+]cn3c1)CCCO2 ZINC000414185291 1022065714 /nfs/dbraw/zinc/06/57/14/1022065714.db2.gz OJCZATSXYLHMOH-HXUWFJFHSA-N 2 0 335.451 4.461 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccc(F)c(F)c1 ZINC000171126294 1022072697 /nfs/dbraw/zinc/07/26/97/1022072697.db2.gz YOVYXWQNXUUGAF-OAHLLOKOSA-N 2 0 348.437 4.146 20 0 EIADRP C[C@@H]([NH2+]C1CCC(C(F)F)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000414196903 1022097561 /nfs/dbraw/zinc/09/75/61/1022097561.db2.gz VNYHXAVJVSZMNJ-ODIFPOPNSA-N 2 0 340.458 4.102 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccccc1Cl ZINC000069645252 1022144641 /nfs/dbraw/zinc/14/46/41/1022144641.db2.gz LPACGUOYONGMAY-OAHLLOKOSA-N 2 0 332.875 4.131 20 0 EIADRP CC[C@@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000414219481 1022192150 /nfs/dbraw/zinc/19/21/50/1022192150.db2.gz HLPYLPSYNBSXTF-LAUBAEHRSA-N 2 0 326.484 4.429 20 0 EIADRP [NH3+][C@@H]1C[C@H](NC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)c2ccccc21 ZINC000261629368 1022364742 /nfs/dbraw/zinc/36/47/42/1022364742.db2.gz VTYNMQHREBQRHS-PTUXOGIPSA-N 2 0 349.522 4.023 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CC(C)(C)OCC2CC2)CC1 ZINC000414279327 1022391726 /nfs/dbraw/zinc/39/17/26/1022391726.db2.gz ZWFYSJXRDSQDBS-UHFFFAOYSA-N 2 0 344.543 4.224 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CC[C@H]2CCCCO2)ccc1OC ZINC000180259727 1022455299 /nfs/dbraw/zinc/45/52/99/1022455299.db2.gz WHGGJTYQMFRZNY-YLJYHZDGSA-N 2 0 348.531 4.147 20 0 EIADRP COCC1CCC([NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CC1 ZINC000414317381 1022521506 /nfs/dbraw/zinc/52/15/06/1022521506.db2.gz VXZJGEBLWMDDAE-UHFFFAOYSA-N 2 0 338.580 4.460 20 0 EIADRP CC(C)(C)[C@H]1C[C@@H]([NH2+]C2CC[NH+](CC3CCCCC3)CC2)CCO1 ZINC000378407956 1022805277 /nfs/dbraw/zinc/80/52/77/1022805277.db2.gz YRZPDMJZTKPXAI-VQTJNVASSA-N 2 0 336.564 4.214 20 0 EIADRP COc1cc(C)ccc1C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548153696 1022827293 /nfs/dbraw/zinc/82/72/93/1022827293.db2.gz DGZUSAJFZAPPRF-GHTZIAJQSA-N 2 0 338.495 4.004 20 0 EIADRP COc1cc(C)ccc1C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548153698 1022829006 /nfs/dbraw/zinc/82/90/06/1022829006.db2.gz DGZUSAJFZAPPRF-RXVVDRJESA-N 2 0 338.495 4.004 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)ccc1Br ZINC000378489595 1022842750 /nfs/dbraw/zinc/84/27/50/1022842750.db2.gz CTXBTYNBLSYSPU-NUEKZKHPSA-N 2 0 337.305 4.035 20 0 EIADRP Fc1ccc([C@@H]2C[C@H]([NH2+]C3CC[NH+](C4CCCC4)CC3)CCO2)cc1 ZINC000363863315 1022867381 /nfs/dbraw/zinc/86/73/81/1022867381.db2.gz KMJMBPYEJWDPPE-CTNGQTDRSA-N 2 0 346.490 4.042 20 0 EIADRP COc1ccc([C@@H]([NH2+][C@H](C)C2CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000396471676 1023039082 /nfs/dbraw/zinc/03/90/82/1023039082.db2.gz YBZVXCAHNXRHEO-VGSWGCGISA-N 2 0 338.495 4.105 20 0 EIADRP C[C@@]1(C[NH2+]Cc2cncc3ccccc32)CC[N@H+](Cc2ccccc2)C1 ZINC000311366693 1023128433 /nfs/dbraw/zinc/12/84/33/1023128433.db2.gz KHKSZDVIJYPLOR-QHCPKHFHSA-N 2 0 345.490 4.237 20 0 EIADRP C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccc(-c3ccccc3F)o2)C1 ZINC000584687840 1023188945 /nfs/dbraw/zinc/18/89/45/1023188945.db2.gz PXEIDOKANLTINQ-HNAYVOBHSA-N 2 0 328.431 4.002 20 0 EIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+][C@@H](C)c2cccc(C[NH+](C)C)c2)c1 ZINC000924600432 1023332200 /nfs/dbraw/zinc/33/22/00/1023332200.db2.gz STNHVQYKPADABV-JKSUJKDBSA-N 2 0 339.483 4.118 20 0 EIADRP C[C@H](CCc1ccco1)[NH2+]C[C@@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000310066036 1023336531 /nfs/dbraw/zinc/33/65/31/1023336531.db2.gz BLFIVZQJFQKBSH-WIYYLYMNSA-N 2 0 326.484 4.103 20 0 EIADRP C[C@H](C[N@H+](C)C1CCN(CCc2ccccn2)CC1)C1CCCCC1 ZINC000549472639 1023337571 /nfs/dbraw/zinc/33/75/71/1023337571.db2.gz XYVBVOPGYLFGBH-LJQANCHMSA-N 2 0 343.559 4.237 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+]Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000415016265 1023390787 /nfs/dbraw/zinc/39/07/87/1023390787.db2.gz CCLWDSKXJMLOEF-AWEZNQCLSA-N 2 0 348.922 4.176 20 0 EIADRP Clc1csc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000309697143 1023400696 /nfs/dbraw/zinc/40/06/96/1023400696.db2.gz FINUGCRLXFDSGC-MRXNPFEDSA-N 2 0 334.916 4.403 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000415040641 1023404955 /nfs/dbraw/zinc/40/49/55/1023404955.db2.gz PAUSTLLBVYWYPS-ISWURRPUSA-N 2 0 326.406 4.059 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cccc(OC(F)(F)F)c1)c1ccccc1 ZINC000415049573 1023409206 /nfs/dbraw/zinc/40/92/06/1023409206.db2.gz HVKHTNVHOLVLRO-QGZVFWFLSA-N 2 0 338.373 4.155 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2cccc3c2CCCN3)CC[N@@H+]1Cc1ccccc1 ZINC000415046494 1023409873 /nfs/dbraw/zinc/40/98/73/1023409873.db2.gz ZTYLDQFIAXMZEM-WIYYLYMNSA-N 2 0 349.522 4.187 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1ncc(-c2ccccc2)s1)c1ccccc1 ZINC000415057231 1023411909 /nfs/dbraw/zinc/41/19/09/1023411909.db2.gz RLRLXHBFOQFQQW-SFHVURJKSA-N 2 0 337.492 4.380 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@H]1CC[NH2+][C@@H](C)C1 ZINC000415075440 1023421138 /nfs/dbraw/zinc/42/11/38/1023421138.db2.gz FKNRKXONWKKBJQ-ZOBUZTSGSA-N 2 0 343.540 4.466 20 0 EIADRP C[NH+](C)CC1CC[NH+](CCCOc2cccc(C(C)(C)C)c2)CC1 ZINC000511649832 1023474880 /nfs/dbraw/zinc/47/48/80/1023474880.db2.gz PPLCQQBTZTYQCA-UHFFFAOYSA-N 2 0 332.532 4.027 20 0 EIADRP CCC[NH+]1CCC([N@H+](C)Cc2ccc(Br)c(C)c2)CC1 ZINC000500070928 1023479691 /nfs/dbraw/zinc/47/96/91/1023479691.db2.gz TUWBRSZSQAMWJJ-UHFFFAOYSA-N 2 0 339.321 4.064 20 0 EIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@@H+]2Cc2cccc(C3CCCC3)c2)C1 ZINC000656785845 1023528860 /nfs/dbraw/zinc/52/88/60/1023528860.db2.gz KEENGOPTWCDCCA-FSSWDIPSSA-N 2 0 342.527 4.205 20 0 EIADRP c1nc(-c2ccccc2)sc1C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656785936 1023534803 /nfs/dbraw/zinc/53/48/03/1023534803.db2.gz NNNHCPCUVISDRZ-GOSISDBHSA-N 2 0 341.524 4.022 20 0 EIADRP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000684370478 1023544278 /nfs/dbraw/zinc/54/42/78/1023544278.db2.gz VLQINWURUKZIDY-DZFGPLHGSA-N 2 0 330.516 4.108 20 0 EIADRP C[N@@H+]1CCCC2(CC[NH+](CCc3ccccc3C(F)(F)F)CC2)C1 ZINC001279244561 1023571722 /nfs/dbraw/zinc/57/17/22/1023571722.db2.gz PQJUFDNESURYFC-UHFFFAOYSA-N 2 0 340.433 4.056 20 0 EIADRP CC[C@@H]([NH2+][C@@H]1CC[NH2+]C(C)(C)C1)c1ccc(Br)cc1 ZINC000709357892 1023573645 /nfs/dbraw/zinc/57/36/45/1023573645.db2.gz WAINSYMLZKICNH-HUUCEWRRSA-N 2 0 325.294 4.020 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc(F)c(Br)c1 ZINC000019915208 1023633646 /nfs/dbraw/zinc/63/36/46/1023633646.db2.gz YPZQPISOTXFGNS-ZDUSSCGKSA-N 2 0 345.300 4.188 20 0 EIADRP [NH3+]CCC[C@H]([NH2+][C@H]1CCCc2c(F)cc(F)cc21)c1ccccc1 ZINC000925674741 1023664178 /nfs/dbraw/zinc/66/41/78/1023664178.db2.gz KIZQZMRPZGDCOV-PMACEKPBSA-N 2 0 330.422 4.412 20 0 EIADRP C[C@H](CCCC(F)(F)F)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000390744206 1023819470 /nfs/dbraw/zinc/81/94/70/1023819470.db2.gz OMYRZDVLVWTWEV-WBVHZDCISA-N 2 0 328.422 4.219 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(N2CC[NH+](CC3CC3)CC2)cc1)c1ccccc1 ZINC000090971284 1023930320 /nfs/dbraw/zinc/93/03/20/1023930320.db2.gz CINXYULSMBIBAZ-IBGZPJMESA-N 2 0 349.522 4.069 20 0 EIADRP CC(C)CCOc1ccc(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)cc1 ZINC000510541110 1024009021 /nfs/dbraw/zinc/00/90/21/1024009021.db2.gz ZEXDRIDAKWXHSM-GOSISDBHSA-N 2 0 327.472 4.214 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2nc3ccc(F)cc3o2)CC1 ZINC000543873533 1024016064 /nfs/dbraw/zinc/01/60/64/1024016064.db2.gz TUICAICOSNIVAX-UHFFFAOYSA-N 2 0 347.478 4.301 20 0 EIADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000510671957 1024209932 /nfs/dbraw/zinc/20/99/32/1024209932.db2.gz ROOZVPMIOSWFJY-DOTOQJQBSA-N 2 0 342.449 4.348 20 0 EIADRP Cc1cc(OCCC[C@H](C)[NH2+][C@H]2CCN(C)[C@@H](C)C2)ccc1Cl ZINC000510738281 1024379791 /nfs/dbraw/zinc/37/97/91/1024379791.db2.gz VGMPBVKTDJRKKI-ULQDDVLXSA-N 2 0 338.923 4.268 20 0 EIADRP C[C@H](CCc1c(F)cccc1F)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000510750060 1024390747 /nfs/dbraw/zinc/39/07/47/1024390747.db2.gz LBFUXINEVUZRLL-OAHLLOKOSA-N 2 0 336.470 4.283 20 0 EIADRP CC(C)(C)[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]CC2)c1ccc(F)cc1 ZINC000652341372 1024668150 /nfs/dbraw/zinc/66/81/50/1024668150.db2.gz KJQUAFQVGMXXES-FQEVSTJZSA-N 2 0 326.459 4.348 20 0 EIADRP CC(C)c1ccc([C@H](C)[N@@H+]2CCC[C@H]([C@@H]3C[C@H]([NH3+])CCO3)C2)cc1 ZINC000652350436 1024701905 /nfs/dbraw/zinc/70/19/05/1024701905.db2.gz YMHSDDVBIKOYEF-DVWBAYGPSA-N 2 0 330.516 4.089 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248490698 1024871381 /nfs/dbraw/zinc/87/13/81/1024871381.db2.gz IGAVCYDGDUFXDE-ILXRZTDVSA-N 2 0 336.907 4.349 20 0 EIADRP C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662295629 1025046498 /nfs/dbraw/zinc/04/64/98/1025046498.db2.gz VYYDMTBTTWHOLV-LPHOPBHVSA-N 2 0 339.483 4.114 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2cccc(OCc3ccccc3)c2)C1 ZINC000062426984 1025058079 /nfs/dbraw/zinc/05/80/79/1025058079.db2.gz RUDYZHGXKLBYKN-NRFANRHFSA-N 2 0 338.495 4.086 20 0 EIADRP Clc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c2ncccc12 ZINC000663346533 1025146144 /nfs/dbraw/zinc/14/61/44/1025146144.db2.gz TWLXQMGPPTVWEF-INIZCTEOSA-N 2 0 343.902 4.100 20 0 EIADRP CC[NH+](CC)CCOC1CC[NH+]([C@H](C)c2ccccc2Cl)CC1 ZINC000342084238 1025152192 /nfs/dbraw/zinc/15/21/92/1025152192.db2.gz BBUNNMOLOJFGFL-MRXNPFEDSA-N 2 0 338.923 4.224 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(F)cc1 ZINC000162585860 1025158627 /nfs/dbraw/zinc/15/86/27/1025158627.db2.gz QVBLUBKEUBGELE-FQEVSTJZSA-N 2 0 330.447 4.007 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c(C)o1 ZINC000067506494 1025231012 /nfs/dbraw/zinc/23/10/12/1025231012.db2.gz LZTHQDWOTXYDCZ-QGZVFWFLSA-N 2 0 342.483 4.222 20 0 EIADRP FC(F)(F)[C@H]1CC[N@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC000663435086 1025336993 /nfs/dbraw/zinc/33/69/93/1025336993.db2.gz POWISNCARFLGPM-KRWDZBQOSA-N 2 0 326.406 4.057 20 0 EIADRP C[C@H](Cc1coc2ccccc12)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663466258 1025392645 /nfs/dbraw/zinc/39/26/45/1025392645.db2.gz QDVIOSJHQTXFLR-AEFFLSMTSA-N 2 0 326.484 4.075 20 0 EIADRP COc1cc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)ccc1SC ZINC000663466979 1025401622 /nfs/dbraw/zinc/40/16/22/1025401622.db2.gz CIPIPSTWEQQFFB-NVXWUHKLSA-N 2 0 348.556 4.190 20 0 EIADRP c1ccc2cc(CC[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)ccc2c1 ZINC001167965835 1025517303 /nfs/dbraw/zinc/51/73/03/1025517303.db2.gz NNJDDZCCCOVTPV-NOTZXAQLSA-N 2 0 334.507 4.377 20 0 EIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000156750791 1025601949 /nfs/dbraw/zinc/60/19/49/1025601949.db2.gz KONLRZOCZDDPFA-DLBZAZTESA-N 2 0 330.516 4.184 20 0 EIADRP CCc1ccc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cn1 ZINC000512047149 1025843116 /nfs/dbraw/zinc/84/31/16/1025843116.db2.gz XRMRDKQSQYBOHP-QUCCMNQESA-N 2 0 337.511 4.034 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(OC)(c2ccccc2)CC1 ZINC001167836532 1025846479 /nfs/dbraw/zinc/84/64/79/1025846479.db2.gz FCDWXHOBURSEFQ-IBGZPJMESA-N 2 0 332.532 4.135 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(n2ncc3ccccc32)CC1 ZINC001167838245 1025850729 /nfs/dbraw/zinc/85/07/29/1025850729.db2.gz SLXBHIHPQNDRQJ-GOSISDBHSA-N 2 0 342.531 4.184 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1cc2ccncc2s1 ZINC000657308928 1025864026 /nfs/dbraw/zinc/86/40/26/1025864026.db2.gz YXRSIVNNDAMGIZ-UHFFFAOYSA-N 2 0 339.508 4.426 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+]Cc3ccc4occc4c3)CC2)c1 ZINC000512085744 1025908827 /nfs/dbraw/zinc/90/88/27/1025908827.db2.gz YBYRRUHFKCHXJT-UHFFFAOYSA-N 2 0 340.492 4.496 20 0 EIADRP CCOC(=O)C[N@@H+]([C@H](C)c1ccccc1)[C@@H](C)CCC[NH+](CC)CC ZINC001167842438 1025915245 /nfs/dbraw/zinc/91/52/45/1025915245.db2.gz XIICLOQCDBFPRP-RBUKOAKNSA-N 2 0 348.531 4.123 20 0 EIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000585814859 1025940070 /nfs/dbraw/zinc/94/00/70/1025940070.db2.gz VMHBCZQCIBKGAE-OAHLLOKOSA-N 2 0 332.488 4.374 20 0 EIADRP Clc1ccc2c(c1)CC[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3CC1CC1)C2 ZINC001167971282 1026057086 /nfs/dbraw/zinc/05/70/86/1026057086.db2.gz VZMKVMXNCPNNKF-WVVQBRDUSA-N 2 0 344.930 4.192 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C1(c2cccc(Cl)c2)CC1 ZINC000344217508 1026153642 /nfs/dbraw/zinc/15/36/42/1026153642.db2.gz WAJBCNPKMYSBQY-UHFFFAOYSA-N 2 0 338.842 4.008 20 0 EIADRP c1sc2ccccc2c1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167973843 1026185477 /nfs/dbraw/zinc/18/54/77/1026185477.db2.gz OVZBDZMWBVRQGO-AYHJJNSGSA-N 2 0 326.509 4.396 20 0 EIADRP Cc1ccccc1CC(C)(C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167975867 1026305062 /nfs/dbraw/zinc/30/50/62/1026305062.db2.gz XVQNVGAUVQQFQN-SEJPIABJSA-N 2 0 326.528 4.311 20 0 EIADRP CSc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167981625 1026378715 /nfs/dbraw/zinc/37/87/15/1026378715.db2.gz BZVQPRDYVGLDMF-AQXGTKIOSA-N 2 0 330.541 4.465 20 0 EIADRP Clc1ccc([C@H]2C[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167982174 1026390339 /nfs/dbraw/zinc/39/03/39/1026390339.db2.gz ZLDWSDAWESBIHG-DGDSNLKDSA-N 2 0 330.903 4.191 20 0 EIADRP Fc1ccc([C@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167982804 1026401067 /nfs/dbraw/zinc/40/10/67/1026401067.db2.gz AVWUYKNQKXMVTO-JGUMPVPUSA-N 2 0 328.475 4.368 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2nc(-c3ccccc3)cs2)CC1 ZINC000506858370 1026426513 /nfs/dbraw/zinc/42/65/13/1026426513.db2.gz BHTZUVJMRQOPMV-UHFFFAOYSA-N 2 0 343.540 4.364 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cnc(C(C)(C)C)s2)CC1 ZINC000506879399 1026484110 /nfs/dbraw/zinc/48/41/10/1026484110.db2.gz CYOHZIXSIDMDMO-UHFFFAOYSA-N 2 0 337.577 4.385 20 0 EIADRP COc1ccccc1-c1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)cc1 ZINC000506929469 1026533446 /nfs/dbraw/zinc/53/34/46/1026533446.db2.gz QUIVCPLDGVRMMA-UHFFFAOYSA-N 2 0 338.495 4.136 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](C/C(C)=C\c2ccccc2COC)CC1 ZINC000507207544 1026688174 /nfs/dbraw/zinc/68/81/74/1026688174.db2.gz DPGRLEAYUKSFFH-CYVLTUHYSA-N 2 0 344.543 4.290 20 0 EIADRP COc1ccc([C@H]2CCCC[C@@H]2[NH2+]CC2(C)CC[NH+](C)CC2)cc1F ZINC000507446442 1026796902 /nfs/dbraw/zinc/79/69/02/1026796902.db2.gz UFOVWFZMYBATAM-MJGOQNOKSA-N 2 0 348.506 4.182 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCOc2cccc3ccccc32)C[C@@H]1C ZINC001167589379 1026859761 /nfs/dbraw/zinc/85/97/61/1026859761.db2.gz DKKYOBPXNIBJDQ-ICSRJNTNSA-N 2 0 340.511 4.413 20 0 EIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@H]2CCCc3cccnc32)c1 ZINC000684954155 1026888733 /nfs/dbraw/zinc/88/87/33/1026888733.db2.gz UQYZYRNEDYUHMS-NRFANRHFSA-N 2 0 335.495 4.235 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3cccnc32)C1 ZINC000684953660 1026889397 /nfs/dbraw/zinc/88/93/97/1026889397.db2.gz QQSJSTXCMJWDET-AVRDEDQJSA-N 2 0 349.522 4.481 20 0 EIADRP CC[NH+](CC)CCO[C@@H]1CC[N@@H+]([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC001167603781 1026993234 /nfs/dbraw/zinc/99/32/34/1026993234.db2.gz ZQDGHSMBHIROQW-WOJBJXKFSA-N 2 0 332.532 4.106 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000474481254 1027115903 /nfs/dbraw/zinc/11/59/03/1027115903.db2.gz VZASRZINIPMTEZ-RTBURBONSA-N 2 0 332.532 4.289 20 0 EIADRP Cc1cc2c(cn1)[C@H]([NH2+]C1C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C1)CC2 ZINC001168037463 1027252551 /nfs/dbraw/zinc/25/25/51/1027252551.db2.gz YNXQNUNCCVXXKE-PMAPCBKXSA-N 2 0 349.522 4.409 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCN(C)C2CCCCC2)cc1OC ZINC000474629207 1027335760 /nfs/dbraw/zinc/33/57/60/1027335760.db2.gz CSVUBWNXCXJIII-IAGOWNOFSA-N 2 0 348.531 4.050 20 0 EIADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474714915 1027433314 /nfs/dbraw/zinc/43/33/14/1027433314.db2.gz SKSCLIHUVYBWQU-VHDGCEQUSA-N 2 0 326.937 4.215 20 0 EIADRP CC(C)C[C@@H](C[NH2+]CC1(N2CCCC2)CCOCC1)c1ccccc1 ZINC000474722805 1027440679 /nfs/dbraw/zinc/44/06/79/1027440679.db2.gz MPHFRTSQUMEUMW-NRFANRHFSA-N 2 0 344.543 4.051 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)C1CCOCC1 ZINC000532206191 1027495787 /nfs/dbraw/zinc/49/57/87/1027495787.db2.gz KGNMDOSVIQGZAU-QFIPXVFZSA-N 2 0 344.543 4.357 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cccc(Cl)c2)[C@H](C)C1 ZINC000152443749 1027545489 /nfs/dbraw/zinc/54/54/89/1027545489.db2.gz IFFUOJWXWREOBG-GJYPPUQNSA-N 2 0 338.923 4.128 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1Cl ZINC000112517471 1027580332 /nfs/dbraw/zinc/58/03/32/1027580332.db2.gz YOYCDGRUTBEDHD-AWEZNQCLSA-N 2 0 332.875 4.261 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(F)c(F)c1 ZINC000112518304 1027580495 /nfs/dbraw/zinc/58/04/95/1027580495.db2.gz JIRUASIORHBROA-OAHLLOKOSA-N 2 0 330.422 4.411 20 0 EIADRP CO[C@]1(C)CCC[N@H+](CC(C)(C)C[NH+](C)Cc2ccccc2)CC1 ZINC000475552718 1027595135 /nfs/dbraw/zinc/59/51/35/1027595135.db2.gz DFGWHBQNNFBYNC-OAQYLSRUSA-N 2 0 332.532 4.036 20 0 EIADRP CC1(c2ccccc2)CCC([NH2+]C2CC([NH+]3CCCCC3)C2)CC1 ZINC000475567116 1027639719 /nfs/dbraw/zinc/63/97/19/1027639719.db2.gz BPKBCJOKOZKEAQ-UHFFFAOYSA-N 2 0 326.528 4.493 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)C1CCSCC1 ZINC000474879491 1027711728 /nfs/dbraw/zinc/71/17/28/1027711728.db2.gz QSEBCSBXVSYDQW-WSTZPKSXSA-N 2 0 346.584 4.408 20 0 EIADRP Fc1ccccc1[C@@H]1CC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)C1 ZINC001167995640 1027793133 /nfs/dbraw/zinc/79/31/33/1027793133.db2.gz MCOPMQVTBIFADW-KAKFPZCNSA-N 2 0 328.475 4.020 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2scnc2C2CC2)CC1 ZINC000426167855 1027832100 /nfs/dbraw/zinc/83/21/00/1027832100.db2.gz WQUBAGWRJZTJHK-UHFFFAOYSA-N 2 0 335.561 4.355 20 0 EIADRP C[C@@H](c1ccccn1)[NH+](C)CCCCC[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000091702932 1027901222 /nfs/dbraw/zinc/90/12/22/1027901222.db2.gz ZQYBDWGAHIUQIV-OALUTQOASA-N 2 0 340.515 4.333 20 0 EIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000520460116 1028046951 /nfs/dbraw/zinc/04/69/51/1028046951.db2.gz XUCYOUUHUYTUOZ-APIJFGDWSA-N 2 0 326.937 4.213 20 0 EIADRP Cc1ccc2cc(C[NH2+]CCCC[N@H+]3CCC[C@@H](C)C3)ccc2n1 ZINC000189256319 1028110998 /nfs/dbraw/zinc/11/09/98/1028110998.db2.gz WOFLPISZFPWNLP-QGZVFWFLSA-N 2 0 325.500 4.145 20 0 EIADRP CCc1nc2c(s1)[C@@H]([NH2+]Cc1cccc(C[N@@H+](C)CC)c1)CCC2 ZINC000123944861 1028152672 /nfs/dbraw/zinc/15/26/72/1028152672.db2.gz NPNRYQAFVSKFMU-KRWDZBQOSA-N 2 0 343.540 4.324 20 0 EIADRP CSCC1CCC([NH2+][C@@H](C)c2ccc(-n3ccnc3)cc2)CC1 ZINC000395346292 1028169794 /nfs/dbraw/zinc/16/97/94/1028169794.db2.gz GRRWHIRWMSGJNY-HJOIGYKYSA-N 2 0 329.513 4.445 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC001167659936 1028264360 /nfs/dbraw/zinc/26/43/60/1028264360.db2.gz XTZFJCMFKLFAPR-MRXNPFEDSA-N 2 0 336.470 4.441 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000346140176 1028274851 /nfs/dbraw/zinc/27/48/51/1028274851.db2.gz XAGHEACYTWBYEM-HXUWFJFHSA-N 2 0 336.414 4.052 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](Cc1ccccc1)CC1CCC1 ZINC000346188113 1028297838 /nfs/dbraw/zinc/29/78/38/1028297838.db2.gz UPAREFQNFGAILC-UHFFFAOYSA-N 2 0 346.478 4.378 20 0 EIADRP CC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)Cc1ccc(Cl)cc1 ZINC000346226667 1028336390 /nfs/dbraw/zinc/33/63/90/1028336390.db2.gz XVHJDDDQWYWOSZ-UHFFFAOYSA-N 2 0 340.858 4.251 20 0 EIADRP FC1(F)CC[C@@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000281080519 1028379158 /nfs/dbraw/zinc/37/91/58/1028379158.db2.gz JGEPWXACDHOWRX-MKXGPGLRSA-N 2 0 334.454 4.207 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+]Cc1ccc(OC(F)F)c(Cl)c1)C(C)(C)C ZINC000523864475 1028433333 /nfs/dbraw/zinc/43/33/33/1028433333.db2.gz PLWIQLHITMRMFG-HNNXBMFYSA-N 2 0 348.865 4.397 20 0 EIADRP [NH3+]C1CC[NH+](Cc2ccc(-c3cccc(C(F)(F)F)c3)cc2)CC1 ZINC000629696044 1028636024 /nfs/dbraw/zinc/63/60/24/1028636024.db2.gz SWLLWGDWAMELQE-UHFFFAOYSA-N 2 0 334.385 4.296 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000583395824 1028657826 /nfs/dbraw/zinc/65/78/26/1028657826.db2.gz NZPPOTNBWWOBQX-VGWHQZGPSA-N 2 0 327.299 4.027 20 0 EIADRP c1cc2c(cccc2C[N@@H+]2C[C@@H]3CC[NH+](Cc4ccccc4)C[C@@H]3C2)[nH]1 ZINC000583423338 1028714439 /nfs/dbraw/zinc/71/44/39/1028714439.db2.gz FEADJNLCWBKOGV-PZJWPPBQSA-N 2 0 345.490 4.122 20 0 EIADRP Cc1ccccc1C1([NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)CCC1 ZINC000650740556 1029044489 /nfs/dbraw/zinc/04/44/89/1029044489.db2.gz MRBOPODWOUBXLX-UNMCSNQZSA-N 2 0 348.490 4.220 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@H](c3ccccn3)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168051809 1029066376 /nfs/dbraw/zinc/06/63/76/1029066376.db2.gz ISBVQZHYSFCBEA-MXNKGDRCSA-N 2 0 349.522 4.313 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cnc(-c2ccco2)s1 ZINC000278395098 1029103887 /nfs/dbraw/zinc/10/38/87/1029103887.db2.gz MYZJOTPYWWUYFT-HNNXBMFYSA-N 2 0 333.501 4.147 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC000469980251 1029207117 /nfs/dbraw/zinc/20/71/17/1029207117.db2.gz DVHXQSPCKUADKV-HZPDHXFCSA-N 2 0 329.513 4.111 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CCC1CC[NH2+]CC1 ZINC000650763927 1029277412 /nfs/dbraw/zinc/27/74/12/1029277412.db2.gz MHVKMPJPOXIEBR-OAHLLOKOSA-N 2 0 343.540 4.083 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)CCS2 ZINC000343471348 1029319431 /nfs/dbraw/zinc/31/94/31/1029319431.db2.gz TUFFXURMILMSDW-AEFFLSMTSA-N 2 0 336.545 4.188 20 0 EIADRP Cc1ccccc1C1([NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)CC1 ZINC000647316280 1029423443 /nfs/dbraw/zinc/42/34/43/1029423443.db2.gz YVAFGJLBNJDKTG-SFHVURJKSA-N 2 0 338.495 4.275 20 0 EIADRP CC(C)CCn1cccc1C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475218834 1029453143 /nfs/dbraw/zinc/45/31/43/1029453143.db2.gz HDWPIZNTEYGBSX-NRFANRHFSA-N 2 0 339.527 4.146 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@H]3CCC[C@@H]3c3ccccc3)C2)cc1 ZINC000475274046 1029478920 /nfs/dbraw/zinc/47/89/20/1029478920.db2.gz HKAOSXPXPKMLRO-MZYLBHOOSA-N 2 0 334.507 4.434 20 0 EIADRP CC(C)(C)[C@@H]1C[C@H]([NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)CS1 ZINC000475291260 1029503345 /nfs/dbraw/zinc/50/33/45/1029503345.db2.gz NRATXTNUWIULCC-QYZOEREBSA-N 2 0 332.557 4.018 20 0 EIADRP CC(C)COc1ccc(C(C)(C)C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000166534644 1029524244 /nfs/dbraw/zinc/52/42/44/1029524244.db2.gz GKTMFPVRUSMESE-WOJBJXKFSA-N 2 0 344.543 4.215 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2ccc3ncccc3c2)CC1 ZINC000475339031 1029554388 /nfs/dbraw/zinc/55/43/88/1029554388.db2.gz XMICWEZVLAPRJH-VGOFRKELSA-N 2 0 337.511 4.368 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)CCCS2 ZINC000446935334 1029644493 /nfs/dbraw/zinc/64/44/93/1029644493.db2.gz ZLBYZKDPEYRHCF-IIDMSEBBSA-N 2 0 334.529 4.085 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)C1CCOCC1 ZINC000584380787 1029795287 /nfs/dbraw/zinc/79/52/87/1029795287.db2.gz SDKIMIKXQCNPAK-RBBKRZOGSA-N 2 0 344.543 4.084 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)c1ccc(OC)c(OC)c1 ZINC000090586270 1029867727 /nfs/dbraw/zinc/86/77/27/1029867727.db2.gz ZLTFGVIRUJHFKJ-HKUYNNGSSA-N 2 0 348.531 4.113 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000091287734 1029882372 /nfs/dbraw/zinc/88/23/72/1029882372.db2.gz QKFXDEDQGIWJGV-SUMWQHHRSA-N 2 0 326.406 4.088 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](c2cccnc2)C(C)C)cc1 ZINC000091267346 1029882499 /nfs/dbraw/zinc/88/24/99/1029882499.db2.gz QCCYUGGNFVMXJV-NRFANRHFSA-N 2 0 325.500 4.410 20 0 EIADRP CC(C)[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C(C)C)c1cccnc1 ZINC000091285233 1029882630 /nfs/dbraw/zinc/88/26/30/1029882630.db2.gz SDUTVYCMARHVRD-OAQYLSRUSA-N 2 0 325.500 4.409 20 0 EIADRP C[C@H](C[N@@H+]1CCC[C@H](c2ncc[nH]2)C1)c1cccc(Br)c1 ZINC000092073655 1029900603 /nfs/dbraw/zinc/90/06/03/1029900603.db2.gz HSOJHHPLCPHDLW-HIFRSBDPSA-N 2 0 348.288 4.155 20 0 EIADRP CCc1ncc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)s1 ZINC000093006740 1029963193 /nfs/dbraw/zinc/96/31/93/1029963193.db2.gz VKEURDRAKNKGMF-UHFFFAOYSA-N 2 0 343.540 4.050 20 0 EIADRP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447574060 1030153685 /nfs/dbraw/zinc/15/36/85/1030153685.db2.gz UKRWDHOAPZBXNU-CQSZACIVSA-N 2 0 336.907 4.264 20 0 EIADRP C[N@H+](CCc1c(Cl)cccc1Cl)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000450983296 1030156160 /nfs/dbraw/zinc/15/61/60/1030156160.db2.gz PSOGMUTWDJLAIW-PBWFPOADSA-N 2 0 327.299 4.093 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@H](c2cccnc2)C2CC2)C3)cc1 ZINC000447588804 1030189044 /nfs/dbraw/zinc/18/90/44/1030189044.db2.gz VNTDPFGVYHXBDI-BJESRGMDSA-N 2 0 347.506 4.318 20 0 EIADRP FC1(F)CCC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000447578775 1030206945 /nfs/dbraw/zinc/20/69/45/1030206945.db2.gz HHPZPIHSPBNQDP-AKHDSKFASA-N 2 0 334.454 4.350 20 0 EIADRP CCc1cnccc1[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447579679 1030208246 /nfs/dbraw/zinc/20/82/46/1030208246.db2.gz LIYQORLFAAVAOQ-MVWVFHAYSA-N 2 0 349.522 4.490 20 0 EIADRP C[C@@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH3+])(c2ccccc2)CC1 ZINC001168165121 1030236153 /nfs/dbraw/zinc/23/61/53/1030236153.db2.gz BZOREHMXUNSYDD-INIZCTEOSA-N 2 0 328.887 4.221 20 0 EIADRP C[C@@H](Cc1ccc(Cl)cc1)[NH2+]CC1CC[NH+](CC2CCC2)CC1 ZINC001168165955 1030270592 /nfs/dbraw/zinc/27/05/92/1030270592.db2.gz KXOXVHPJBMPEQA-INIZCTEOSA-N 2 0 334.935 4.373 20 0 EIADRP C/C=C\COc1ccc(CC[C@H](C)[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)cc1 ZINC000685455690 1030341752 /nfs/dbraw/zinc/34/17/52/1030341752.db2.gz LFXUHYOGVFTFRB-LJQWKTEUSA-N 2 0 344.543 4.283 20 0 EIADRP C([C@@H]1CCC2(CCCC2)O1)[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000530410442 1030380493 /nfs/dbraw/zinc/38/04/93/1030380493.db2.gz SOSOOMKJSPFJDI-PMACEKPBSA-N 2 0 334.548 4.066 20 0 EIADRP c1nc(C2CC2)oc1CNCc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000628210153 1030381982 /nfs/dbraw/zinc/38/19/82/1030381982.db2.gz IXYLIFLADXDVAY-UHFFFAOYSA-N 2 0 339.483 4.218 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H](C)c2cc3cnccc3o2)CC1 ZINC000657902245 1030410469 /nfs/dbraw/zinc/41/04/69/1030410469.db2.gz XXSWUFZMQGMEKH-MRXNPFEDSA-N 2 0 329.488 4.237 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CCN(Cc2cc(C(C)(C)C)on2)CC1 ZINC000685566889 1030521233 /nfs/dbraw/zinc/52/12/33/1030521233.db2.gz PGRVOJAJASBGJI-KRWDZBQOSA-N 2 0 347.547 4.449 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1 ZINC000527232754 1030586673 /nfs/dbraw/zinc/58/66/73/1030586673.db2.gz NULCXCHTZSDAFQ-QZTJIDSGSA-N 2 0 344.543 4.431 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(Br)o1)c1cccc(-n2ccnc2)c1 ZINC000191240629 1030610099 /nfs/dbraw/zinc/61/00/99/1030610099.db2.gz ZQGHVIIKGYDOLO-GFCCVEGCSA-N 2 0 346.228 4.079 20 0 EIADRP C[C@@H](CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(C(F)(F)F)c1 ZINC000192923546 1030721413 /nfs/dbraw/zinc/72/14/13/1030721413.db2.gz ASSAUVJVYKPTJV-DXJOGWAWSA-N 2 0 340.433 4.414 20 0 EIADRP CN1CCC[C@@H](C[NH2+]Cc2ccc3cc[nH]c3c2)[C@@H]1c1cccs1 ZINC000527669028 1030806567 /nfs/dbraw/zinc/80/65/67/1030806567.db2.gz WSPZSNIJISZGCE-FXAWDEMLSA-N 2 0 339.508 4.402 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(F)cc1 ZINC000122383793 1030811644 /nfs/dbraw/zinc/81/16/44/1030811644.db2.gz ZHZORKFKELUTLS-IBGZPJMESA-N 2 0 330.447 4.007 20 0 EIADRP C[C@H]1CC[C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)c2ccccc21 ZINC000658069997 1030815622 /nfs/dbraw/zinc/81/56/22/1030815622.db2.gz SNSVLWCDJBTGDT-JTSKRJEESA-N 2 0 342.527 4.106 20 0 EIADRP CC[C@H]([NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C)c1cc(C)ccc1C ZINC000527817922 1030860287 /nfs/dbraw/zinc/86/02/87/1030860287.db2.gz DWXCKOHRESJVCN-NRFANRHFSA-N 2 0 334.467 4.433 20 0 EIADRP C[C@@H]1[C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C[C@@H]1c1ccccc1 ZINC000658164474 1030860370 /nfs/dbraw/zinc/86/03/70/1030860370.db2.gz DKGAFRGGTXBZIQ-OFAXGOBFSA-N 2 0 349.522 4.075 20 0 EIADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658165408 1030862579 /nfs/dbraw/zinc/86/25/79/1030862579.db2.gz JJXMOPFVKZXLCA-GCJKJVERSA-N 2 0 349.522 4.440 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)[C@@H](C)C2 ZINC000658168497 1030866251 /nfs/dbraw/zinc/86/62/51/1030866251.db2.gz XNBGJWUZTURZRU-MBSDFSHPSA-N 2 0 349.522 4.125 20 0 EIADRP COc1cccc2cc([C@H](C)[NH2+]CC3CC[NH+](CC4CC4)CC3)oc21 ZINC000658354356 1031025357 /nfs/dbraw/zinc/02/53/57/1031025357.db2.gz CIPQPJSUKUZBAI-HNNXBMFYSA-N 2 0 342.483 4.214 20 0 EIADRP C[C@H](c1ccccc1)N1CCC([NH2+][C@H]2CCc3cccnc3CC2)CC1 ZINC000421830393 1031034482 /nfs/dbraw/zinc/03/44/82/1031034482.db2.gz JUUDDVRAZPSZLW-NQIIRXRSSA-N 2 0 349.522 4.144 20 0 EIADRP C[C@H]([NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310081721 1031038613 /nfs/dbraw/zinc/03/86/13/1031038613.db2.gz JTWWQSHTFVIRIJ-UWJYYQICSA-N 2 0 326.459 4.389 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3c[nH]c4ccccc34)CC2)C1 ZINC000532442231 1031070367 /nfs/dbraw/zinc/07/03/67/1031070367.db2.gz MUPBXMMTFOEKQR-YLJYHZDGSA-N 2 0 339.527 4.343 20 0 EIADRP CC(C)C[NH+]1CCC(N[C@@H](C)c2ccccc2OC(F)(F)F)CC1 ZINC000532451942 1031085967 /nfs/dbraw/zinc/08/59/67/1031085967.db2.gz KECAHKFBKUZKGV-AWEZNQCLSA-N 2 0 344.421 4.356 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCCOc1ccc(Cl)cc1Cl ZINC000532464686 1031126262 /nfs/dbraw/zinc/12/62/62/1031126262.db2.gz ZIBFIHXMECYVNM-DVOMOZLQSA-N 2 0 345.314 4.081 20 0 EIADRP CN(Cc1ccccc1)CC(C)(C)[NH2+]CCCN(C)c1ccccc1 ZINC001168207523 1031263030 /nfs/dbraw/zinc/26/30/30/1031263030.db2.gz AKNONLLHHFDSAD-UHFFFAOYSA-N 2 0 339.527 4.013 20 0 EIADRP COc1ccccc1C[N@H+](C1CCC(C)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168205983 1031270501 /nfs/dbraw/zinc/27/05/01/1031270501.db2.gz OAAGEKFWHSOXDJ-YAEFEIELSA-N 2 0 330.516 4.346 20 0 EIADRP CC[N@@H+](Cc1cc2cccnc2o1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000449038587 1031377533 /nfs/dbraw/zinc/37/75/33/1031377533.db2.gz VYPNWYRPLNDNKY-IBGZPJMESA-N 2 0 349.478 4.172 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccc(C)cc2OC)cc1 ZINC000449069517 1031419717 /nfs/dbraw/zinc/41/97/17/1031419717.db2.gz XQLMUNJLKJBFFR-UHFFFAOYSA-N 2 0 326.484 4.135 20 0 EIADRP Cc1nccn1C[C@@H](C)C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449076529 1031429939 /nfs/dbraw/zinc/42/99/39/1031429939.db2.gz TZDLROHNRJKMKR-KRWDZBQOSA-N 2 0 348.579 4.096 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2CCOC3(CCC3)C2)cc1 ZINC000449080392 1031434731 /nfs/dbraw/zinc/43/47/31/1031434731.db2.gz VTTAYHOTQNXRDC-WIYYLYMNSA-N 2 0 342.527 4.252 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2ccc(C(C)C)cc2)[C@@H](C)C1 ZINC000531676916 1031467575 /nfs/dbraw/zinc/46/75/75/1031467575.db2.gz PEJIBJQZBDGKJQ-UGKGYDQZSA-N 2 0 346.559 4.079 20 0 EIADRP CCC[NH+]1CCC(C[NH2+]Cc2cnc(-c3ccccc3F)s2)CC1 ZINC000449132994 1031470241 /nfs/dbraw/zinc/47/02/41/1031470241.db2.gz WUSJSLNXOOQKHI-UHFFFAOYSA-N 2 0 347.503 4.161 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@H]2CSCCc3ccccc32)C1 ZINC000531681414 1031474437 /nfs/dbraw/zinc/47/44/37/1031474437.db2.gz VHWIFIOIVVOQKZ-PXNSSMCTSA-N 2 0 332.557 4.119 20 0 EIADRP C[C@H](c1ccccc1)[NH+]1CCC(NCc2cc3cccnc3o2)CC1 ZINC000449146320 1031480987 /nfs/dbraw/zinc/48/09/87/1031480987.db2.gz BYYVJUCMSCJUGQ-MRXNPFEDSA-N 2 0 335.451 4.143 20 0 EIADRP Cc1nccn1CC[NH2+][C@H](Cc1cccc(F)c1)c1cccc(F)c1 ZINC000531708085 1031493218 /nfs/dbraw/zinc/49/32/18/1031493218.db2.gz NOZJRPOKVVWCHX-HXUWFJFHSA-N 2 0 341.405 4.043 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1ccc(OC2CCCCC2)cc1 ZINC000531708618 1031494894 /nfs/dbraw/zinc/49/48/94/1031494894.db2.gz VUPLVKCBIUSEEW-LLGFUMIMSA-N 2 0 330.516 4.216 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCC[C@H]3OCC[C@@H]32)CC1 ZINC000449189391 1031506896 /nfs/dbraw/zinc/50/68/96/1031506896.db2.gz UPQJMUYAUNASSX-GUDVDZBRSA-N 2 0 336.564 4.213 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCC[C@@H]3OCC[C@H]32)CC1 ZINC000449189393 1031507344 /nfs/dbraw/zinc/50/73/44/1031507344.db2.gz UPQJMUYAUNASSX-OTWHNJEPSA-N 2 0 336.564 4.213 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccoc1 ZINC000531719686 1031520167 /nfs/dbraw/zinc/52/01/67/1031520167.db2.gz BDUKLOVQIQUWBW-HNNXBMFYSA-N 2 0 332.875 4.496 20 0 EIADRP COCC1CCC([NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000449216235 1031549929 /nfs/dbraw/zinc/54/99/29/1031549929.db2.gz QQJAFAMENNRVIF-PMJAUZGISA-N 2 0 344.543 4.082 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccncc1 ZINC000453099265 1031558304 /nfs/dbraw/zinc/55/83/04/1031558304.db2.gz YRYOVZWVFJKGAC-LJQANCHMSA-N 2 0 329.513 4.096 20 0 EIADRP C[C@H](CC(F)(F)F)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449249480 1031563485 /nfs/dbraw/zinc/56/34/85/1031563485.db2.gz LVJZINZFTZKKHI-CABCVRRESA-N 2 0 328.422 4.013 20 0 EIADRP C[C@H]1C[C@H](CC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CCO1 ZINC000449240905 1031578715 /nfs/dbraw/zinc/57/87/15/1031578715.db2.gz PSONSVGXWUTHOI-ZWKOTPCHSA-N 2 0 338.580 4.460 20 0 EIADRP CC(C)[N@H+](C)CCCN[C@H](C)c1ccc(Oc2ccccc2)cn1 ZINC000453088993 1031579905 /nfs/dbraw/zinc/57/99/05/1031579905.db2.gz ZSIXXJVXYLWSAB-QGZVFWFLSA-N 2 0 327.472 4.255 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)CCCc2cccnc2)c1 ZINC000453107482 1031597976 /nfs/dbraw/zinc/59/79/76/1031597976.db2.gz LELYOUNGXLHLAN-GOSISDBHSA-N 2 0 325.500 4.034 20 0 EIADRP CC[C@@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccncc1 ZINC000453153554 1031630162 /nfs/dbraw/zinc/63/01/62/1031630162.db2.gz VKGGJTCVKCEZRL-OSZJIOELSA-N 2 0 337.511 4.279 20 0 EIADRP CC(C)OCCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@H]21 ZINC000453194480 1031701683 /nfs/dbraw/zinc/70/16/83/1031701683.db2.gz NNTVXDIWILJMOG-BDTNDASRSA-N 2 0 344.543 4.224 20 0 EIADRP CC1(C)C[N@H+](Cc2ccncc2)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449417512 1031702376 /nfs/dbraw/zinc/70/23/76/1031702376.db2.gz YOTGVOHOVWQSCD-JOCHJYFZSA-N 2 0 349.522 4.204 20 0 EIADRP COCCC(C)(C)C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000453198905 1031708763 /nfs/dbraw/zinc/70/87/63/1031708763.db2.gz PESYJQNADREOQK-NJYVYQBISA-N 2 0 344.543 4.082 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1cc(-c2ccccc2)nn1C ZINC000453213450 1031729319 /nfs/dbraw/zinc/72/93/19/1031729319.db2.gz AGVLRGZENDJWBW-GOSISDBHSA-N 2 0 340.515 4.004 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C2CC2)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000188722221 1031730814 /nfs/dbraw/zinc/73/08/14/1031730814.db2.gz VHAGDBLOZHVBCA-QGZVFWFLSA-N 2 0 338.495 4.355 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCCCC1(F)F)c1cccc(OCC[NH+](C)C)c1 ZINC000453251813 1031774193 /nfs/dbraw/zinc/77/41/93/1031774193.db2.gz NUSHDUTZOWCCQU-WBVHZDCISA-N 2 0 340.458 4.103 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@@H]2CCCC2(F)F)CC1 ZINC000449499642 1031808613 /nfs/dbraw/zinc/80/86/13/1031808613.db2.gz UBLTZIMEGXNGML-WMZOPIPTSA-N 2 0 336.470 4.107 20 0 EIADRP COc1ccc2oc([C@@H](C)NC3C[C@H]4CC[C@@H](C3)[N@H+]4C)c(C)c2c1 ZINC000453341979 1031867187 /nfs/dbraw/zinc/86/71/87/1031867187.db2.gz HVXUUJJGPJMZJP-WZYMTQMTSA-N 2 0 328.456 4.026 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000531958348 1031876334 /nfs/dbraw/zinc/87/63/34/1031876334.db2.gz NVBMEVIGRXDVQU-IRXDYDNUSA-N 2 0 344.474 4.220 20 0 EIADRP Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000453387507 1031897183 /nfs/dbraw/zinc/89/71/83/1031897183.db2.gz FGGQTRAFOPNNIL-ZWKOTPCHSA-N 2 0 326.484 4.347 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)C1CCCCC1 ZINC000132824161 1031940271 /nfs/dbraw/zinc/94/02/71/1031940271.db2.gz MAROMKVJOXANRE-QFIPXVFZSA-N 2 0 344.543 4.092 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@H](C)c1nc2ccccc2s1 ZINC000453417584 1031952125 /nfs/dbraw/zinc/95/21/25/1031952125.db2.gz XVEGFGIYBKHQFZ-LSDHHAIUSA-N 2 0 331.529 4.252 20 0 EIADRP CCO[C@@H](C[NH2+][C@H](C)c1ccc(-n2ccnc2)cc1)c1ccccc1 ZINC000193431137 1032048365 /nfs/dbraw/zinc/04/83/65/1032048365.db2.gz SCQMKIKEOFCBHW-UTKZUKDTSA-N 2 0 335.451 4.301 20 0 EIADRP FC1(F)CCC[C@H]([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000512646590 1033612728 /nfs/dbraw/zinc/61/27/28/1033612728.db2.gz BMWAUGSCCQIEGO-LWYYNNOASA-N 2 0 348.481 4.455 20 0 EIADRP FC(F)(F)CCC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000512653433 1033622285 /nfs/dbraw/zinc/62/22/85/1033622285.db2.gz FHIFODHMDTVILA-RCCFBDPRSA-N 2 0 340.433 4.219 20 0 EIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](CC3CCC(F)(F)CC3)C2)CC1 ZINC001307440779 1033751163 /nfs/dbraw/zinc/75/11/63/1033751163.db2.gz SUVIIVWKPJMILI-GOSISDBHSA-N 2 0 328.491 4.256 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCC[C@H](C)C2)cc1OC ZINC000513103975 1034582934 /nfs/dbraw/zinc/58/29/34/1034582934.db2.gz AVASVQSSPMNCFN-PKOBYXMFSA-N 2 0 348.531 4.084 20 0 EIADRP c1csc(C[NH+]2CCC3(CC2)CC[NH+]([C@H]2C[C@H]4C[C@H]4C2)CC3)c1 ZINC001167933161 1034696370 /nfs/dbraw/zinc/69/63/70/1034696370.db2.gz BHDQNVUIMCLQJB-PIIMJCKOSA-N 2 0 330.541 4.225 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3c2c(F)ccc3F)c1 ZINC000513365059 1034893139 /nfs/dbraw/zinc/89/31/39/1034893139.db2.gz KFHQLTHSOYYYJE-IBGZPJMESA-N 2 0 330.422 4.194 20 0 EIADRP C/C(=C\c1ccc(Cl)cc1)C[NH2+]C[C@H]1CCCn2cc(C)nc21 ZINC000513526802 1035021621 /nfs/dbraw/zinc/02/16/21/1035021621.db2.gz QFNJNVYAEMNPIM-IDKBZEPQSA-N 2 0 329.875 4.415 20 0 EIADRP CC[NH+](CC)Cc1ccc(NCc2cn(-c3cc[nH+]cc3)nc2C)cc1 ZINC000345437682 1035220522 /nfs/dbraw/zinc/22/05/22/1035220522.db2.gz OGDXYQUOLZJIDM-UHFFFAOYSA-N 2 0 349.482 4.030 20 0 EIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@@H](CC(C)(C)C)c2ccccc2)CC1 ZINC000501005033 1035343585 /nfs/dbraw/zinc/34/35/85/1035343585.db2.gz CTUBBFDHVKKOFB-NRFANRHFSA-N 2 0 345.575 4.170 20 0 EIADRP C[C@H](CCc1ccccc1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501066457 1035366760 /nfs/dbraw/zinc/36/67/60/1035366760.db2.gz CQJSPKUHTYTRKQ-LJQANCHMSA-N 2 0 337.511 4.251 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000501380169 1035434415 /nfs/dbraw/zinc/43/44/15/1035434415.db2.gz CUIZLRKKNOWIDT-BAAYTWLHSA-N 2 0 338.417 4.183 20 0 EIADRP FC(F)(F)c1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000261818052 1035483253 /nfs/dbraw/zinc/48/32/53/1035483253.db2.gz WIZAOJBFLINDQT-GVDBMIGSSA-N 2 0 326.406 4.106 20 0 EIADRP FC(F)(F)CCCC[N@H+](Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000420301817 1035501679 /nfs/dbraw/zinc/50/16/79/1035501679.db2.gz BANIHVNCCOAQCN-OAHLLOKOSA-N 2 0 346.462 4.425 20 0 EIADRP FC(F)(F)CCCC[N@H+](Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2 ZINC000420301816 1035502799 /nfs/dbraw/zinc/50/27/99/1035502799.db2.gz BANIHVNCCOAQCN-HNNXBMFYSA-N 2 0 346.462 4.425 20 0 EIADRP C[NH2+]CC1CC[NH+]([C@H](C)c2nc(C)c(-c3ccc(Cl)cc3)o2)CC1 ZINC000420298420 1035503221 /nfs/dbraw/zinc/50/32/21/1035503221.db2.gz SBPQOZWLNGNUQY-CQSZACIVSA-N 2 0 347.890 4.296 20 0 EIADRP Cc1nc([C@H](C)N2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)oc1-c1ccc(Cl)cc1 ZINC000420315682 1035510167 /nfs/dbraw/zinc/51/01/67/1035510167.db2.gz XEPDGSZYZDPIMX-SDNTUTLCSA-N 2 0 345.874 4.034 20 0 EIADRP [NH3+]C[C@@H]1C[N@@H+]([C@@H]2CCc3c2cccc3Cl)C[C@H]1c1ccccc1 ZINC000420315846 1035515684 /nfs/dbraw/zinc/51/56/84/1035515684.db2.gz MVQOMNXGDPLRQU-MOXGXCLJSA-N 2 0 326.871 4.002 20 0 EIADRP CSCC1(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000595073426 1035554040 /nfs/dbraw/zinc/55/40/40/1035554040.db2.gz SLDWDSCGUNGRBI-IEBWSBKVSA-N 2 0 332.557 4.020 20 0 EIADRP C[C@H](c1ccc2ccccc2c1)[NH+]1CCC([C@H]2OCCC[C@H]2[NH3+])CC1 ZINC000420374242 1035571104 /nfs/dbraw/zinc/57/11/04/1035571104.db2.gz HFQMHERVDBIPSN-NPFVIJTESA-N 2 0 338.495 4.119 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000420418675 1035571835 /nfs/dbraw/zinc/57/18/35/1035571835.db2.gz XDYDWSLVNPCRNC-GXTWGEPZSA-N 2 0 349.931 4.422 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc3sccc3c2)[C@H](C)C1 ZINC000575222289 1035729967 /nfs/dbraw/zinc/72/99/67/1035729967.db2.gz ZMWVFJIJQRIMIX-VQIMIIECSA-N 2 0 346.540 4.128 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H]2CCc3[nH]c4ccc(C)cc4c3C2)CC1 ZINC000491010159 1035752573 /nfs/dbraw/zinc/75/25/73/1035752573.db2.gz SFXPICUPQBKNSM-GOSISDBHSA-N 2 0 339.527 4.045 20 0 EIADRP Cc1cc(C[NH2+]Cc2cccc(C[N@@H+](C)C(C)C)c2)cnc1Cl ZINC000760664917 1036009516 /nfs/dbraw/zinc/00/95/16/1036009516.db2.gz YJULMXXAOQGFEQ-UHFFFAOYSA-N 2 0 331.891 4.173 20 0 EIADRP CC1(c2ccccc2)CC([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C1 ZINC000668513838 1036029198 /nfs/dbraw/zinc/02/91/98/1036029198.db2.gz YAXLEJOUGYKLJK-UHFFFAOYSA-N 2 0 349.522 4.004 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C[C@H]2CCCC(F)(F)C2)CC1 ZINC000502317418 1036073439 /nfs/dbraw/zinc/07/34/39/1036073439.db2.gz NCGMIHLFXBBAIJ-SOLBZPMBSA-N 2 0 328.491 4.445 20 0 EIADRP C[N@H+](Cc1cccc(C2CC2)c1)C1CCN(CCc2ccccn2)CC1 ZINC000421319357 1036263093 /nfs/dbraw/zinc/26/30/93/1036263093.db2.gz MHXLAWDEBYWRSM-UHFFFAOYSA-N 2 0 349.522 4.098 20 0 EIADRP Cc1ccc(-c2nc(C[NH2+]C3CCC([NH+](C)C)CC3)cs2)cc1 ZINC000421365743 1036311111 /nfs/dbraw/zinc/31/11/11/1036311111.db2.gz AUNLWHFVWTUYMX-UHFFFAOYSA-N 2 0 329.513 4.081 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421379270 1036333855 /nfs/dbraw/zinc/33/38/55/1036333855.db2.gz UGGKNICGYOMXGK-QVOMUQBLSA-N 2 0 331.529 4.251 20 0 EIADRP Cc1cc(C[NH2+]C2CCC([NH+](C)C)CC2)ccc1Oc1cccnc1 ZINC000421380286 1036333878 /nfs/dbraw/zinc/33/38/78/1036333878.db2.gz YFOPTLWQCUSTBU-UHFFFAOYSA-N 2 0 339.483 4.145 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1cnn(C2CCCC2)c1 ZINC000502685104 1036505042 /nfs/dbraw/zinc/50/50/42/1036505042.db2.gz IIIFCAMYJPBXRX-SFHVURJKSA-N 2 0 332.536 4.161 20 0 EIADRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000502696046 1036512733 /nfs/dbraw/zinc/51/27/33/1036512733.db2.gz BMJSLHZGLUHBPA-BVYCBKJFSA-N 2 0 344.543 4.213 20 0 EIADRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000502696880 1036513557 /nfs/dbraw/zinc/51/35/57/1036513557.db2.gz MFQOATVOKHOPOL-FCHUYYIVSA-N 2 0 344.543 4.357 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1 ZINC000502725583 1036587023 /nfs/dbraw/zinc/58/70/23/1036587023.db2.gz XUVKLZSTDGHCGE-IPJJNNNSSA-N 2 0 344.543 4.213 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cccc(F)c2)CC1 ZINC000513758667 1036731431 /nfs/dbraw/zinc/73/14/31/1036731431.db2.gz AWQRFZDPEKMFKH-UHFFFAOYSA-N 2 0 326.459 4.359 20 0 EIADRP c1cn(C2CC[NH+](C3CC[NH+](CC4CC4)CC3)CC2)c2ccccc12 ZINC001168389434 1036751518 /nfs/dbraw/zinc/75/15/18/1036751518.db2.gz QCPKLDSNFTWNMO-UHFFFAOYSA-N 2 0 337.511 4.153 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccncc1Cl ZINC000421824897 1036781202 /nfs/dbraw/zinc/78/12/02/1036781202.db2.gz KWJSWFBUNOFSSH-INIZCTEOSA-N 2 0 343.902 4.298 20 0 EIADRP C[C@H]([NH2+]Cc1cc2ccc(F)cc2[nH]1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000486719639 1036825206 /nfs/dbraw/zinc/82/52/06/1036825206.db2.gz HMXVBOGXCOTLFH-GOEBONIOSA-N 2 0 329.463 4.050 20 0 EIADRP Fc1ccc2cc(C[NH2+]C3CC[NH+](CC4CCCC4)CC3)[nH]c2c1 ZINC000486718754 1036825966 /nfs/dbraw/zinc/82/59/66/1036825966.db2.gz FNPSZHVBHARGFP-UHFFFAOYSA-N 2 0 329.463 4.051 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccnc(Cl)c2)cc1 ZINC000163567652 1036833411 /nfs/dbraw/zinc/83/34/11/1036833411.db2.gz PPURYLJFPQAXPM-OAHLLOKOSA-N 2 0 331.891 4.428 20 0 EIADRP Cc1cc([C@H]([NH2+]C2CCC([NH+](C)C)CC2)c2cccnc2)ccc1F ZINC000421871917 1036840192 /nfs/dbraw/zinc/84/01/92/1036840192.db2.gz GHVFELZEQNMZTE-GRERDSQWSA-N 2 0 341.474 4.081 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CCc2cccc3[nH]ccc32)CCN1Cc1ccccc1 ZINC000503123229 1036921919 /nfs/dbraw/zinc/92/19/19/1036921919.db2.gz RMWSXKGBFUCZLY-GHTZIAJQSA-N 2 0 347.506 4.353 20 0 EIADRP CC1CC[NH+](Cc2cccc(C[NH2+]C/C=C/c3ccncc3)c2)CC1 ZINC000487278500 1037091616 /nfs/dbraw/zinc/09/16/16/1037091616.db2.gz OCVGEHJFLNDWEJ-ZZXKWVIFSA-N 2 0 335.495 4.117 20 0 EIADRP C[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CC1(C)C ZINC000487278185 1037091967 /nfs/dbraw/zinc/09/19/67/1037091967.db2.gz MJUYYNSVZYILNB-NQIIRXRSSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(Cl)nc1 ZINC000272265916 1037146945 /nfs/dbraw/zinc/14/69/45/1037146945.db2.gz AKVPTBQQKHUFBX-BXWFABGCSA-N 2 0 343.902 4.296 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)COC2)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000272691535 1037267923 /nfs/dbraw/zinc/26/79/23/1037267923.db2.gz PQQGJUYLHSHXRI-JZXOWHBKSA-N 2 0 328.500 4.020 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNC(=[NH2+])Nc3ccccc3)cc2)C1 ZINC000057887941 1037289455 /nfs/dbraw/zinc/28/94/55/1037289455.db2.gz PUHFTIOFWUZEBE-QGZVFWFLSA-N 2 0 336.483 4.055 20 0 EIADRP Cc1cnc([C@H](C)C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000273508581 1037487995 /nfs/dbraw/zinc/48/79/95/1037487995.db2.gz ZZDNCGACKAIKLA-GPMSIDNRSA-N 2 0 343.540 4.055 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+]Cc1ccc(OCC(F)(F)F)cc1)C(C)(C)C ZINC000604771096 1037509399 /nfs/dbraw/zinc/50/93/99/1037509399.db2.gz VQRYHKUBSBOORM-INIZCTEOSA-N 2 0 346.437 4.084 20 0 EIADRP CN(c1ccccc1)c1ccc(C[NH2+]CCC2CC[NH+](C)CC2)cc1 ZINC000591709083 1037557962 /nfs/dbraw/zinc/55/79/62/1037557962.db2.gz NQXJVNPYGJVIKT-UHFFFAOYSA-N 2 0 337.511 4.276 20 0 EIADRP C[C@H]([NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000488551030 1037662279 /nfs/dbraw/zinc/66/22/79/1037662279.db2.gz ZOHQJIUJKFPPCB-OJAHFUOMSA-N 2 0 346.584 4.407 20 0 EIADRP C[C@@H]1C[C@@H](C[N@@H+]2CCc3sccc3[C@@H]2c2cccs2)CC[NH2+]1 ZINC000414680355 1037793631 /nfs/dbraw/zinc/79/36/31/1037793631.db2.gz MYGTWSVJFFXDLF-QWQRMKEZSA-N 2 0 332.538 4.145 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](c1ccc(F)cc1)C1CCC1 ZINC000422718234 1037812917 /nfs/dbraw/zinc/81/29/17/1037812917.db2.gz PMSBLRFWBQWYJS-JLTOFOAXSA-N 2 0 327.447 4.180 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)cc1OCCC ZINC000422766504 1037827963 /nfs/dbraw/zinc/82/79/63/1037827963.db2.gz QDXPOICHKFEDPS-FUHWJXTLSA-N 2 0 334.504 4.057 20 0 EIADRP [NH3+][C@H]1C[C@@H]([NH2+]CCc2csc(-c3ccccc3)n2)c2ccccc21 ZINC000422776630 1037829887 /nfs/dbraw/zinc/82/98/87/1037829887.db2.gz AQSXDIDIHNCRAT-RBUKOAKNSA-N 2 0 335.476 4.087 20 0 EIADRP c1cc(-c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)cc2)ccn1 ZINC000422774374 1037830390 /nfs/dbraw/zinc/83/03/90/1037830390.db2.gz WTDWXIWTGZPSAA-FDFHNCONSA-N 2 0 335.495 4.149 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCCc1ccc(C(C)C)cc1 ZINC000422771333 1037831166 /nfs/dbraw/zinc/83/11/66/1037831166.db2.gz XYRKCYQSUAMGAZ-MRXNPFEDSA-N 2 0 325.500 4.256 20 0 EIADRP CCC[C@@H](CCc1ccccc1)[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422783679 1037833254 /nfs/dbraw/zinc/83/32/54/1037833254.db2.gz OQVBGFXHUUCMSH-APWZRJJASA-N 2 0 325.500 4.301 20 0 EIADRP Cc1cccc(Oc2cc(C[NH2+]C3CCC(C[NH3+])CC3)ccn2)c1C ZINC000422803723 1037835998 /nfs/dbraw/zinc/83/59/98/1037835998.db2.gz GJLRMFXYKWJZPB-UHFFFAOYSA-N 2 0 339.483 4.098 20 0 EIADRP CCOc1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C(C)C)cc1OCC ZINC000422799094 1037836210 /nfs/dbraw/zinc/83/62/10/1037836210.db2.gz VCUVILJYBODNJI-PGGWPXBNSA-N 2 0 346.515 4.054 20 0 EIADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(COCc2ccccc2)cc1 ZINC000422867690 1037848891 /nfs/dbraw/zinc/84/88/91/1037848891.db2.gz SYZUZLYNZRKONA-FGZHOGPDSA-N 2 0 338.495 4.011 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000311123376 1037858085 /nfs/dbraw/zinc/85/80/85/1037858085.db2.gz HPZJHEKDDHEXNG-XMSQKQJNSA-N 2 0 338.495 4.258 20 0 EIADRP Cc1cccc(C2(C[NH2+][C@@H](C)c3ccc(C[NH3+])nc3C)CCCC2)c1 ZINC000422901760 1037863922 /nfs/dbraw/zinc/86/39/22/1037863922.db2.gz CDTFPPRMIMQZED-KRWDZBQOSA-N 2 0 337.511 4.320 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000422940966 1037876000 /nfs/dbraw/zinc/87/60/00/1037876000.db2.gz ULCPFYQNDVTPHL-KEYYUXOJSA-N 2 0 329.513 4.157 20 0 EIADRP CCOc1ccc([C@H]([NH2+][C@H](C)CCCC[NH3+])c2ccccc2)cc1 ZINC000422946743 1037885638 /nfs/dbraw/zinc/88/56/38/1037885638.db2.gz PDUOQSAQRWITOD-DYESRHJHSA-N 2 0 326.484 4.282 20 0 EIADRP COc1ccc([C@@H]([NH2+][C@@H](C)CCCC[NH3+])c2ccc(F)cc2)cc1 ZINC000422950969 1037887311 /nfs/dbraw/zinc/88/73/11/1037887311.db2.gz ZFRHFIZRETWCOB-YWZLYKJASA-N 2 0 330.447 4.031 20 0 EIADRP CCC[C@@H]([NH2+][C@H](CCC[NH3+])COC)c1ccc(Cl)c(Cl)c1 ZINC000422958606 1037889495 /nfs/dbraw/zinc/88/94/95/1037889495.db2.gz YKJXXQPHWFZGNB-CZUORRHYSA-N 2 0 333.303 4.178 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1c(C)c(C)c(C)c(C)c1C ZINC000422993812 1037891339 /nfs/dbraw/zinc/89/13/39/1037891339.db2.gz GIIMKFLOJCHRTA-QGZVFWFLSA-N 2 0 325.500 4.242 20 0 EIADRP Fc1ccc(Oc2ccc(CC[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)cc2)cc1 ZINC000423001585 1037897956 /nfs/dbraw/zinc/89/79/56/1037897956.db2.gz IBJINKVJDWWQRU-DFNIBXOVSA-N 2 0 340.442 4.033 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000423056241 1037923206 /nfs/dbraw/zinc/92/32/06/1037923206.db2.gz XEDYSUKTZDRXLB-BDJLRTHQSA-N 2 0 343.284 4.146 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000423052578 1037938638 /nfs/dbraw/zinc/93/86/38/1037938638.db2.gz QURWDBVKJCCWAS-DOMZBBRYSA-N 2 0 333.476 4.044 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1cc2ccccc2s1 ZINC000423053862 1037941840 /nfs/dbraw/zinc/94/18/40/1037941840.db2.gz BDXMTFATCAZZOL-JSGCOSHPSA-N 2 0 325.481 4.475 20 0 EIADRP C[C@H]([NH2+]CC1CCC(F)(F)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000503859641 1037945452 /nfs/dbraw/zinc/94/54/52/1037945452.db2.gz NFBAAHVHOSTARO-HNNXBMFYSA-N 2 0 340.458 4.103 20 0 EIADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000423092030 1037955253 /nfs/dbraw/zinc/95/52/53/1037955253.db2.gz AGAWQGSOEJUFCY-HJWJTTGWSA-N 2 0 326.406 4.201 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H]1CCCc2sc(Cl)cc21 ZINC000423126403 1037968647 /nfs/dbraw/zinc/96/86/47/1037968647.db2.gz ISIBCJAIYCFURJ-XHDPSFHLSA-N 2 0 335.904 4.292 20 0 EIADRP c1ccc([C@H](C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C2CC2)cc1 ZINC000423121285 1037970446 /nfs/dbraw/zinc/97/04/46/1037970446.db2.gz APESPKYRCWDBOE-FUDKSRODSA-N 2 0 348.490 4.026 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2nccc3ccccc32)c1 ZINC000607167340 1037980621 /nfs/dbraw/zinc/98/06/21/1037980621.db2.gz KEHLOVXNXRPZHP-UHFFFAOYSA-N 2 0 333.479 4.365 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@@H](C)Oc1ccc(C(C)C)cc1 ZINC000423105890 1037983754 /nfs/dbraw/zinc/98/37/54/1037983754.db2.gz JCNPTQBCQNICDJ-HZPDHXFCSA-N 2 0 341.499 4.090 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000423112095 1037987008 /nfs/dbraw/zinc/98/70/08/1037987008.db2.gz XBMHIUHDDQEUEK-BACDZXNISA-N 2 0 326.406 4.201 20 0 EIADRP c1ccc(C2CC(C[NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)C2)cc1 ZINC000423111264 1037991768 /nfs/dbraw/zinc/99/17/68/1037991768.db2.gz INORSBRZEXZMNJ-ZJIWQVHUSA-N 2 0 348.490 4.026 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1F ZINC000423145672 1037998768 /nfs/dbraw/zinc/99/87/68/1037998768.db2.gz LYCFIIBPQGFCAV-VMRPVKRXSA-N 2 0 340.442 4.041 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+]Cc2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000503921339 1038002461 /nfs/dbraw/zinc/00/24/61/1038002461.db2.gz QJJMWMIJPJIGTR-UHFFFAOYSA-N 2 0 334.813 4.180 20 0 EIADRP [NH3+][C@@H]1C[C@@H]([NH+]2CCC(Cc3cccc(F)c3F)CC2)c2ccccc21 ZINC000423153207 1038004869 /nfs/dbraw/zinc/00/48/69/1038004869.db2.gz GXSWJBUFXHHVMU-WOJBJXKFSA-N 2 0 342.433 4.364 20 0 EIADRP C[C@H]([NH2+]CC1CCC(F)(F)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000503906773 1038005047 /nfs/dbraw/zinc/00/50/47/1038005047.db2.gz ANTHSHUCMJENGA-HNNXBMFYSA-N 2 0 340.458 4.103 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)CC1 ZINC000503914561 1038012504 /nfs/dbraw/zinc/01/25/04/1038012504.db2.gz YATWBGDZDMMJOG-UHFFFAOYSA-N 2 0 334.410 4.046 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000423210417 1038039772 /nfs/dbraw/zinc/03/97/72/1038039772.db2.gz GFIKUABPNOZISN-IKGGRYGDSA-N 2 0 327.516 4.202 20 0 EIADRP Clc1ccccc1C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cccs1 ZINC000423239200 1038056241 /nfs/dbraw/zinc/05/62/41/1038056241.db2.gz AYGGPYARCQLOIK-YOEHRIQHSA-N 2 0 334.916 4.275 20 0 EIADRP c1csc(C[N@@H+](CC2CCCCCC2)[C@@H]2CC23CC[NH2+]CC3)n1 ZINC000414725797 1038056536 /nfs/dbraw/zinc/05/65/36/1038056536.db2.gz WXSCDRQFBJYRBY-QGZVFWFLSA-N 2 0 333.545 4.058 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(SCC(F)F)cc1 ZINC000423214932 1038060773 /nfs/dbraw/zinc/06/07/73/1038060773.db2.gz MBCLGANOCUZQQF-KCQAQPDRSA-N 2 0 328.472 4.083 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1OC(F)F)[C@@H]1CCC[NH2+]C1 ZINC000423216080 1038061274 /nfs/dbraw/zinc/06/12/74/1038061274.db2.gz NYYKJWSDNNZZFI-IJEWVQPXSA-N 2 0 348.437 4.480 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(SCC(F)(F)F)cc1)[C@H]1CCC[NH2+]C1 ZINC000423216229 1038063497 /nfs/dbraw/zinc/06/34/97/1038063497.db2.gz OENIEOHDTGCXSM-GUTXKFCHSA-N 2 0 346.462 4.380 20 0 EIADRP COc1ccc([C@@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2ccccc2Cl)cc1 ZINC000423250938 1038081946 /nfs/dbraw/zinc/08/19/46/1038081946.db2.gz RFVGDDFBRUHGGO-MGPUTAFESA-N 2 0 344.886 4.027 20 0 EIADRP CC1(C)Cc2cccc(C[NH2+]CCCCC[NH+]3CCCCC3)c2O1 ZINC000606470087 1038091157 /nfs/dbraw/zinc/09/11/57/1038091157.db2.gz UANYETIRQILGHB-UHFFFAOYSA-N 2 0 330.516 4.146 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2ccc(Br)s2)cc1 ZINC000423290317 1038092550 /nfs/dbraw/zinc/09/25/50/1038092550.db2.gz CUVGXUFCAPPGSY-GHMZBOCLSA-N 2 0 339.302 4.381 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCCOc3ccc(Cl)cc32)cc1 ZINC000423291259 1038094526 /nfs/dbraw/zinc/09/45/26/1038094526.db2.gz HNJXBVDDVOFYND-SCLBCKFNSA-N 2 0 330.859 4.363 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)cc1 ZINC000423290071 1038095200 /nfs/dbraw/zinc/09/52/00/1038095200.db2.gz CHEOENVLQACINH-OLZOCXBDSA-N 2 0 338.373 4.456 20 0 EIADRP Cc1ccc(C)c(OCCC[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000606540422 1038123779 /nfs/dbraw/zinc/12/37/79/1038123779.db2.gz NHVPYCPJCNUKGF-FQEVSTJZSA-N 2 0 330.516 4.023 20 0 EIADRP CC(C)[C@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc2[nH]c(=O)oc2c1 ZINC000423295372 1038124431 /nfs/dbraw/zinc/12/44/31/1038124431.db2.gz WWHARKLOLPUNCD-DJJJIMSYSA-N 2 0 339.439 4.040 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]CC3(C)CC[NH2+]CC3)cs2)cs1 ZINC000423335416 1038152276 /nfs/dbraw/zinc/15/22/76/1038152276.db2.gz RWFOPZQGNZXUPT-GFCCVEGCSA-N 2 0 335.542 4.220 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[C@H](C[NH3+])C2)CCC3)cc1 ZINC000574310515 1038165225 /nfs/dbraw/zinc/16/52/25/1038165225.db2.gz STVQCSMUMUECFI-USXIJHARSA-N 2 0 341.524 4.213 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423356630 1038171998 /nfs/dbraw/zinc/17/19/98/1038171998.db2.gz GZEQULFFCRESEQ-WMLDXEAASA-N 2 0 329.513 4.220 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccsc1 ZINC000423356606 1038172453 /nfs/dbraw/zinc/17/24/53/1038172453.db2.gz QVDWIGWHCXXNOF-GOSISDBHSA-N 2 0 332.900 4.195 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423361253 1038179969 /nfs/dbraw/zinc/17/99/69/1038179969.db2.gz AAPQQHJPILMACV-YZVOILCLSA-N 2 0 328.431 4.267 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)C1 ZINC000423366079 1038186971 /nfs/dbraw/zinc/18/69/71/1038186971.db2.gz LFPLJONJPXSVOB-YYIAUSFCSA-N 2 0 326.406 4.201 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H]2CC[NH2+][C@H](C)C2)CCC3)cc1 ZINC000423379263 1038190151 /nfs/dbraw/zinc/19/01/51/1038190151.db2.gz MWODHEHMDOJCOR-HYVNUMGLSA-N 2 0 341.524 4.226 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC[NH2+]1 ZINC000423380571 1038194671 /nfs/dbraw/zinc/19/46/71/1038194671.db2.gz MZAYVAXNNPGAOH-JWZBEHFJSA-N 2 0 326.406 4.072 20 0 EIADRP CC[C@@H]([NH2+]CC1(COC)CC[NH2+]CC1)c1ccc(Cl)c(Cl)c1 ZINC000423388704 1038198290 /nfs/dbraw/zinc/19/82/90/1038198290.db2.gz KXCIGUWNOIIDMA-MRXNPFEDSA-N 2 0 345.314 4.050 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2ccccc2Cl)c2ccsc2)CC[NH2+]1 ZINC000423393604 1038199962 /nfs/dbraw/zinc/19/99/62/1038199962.db2.gz YZJWHDYMABKGPC-QBIMZIAESA-N 2 0 334.916 4.415 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(OC(F)(F)F)cc1 ZINC000423376805 1038205896 /nfs/dbraw/zinc/20/58/96/1038205896.db2.gz JBRSHNQRXRFSLU-GFCCVEGCSA-N 2 0 336.357 4.039 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1nc(-c2ccccc2)cs1 ZINC000423423074 1038211580 /nfs/dbraw/zinc/21/15/80/1038211580.db2.gz LVVFLAPIXJFJNY-BZUAXINKSA-N 2 0 329.513 4.226 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)c2ccccc12 ZINC000423403653 1038215713 /nfs/dbraw/zinc/21/57/13/1038215713.db2.gz XCGPFPJJMIHTHH-OAHLLOKOSA-N 2 0 332.447 4.302 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000423456935 1038238532 /nfs/dbraw/zinc/23/85/32/1038238532.db2.gz HNXHYODJLZNPCH-LXZKKBNFSA-N 2 0 329.513 4.287 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423459225 1038240881 /nfs/dbraw/zinc/24/08/81/1038240881.db2.gz LAVJOJSKAIMMGH-DXCKQFNASA-N 2 0 347.503 4.426 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000423467493 1038245222 /nfs/dbraw/zinc/24/52/22/1038245222.db2.gz JBSWICPTIYOCIV-PLYYQAHHSA-N 2 0 340.433 4.449 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1cc(Cl)ccc1OC(F)F ZINC000423472792 1038246654 /nfs/dbraw/zinc/24/66/54/1038246654.db2.gz NHHJCJCIKPHKPY-GMXVVIOVSA-N 2 0 332.822 4.110 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000423472178 1038247471 /nfs/dbraw/zinc/24/74/71/1038247471.db2.gz MXSAGEKLIVLADG-WBAXXEDZSA-N 2 0 343.540 4.210 20 0 EIADRP CCc1nc2c(s1)[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)CCC2 ZINC000423500568 1038255506 /nfs/dbraw/zinc/25/55/06/1038255506.db2.gz KMCWPMXQVREISF-HZPDHXFCSA-N 2 0 329.513 4.153 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)CCS2 ZINC000423503166 1038256301 /nfs/dbraw/zinc/25/63/01/1038256301.db2.gz FLWHCTGYZJUSLW-MOPGFXCFSA-N 2 0 342.508 4.302 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423486809 1038259593 /nfs/dbraw/zinc/25/95/93/1038259593.db2.gz SUXWRPAHIRKYRB-DLBZAZTESA-N 2 0 327.516 4.346 20 0 EIADRP CC[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(OC)c(OC)c1 ZINC000423495318 1038263409 /nfs/dbraw/zinc/26/34/09/1038263409.db2.gz BQZGKSDCXPPMJJ-RBUKOAKNSA-N 2 0 342.483 4.225 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000423493044 1038263672 /nfs/dbraw/zinc/26/36/72/1038263672.db2.gz PJBPNTHSRSODBD-RBOXIYTFSA-N 2 0 333.476 4.036 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000423496256 1038265136 /nfs/dbraw/zinc/26/51/36/1038265136.db2.gz GGWSAGJGXRCVAU-LSBZLQRGSA-N 2 0 346.421 4.094 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cc1OCCC ZINC000423492313 1038265649 /nfs/dbraw/zinc/26/56/49/1038265649.db2.gz MNIPSTQKDDDWIW-LZLYRXPVSA-N 2 0 334.504 4.042 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423492248 1038265709 /nfs/dbraw/zinc/26/57/09/1038265709.db2.gz MIQVJLMHJZBEMH-UXLLHSPISA-N 2 0 328.431 4.396 20 0 EIADRP CC(C)Oc1ccc([C@H]2CCC[C@@H]2[NH2+]CCC2=CC[NH2+]CC2)cc1 ZINC000423534829 1038267507 /nfs/dbraw/zinc/26/75/07/1038267507.db2.gz AZHSNOYFEQRFOC-RTWAWAEBSA-N 2 0 328.500 4.009 20 0 EIADRP C[C@H]([NH2+]CCC[NH2+]C1CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000423531280 1038268794 /nfs/dbraw/zinc/26/87/94/1038268794.db2.gz SGKHBDLGQAANIQ-LBPRGKRZSA-N 2 0 332.435 4.134 20 0 EIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cccc(OC(F)F)c1 ZINC000423511496 1038271404 /nfs/dbraw/zinc/27/14/04/1038271404.db2.gz TWQDSKLPKUEVKW-KDOFPFPSSA-N 2 0 334.410 4.419 20 0 EIADRP [NH3+]CCC[C@H]([NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21)c1ccccc1 ZINC000423522250 1038273090 /nfs/dbraw/zinc/27/30/90/1038273090.db2.gz UHTDRJNJVYIIJV-JKSUJKDBSA-N 2 0 334.385 4.161 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H](c2cccc(F)c2)c2cccc(Cl)c2)C1 ZINC000423517979 1038274033 /nfs/dbraw/zinc/27/40/33/1038274033.db2.gz UVBVTYVXQAMWRD-VMDGZTHMSA-N 2 0 332.850 4.286 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]C1CCC(OC2CCCC2)CC1)c1ccccc1 ZINC000423526459 1038279497 /nfs/dbraw/zinc/27/94/97/1038279497.db2.gz ZJPZXUXUGBJTEB-DQVLVPHSSA-N 2 0 330.516 4.327 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]CCC2=CC[NH2+]CC2)cc1 ZINC000423559801 1038282567 /nfs/dbraw/zinc/28/25/67/1038282567.db2.gz PEMPLOGNIYIEIL-KRWDZBQOSA-N 2 0 336.479 4.323 20 0 EIADRP CC(C)Oc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)cc1Cl ZINC000423540225 1038284914 /nfs/dbraw/zinc/28/49/14/1038284914.db2.gz DCWTVFWWYRVUQN-PQEBFOHHSA-N 2 0 336.907 4.166 20 0 EIADRP Fc1ccc(C([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)c2ccc(F)cc2)cc1 ZINC000423540609 1038289093 /nfs/dbraw/zinc/28/90/93/1038289093.db2.gz KALRFJHKYJTQMZ-MBOZVWFJSA-N 2 0 342.433 4.032 20 0 EIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423554944 1038291210 /nfs/dbraw/zinc/29/12/10/1038291210.db2.gz XKWCCRROCRRATC-HAGHYFMRSA-N 2 0 340.536 4.318 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@@H]1CCCC[NH2+]C1 ZINC000423556825 1038295400 /nfs/dbraw/zinc/29/54/00/1038295400.db2.gz MTILJOCXGVBWKI-MLGOLLRUSA-N 2 0 333.476 4.050 20 0 EIADRP C[C@H]1CCC[C@@H](C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C1 ZINC000574553057 1038302015 /nfs/dbraw/zinc/30/20/15/1038302015.db2.gz YRSHWDOPZLGQIJ-PKOBYXMFSA-N 2 0 330.516 4.076 20 0 EIADRP C[C@@H]1C[C@H](C[N@@H+]2CCC[C@H]2c2ccc(Br)s2)CC[NH2+]1 ZINC000414760294 1038350207 /nfs/dbraw/zinc/35/02/07/1038350207.db2.gz QHDJGKJAWFSZHV-UPJWGTAASA-N 2 0 343.334 4.036 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000490142364 1038357454 /nfs/dbraw/zinc/35/74/54/1038357454.db2.gz HQCGKGURPLNTDJ-LJQANCHMSA-N 2 0 334.866 4.500 20 0 EIADRP CCC1(C[NH2+][C@@H](C)c2ccccn2)CC[NH+](Cc2ccccc2)CC1 ZINC000539041294 1038779207 /nfs/dbraw/zinc/77/92/07/1038779207.db2.gz ITDWLCLKBRAGJJ-IBGZPJMESA-N 2 0 337.511 4.425 20 0 EIADRP c1ccc2c(c1)sc1c2CCC[C@H]1[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000480758668 1038799737 /nfs/dbraw/zinc/79/97/37/1038799737.db2.gz NRWBESLRUYPHRP-KBXCAEBGSA-N 2 0 326.509 4.353 20 0 EIADRP Cc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000539082140 1038829250 /nfs/dbraw/zinc/82/92/50/1038829250.db2.gz LWJGXWRRGFMAKB-JTSKRJEESA-N 2 0 338.495 4.274 20 0 EIADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000424381076 1038839872 /nfs/dbraw/zinc/83/98/72/1038839872.db2.gz YENNDNIOTLRCEK-MWQQHZPXSA-N 2 0 326.406 4.201 20 0 EIADRP Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000504895221 1038841297 /nfs/dbraw/zinc/84/12/97/1038841297.db2.gz RPSWJSRATSZUBD-UWJYYQICSA-N 2 0 338.495 4.274 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(C)cc2C)[C@@H](C)C1 ZINC000480887606 1038853971 /nfs/dbraw/zinc/85/39/71/1038853971.db2.gz FMIFRNMICOYHPG-ZJOUEHCJSA-N 2 0 332.532 4.091 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+]CC[C@@H]2CCCC[N@@H+]2C)cc1OC ZINC000539252281 1038896666 /nfs/dbraw/zinc/89/66/66/1038896666.db2.gz ILKJDAFIPRPSJX-WMZOPIPTSA-N 2 0 334.504 4.009 20 0 EIADRP C[NH+](C)C1CCC([NH+]2CCC3(CC2)OC(C)(C)c2ccccc23)CC1 ZINC001168327954 1038930951 /nfs/dbraw/zinc/93/09/51/1038930951.db2.gz VAYYXWUJTYJAMK-UHFFFAOYSA-N 2 0 342.527 4.116 20 0 EIADRP CC[N@H+](Cc1ccc(C(F)(F)F)cc1)C1CCC([NH+](C)C)CC1 ZINC001168328442 1038942456 /nfs/dbraw/zinc/94/24/56/1038942456.db2.gz GROMMTSXTVZZGB-UHFFFAOYSA-N 2 0 328.422 4.400 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CCSCc1ccc(Cl)cc1Cl ZINC000539296771 1038946785 /nfs/dbraw/zinc/94/67/85/1038946785.db2.gz LCWGAQDDCUDUBA-BLLLJJGKSA-N 2 0 347.355 4.156 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(OCC(F)(F)F)cc2)C1 ZINC000481024739 1038962040 /nfs/dbraw/zinc/96/20/40/1038962040.db2.gz OQTDSOJOKCVWHG-GJZGRUSLSA-N 2 0 344.421 4.010 20 0 EIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)CC3CCCCCC3)CC2)CC1 ZINC000537621045 1038982399 /nfs/dbraw/zinc/98/23/99/1038982399.db2.gz SAAUWBVSNCZJAP-UHFFFAOYSA-N 2 0 349.607 4.085 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cccc3c[nH]nc32)CC1 ZINC000537622152 1038986589 /nfs/dbraw/zinc/98/65/89/1038986589.db2.gz PCKDETAKCLGPRW-QGZVFWFLSA-N 2 0 340.515 4.039 20 0 EIADRP COc1cc(Cl)c(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1Cl ZINC000414805538 1038988690 /nfs/dbraw/zinc/98/86/90/1038988690.db2.gz GHQZNWJEPXASKB-LLVKDONJSA-N 2 0 339.266 4.312 20 0 EIADRP c1ccc(CC(Cc2ccccc2)[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000378931084 1039038944 /nfs/dbraw/zinc/03/89/44/1039038944.db2.gz YIYROVRNYOVJIR-GMAHTHKFSA-N 2 0 334.507 4.057 20 0 EIADRP C[N@H+](CCCN[C@@H](c1ncc[nH]1)C1CCCCC1)C1CCCCC1 ZINC000552040780 1039061617 /nfs/dbraw/zinc/06/16/17/1039061617.db2.gz XIKHMNHXINUWIO-LJQANCHMSA-N 2 0 332.536 4.275 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cnc(C3CCCCC3)s2)C[C@H]1C ZINC000552071571 1039093971 /nfs/dbraw/zinc/09/39/71/1039093971.db2.gz PIUOXVGACWSHQS-NVXWUHKLSA-N 2 0 335.561 4.495 20 0 EIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CC2(c3ccccn3)CCC2)CC1 ZINC000552099517 1039157936 /nfs/dbraw/zinc/15/79/36/1039157936.db2.gz LLIRUVLYCGTCOQ-ICSRJNTNSA-N 2 0 341.543 4.136 20 0 EIADRP Cc1nc(C(C)C)ccc1C[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000555422769 1039179166 /nfs/dbraw/zinc/17/91/66/1039179166.db2.gz FOGQAIWSMYBRLQ-VQIMIIECSA-N 2 0 329.532 4.256 20 0 EIADRP Cc1ncc([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)s1 ZINC000090406508 1039223265 /nfs/dbraw/zinc/22/32/65/1039223265.db2.gz LNHJXLDPPXPRBF-ZDUSSCGKSA-N 2 0 335.542 4.076 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2cccc(OCc3ccccc3)c2)C1 ZINC000481294924 1039230100 /nfs/dbraw/zinc/23/01/00/1039230100.db2.gz MZQGGPMAXWLLAT-AZUAARDMSA-N 2 0 338.495 4.258 20 0 EIADRP C[NH2+]C[C@H](C)CNCc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000414834099 1039259386 /nfs/dbraw/zinc/25/93/86/1039259386.db2.gz GXCDHLLSESCTSV-JTQLQIEISA-N 2 0 344.311 4.062 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)c(C)c1OC ZINC000552225098 1039276944 /nfs/dbraw/zinc/27/69/44/1039276944.db2.gz AICKNZZEGWEGDU-AEFFLSMTSA-N 2 0 348.531 4.175 20 0 EIADRP C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1CC[C@]2(C1)CCC[NH+](C)C2 ZINC000555598410 1039421696 /nfs/dbraw/zinc/42/16/96/1039421696.db2.gz ZACGXEKXCIHKNQ-WMLDXEAASA-N 2 0 342.405 4.064 20 0 EIADRP Cc1ccnc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)c1 ZINC000514087936 1039588091 /nfs/dbraw/zinc/58/80/91/1039588091.db2.gz JHRCZCHKILILQC-OALUTQOASA-N 2 0 337.511 4.473 20 0 EIADRP COc1cccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC000514086143 1039589912 /nfs/dbraw/zinc/58/99/12/1039589912.db2.gz YVRXEHUTAKRZTD-UHFFFAOYSA-N 2 0 338.495 4.228 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCc2ccsc2)CC1 ZINC000514090977 1039594584 /nfs/dbraw/zinc/59/45/84/1039594584.db2.gz XRAFKBZDFOUSIL-UHFFFAOYSA-N 2 0 328.525 4.323 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1cc(C)cc(C)c1 ZINC000065932098 1039598333 /nfs/dbraw/zinc/59/83/33/1039598333.db2.gz IZWICJKEZWWNCI-UHFFFAOYSA-N 2 0 340.511 4.314 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CC2(c3cccc(C(F)(F)F)c3)CCC2)CC[N@@H+]1C ZINC000122161323 1039605170 /nfs/dbraw/zinc/60/51/70/1039605170.db2.gz QHKXXMRBHYNJQP-PBHICJAKSA-N 2 0 340.433 4.199 20 0 EIADRP Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cn1 ZINC000514097966 1039634063 /nfs/dbraw/zinc/63/40/63/1039634063.db2.gz CHLSOGABQDBQPF-XPWALMASSA-N 2 0 349.522 4.170 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1C ZINC000122323640 1039643091 /nfs/dbraw/zinc/64/30/91/1039643091.db2.gz LPDAIRYUKFSSCT-SFHVURJKSA-N 2 0 326.484 4.095 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cc(C)ccc1OC ZINC000093370292 1039673645 /nfs/dbraw/zinc/67/36/45/1039673645.db2.gz JGMRUGHSMRUHJX-HXUWFJFHSA-N 2 0 326.484 4.306 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(-c2ccc(F)cc2)s1 ZINC000643533722 1039708546 /nfs/dbraw/zinc/70/85/46/1039708546.db2.gz CGQMFLOOSCLJCR-FZKQIMNGSA-N 2 0 330.472 4.347 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@H]1CCc2c1cc(Br)cc2Cl ZINC000534794910 1039791199 /nfs/dbraw/zinc/79/11/99/1039791199.db2.gz VAKWERGOKHGSPO-HNNXBMFYSA-N 2 0 345.712 4.021 20 0 EIADRP Cc1cc(C)c([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1C ZINC000481727217 1039791566 /nfs/dbraw/zinc/79/15/66/1039791566.db2.gz PJVSVAVHCHLQSH-IBGZPJMESA-N 2 0 340.511 4.403 20 0 EIADRP COc1ccc2cc(C[N@@H+]3CC[C@@H](C[NH+](C)CC4CC4)C3)ccc2c1 ZINC000537647425 1039806644 /nfs/dbraw/zinc/80/66/44/1039806644.db2.gz QEGSYDFFWRBRFI-IBGZPJMESA-N 2 0 338.495 4.012 20 0 EIADRP COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000123028221 1039850296 /nfs/dbraw/zinc/85/02/96/1039850296.db2.gz NNVATNFYXWUSQQ-SFHVURJKSA-N 2 0 338.495 4.450 20 0 EIADRP FC(F)(F)c1cccc(CCC[NH2+]C2CC[NH+](CC3CC3)CC2)c1 ZINC001168361018 1039865178 /nfs/dbraw/zinc/86/51/78/1039865178.db2.gz ZKNCNAKJXXNCNT-UHFFFAOYSA-N 2 0 340.433 4.102 20 0 EIADRP C(=C/c1ccc(OCc2ccccc2)cc1)\C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666955512 1039867946 /nfs/dbraw/zinc/86/79/46/1039867946.db2.gz SMVPJOZWEJENII-ZMTJCJBESA-N 2 0 348.490 4.011 20 0 EIADRP Cc1nc([C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cs1 ZINC000552920143 1039868870 /nfs/dbraw/zinc/86/88/70/1039868870.db2.gz SSSAPUUFJWJSTJ-JTDSTZFVSA-N 2 0 343.540 4.403 20 0 EIADRP CC(C)c1ccccc1NC(=O)C[C@@H](C)[NH2+]CC1([NH3+])CCCCCC1 ZINC000414857189 1039896800 /nfs/dbraw/zinc/89/68/00/1039896800.db2.gz BSZWFETYWWLFRL-QGZVFWFLSA-N 2 0 345.531 4.168 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccccc1-c1ccc(Cl)cc1 ZINC000481923494 1039898359 /nfs/dbraw/zinc/89/83/59/1039898359.db2.gz OQOFGLIBMMFBKR-MGPUTAFESA-N 2 0 328.887 4.437 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@H](C)Cc2ccccc2C(F)(F)F)CC1 ZINC000481926215 1039899600 /nfs/dbraw/zinc/89/96/00/1039899600.db2.gz WSWLXFVVVXWPOG-OAHLLOKOSA-N 2 0 342.449 4.491 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000481957865 1039911384 /nfs/dbraw/zinc/91/13/84/1039911384.db2.gz QRDGMHQVEHYTQC-MRXNPFEDSA-N 2 0 347.503 4.258 20 0 EIADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000481976522 1039922298 /nfs/dbraw/zinc/92/22/98/1039922298.db2.gz ZKVNESKRTDIRKC-XJKSGUPXSA-N 2 0 347.503 4.256 20 0 EIADRP Fc1ccccc1[C@H]1CC[C@@H]([NH2+]C2CCN(c3ccccn3)CC2)C1 ZINC000482074513 1039983398 /nfs/dbraw/zinc/98/33/98/1039983398.db2.gz WHXVLYNKSMJYNE-FUHWJXTLSA-N 2 0 339.458 4.115 20 0 EIADRP C(=C/c1ccccc1)\C[NH2+]CC1(N2CCSCC2)CCCCC1 ZINC000482082847 1040003620 /nfs/dbraw/zinc/00/36/20/1040003620.db2.gz YWTUXGGQTBTSOY-JXMROGBWSA-N 2 0 330.541 4.041 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H](CO)CCC(C)(C)C)CC1 ZINC000551276300 1040132935 /nfs/dbraw/zinc/13/29/35/1040132935.db2.gz BCCSGFFCIAKWLJ-KBWCOIMZSA-N 2 0 346.559 4.206 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)[C@]1(C)CCCO1 ZINC000551268556 1040134371 /nfs/dbraw/zinc/13/43/71/1040134371.db2.gz XYHOSQDLBSAECN-OPYAIIAOSA-N 2 0 330.516 4.108 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2c3cc(F)ccc3C[C@H]2C)c1 ZINC000482323921 1040168555 /nfs/dbraw/zinc/16/85/55/1040168555.db2.gz UJJGFRKNQMULGQ-QVKFZJNVSA-N 2 0 326.459 4.301 20 0 EIADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1cc(Cl)ccc1OC(F)F ZINC000482350844 1040188885 /nfs/dbraw/zinc/18/88/85/1040188885.db2.gz VZOFWWNFXOTLGV-GFCCVEGCSA-N 2 0 346.849 4.324 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](CN[C@H](C)c2ccccc2Br)C1 ZINC000482362199 1040201522 /nfs/dbraw/zinc/20/15/22/1040201522.db2.gz VSZBVVZWTSTGKC-HUUCEWRRSA-N 2 0 339.321 4.220 20 0 EIADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(-c2ccccc2F)s1 ZINC000553439251 1040219414 /nfs/dbraw/zinc/21/94/14/1040219414.db2.gz UDKDPPJBNQZMRO-CQSZACIVSA-N 2 0 330.472 4.467 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(F)cc1 ZINC000482434323 1040242899 /nfs/dbraw/zinc/24/28/99/1040242899.db2.gz FNKLMMJLDYXELO-HKUYNNGSSA-N 2 0 326.459 4.041 20 0 EIADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000482456275 1040254770 /nfs/dbraw/zinc/25/47/70/1040254770.db2.gz ZGWQUNFJGWFIJH-XQFWAAQXSA-N 2 0 334.507 4.074 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(OC)c1 ZINC000479461734 1040367917 /nfs/dbraw/zinc/36/79/17/1040367917.db2.gz DLJDMMGEBSUECV-SIKLNZKXSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995350 1040404385 /nfs/dbraw/zinc/40/43/85/1040404385.db2.gz KPBCCIVWCZSQBF-YOEHRIQHSA-N 2 0 340.433 4.291 20 0 EIADRP CNc1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC000712218040 1040421627 /nfs/dbraw/zinc/42/16/27/1040421627.db2.gz HVJLVQUPSKBEEC-UHFFFAOYSA-N 2 0 349.522 4.216 20 0 EIADRP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1cccc2cccnc21 ZINC000479604231 1040504445 /nfs/dbraw/zinc/50/44/45/1040504445.db2.gz MFLPVAUDAYETAY-UHFFFAOYSA-N 2 0 325.500 4.369 20 0 EIADRP CCc1nc(CN2CCC(C[NH2+]C3[C@@H](C)CCC[C@@H]3C)CC2)cs1 ZINC000482874300 1040531704 /nfs/dbraw/zinc/53/17/04/1040531704.db2.gz NQLNOQIZGVASGL-HOTGVXAUSA-N 2 0 349.588 4.332 20 0 EIADRP CSC1(C[NH2+][C@@H]2CCC[C@@H]2CCc2ccccc2)CC[NH+](C)CC1 ZINC000515353219 1040672459 /nfs/dbraw/zinc/67/24/59/1040672459.db2.gz GNIBTGBYRPKXKY-WOJBJXKFSA-N 2 0 346.584 4.205 20 0 EIADRP c1ccc(N2CCC[C@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)cc1 ZINC000483123058 1040715904 /nfs/dbraw/zinc/71/59/04/1040715904.db2.gz DDNJJLAUXSOVBJ-FQEVSTJZSA-N 2 0 341.543 4.042 20 0 EIADRP C[C@]1(C[NH2+]Cc2cccc3cnccc32)CC[N@H+](Cc2ccccc2)C1 ZINC000311581911 1040733727 /nfs/dbraw/zinc/73/37/27/1040733727.db2.gz DAEGVTZCQOBTKN-HSZRJFAPSA-N 2 0 345.490 4.237 20 0 EIADRP CC[NH+](CC)C[C@H]1CCN([C@H](C)c2cccc(Br)c2)C1 ZINC000483209516 1040768610 /nfs/dbraw/zinc/76/86/10/1040768610.db2.gz BVGDNQKOEJWQNO-HUUCEWRRSA-N 2 0 339.321 4.174 20 0 EIADRP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000669846975 1040850803 /nfs/dbraw/zinc/85/08/03/1040850803.db2.gz UIKYOLMWUFUGSM-QHAWAJNXSA-N 2 0 332.507 4.407 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)CC(C)(C)c1c[nH]c2ccccc21)N(C)C1CC1 ZINC000462805140 1040969327 /nfs/dbraw/zinc/96/93/27/1040969327.db2.gz MJTAMGJJFYDZKO-JKSUJKDBSA-N 2 0 327.516 4.296 20 0 EIADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(SCC(F)F)cc1 ZINC000480160224 1041015918 /nfs/dbraw/zinc/01/59/18/1041015918.db2.gz OAEHRQGQDBIPNG-AWEZNQCLSA-N 2 0 328.472 4.180 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccc(Sc2ccc(F)cc2)cc1 ZINC000538097058 1041046799 /nfs/dbraw/zinc/04/67/99/1041046799.db2.gz OHMYDKFSQMEMBG-QRWLVFNGSA-N 2 0 344.499 4.407 20 0 EIADRP CC(C)[C@@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1cccnc1 ZINC000538115699 1041067671 /nfs/dbraw/zinc/06/76/71/1041067671.db2.gz AWLKXZWBWGWDFY-GHTZIAJQSA-N 2 0 325.500 4.279 20 0 EIADRP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000480244552 1041100973 /nfs/dbraw/zinc/10/09/73/1041100973.db2.gz VMXBQDHDJWRSKK-OPAMFIHVSA-N 2 0 338.470 4.445 20 0 EIADRP CCC[NH+]1CCC([NH2+]CC(C)(C)c2c(F)cccc2Cl)CC1 ZINC000538159302 1041101889 /nfs/dbraw/zinc/10/18/89/1041101889.db2.gz OFFFZAXHWCGVRT-UHFFFAOYSA-N 2 0 326.887 4.221 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)CCC2 ZINC000540148314 1041160468 /nfs/dbraw/zinc/16/04/68/1041160468.db2.gz YVPQNKRDNLQWPH-LAUBAEHRSA-N 2 0 330.516 4.030 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)CCC2 ZINC000540148313 1041160893 /nfs/dbraw/zinc/16/08/93/1041160893.db2.gz YVPQNKRDNLQWPH-DYESRHJHSA-N 2 0 330.516 4.030 20 0 EIADRP Cc1cc(N2CCC([NH2+][C@@H]3C[C@H](C)CC[C@@H]3C(C)C)CC2)nc(C)n1 ZINC000484302732 1041191142 /nfs/dbraw/zinc/19/11/42/1041191142.db2.gz QXVSENIEKXXPLG-CDHQVMDDSA-N 2 0 344.547 4.113 20 0 EIADRP CCCC[C@H](CCC)C[NH2+][C@@H]1CCN(Cc2ccccn2)C[C@H]1C ZINC000484306406 1041192137 /nfs/dbraw/zinc/19/21/37/1041192137.db2.gz WPXAPDOBMHOKAL-SVFBPWRDSA-N 2 0 331.548 4.488 20 0 EIADRP Cc1cc(C)c2c(c1)[C@@H](NC1CC[NH+](C(C)(C)C)CC1)CCCO2 ZINC000540189586 1041233411 /nfs/dbraw/zinc/23/34/11/1041233411.db2.gz BFBGRXNCYJNBMA-IBGZPJMESA-N 2 0 330.516 4.370 20 0 EIADRP CCO[C@@H](CC[NH2+]C1CC[NH+](C2CCCCC2)CC1)C1CCCC1 ZINC000484479136 1041273073 /nfs/dbraw/zinc/27/30/73/1041273073.db2.gz WJUXPSMOQLDIFH-NRFANRHFSA-N 2 0 336.564 4.359 20 0 EIADRP COCCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CCCC1 ZINC000484508611 1041293748 /nfs/dbraw/zinc/29/37/48/1041293748.db2.gz PZOPMQYWSOVDFT-PZJWPPBQSA-N 2 0 344.543 4.084 20 0 EIADRP COc1ccc([C@@H]([NH2+]CCCC[NH+]2CCC(C)CC2)C2CC2)cc1 ZINC000540259070 1041326898 /nfs/dbraw/zinc/32/68/98/1041326898.db2.gz OUCPHVQZWBCUSV-NRFANRHFSA-N 2 0 330.516 4.248 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)C1 ZINC000540301593 1041352261 /nfs/dbraw/zinc/35/22/61/1041352261.db2.gz LQUYJOUCDUESDK-SJKOYZFVSA-N 2 0 327.299 4.376 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](CCC(=O)c2ccc(C)cc2)CC1 ZINC000480519959 1041365806 /nfs/dbraw/zinc/36/58/06/1041365806.db2.gz CBIXSJCVQRPZIX-UHFFFAOYSA-N 2 0 330.516 4.012 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2CCCc3nn(-c4ccccc4)cc32)cc1 ZINC000643514086 1041425259 /nfs/dbraw/zinc/42/52/59/1041425259.db2.gz VIONZFNEGGVANK-IERDGZPVSA-N 2 0 346.478 4.059 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](CCCC2CCOCC2)CC1 ZINC000463284746 1041474060 /nfs/dbraw/zinc/47/40/60/1041474060.db2.gz WDOGCXQZLWLNJU-IBGZPJMESA-N 2 0 336.564 4.170 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CCc2c(F)cccc2F)CCN1Cc1ccccc1 ZINC000401998634 1041474479 /nfs/dbraw/zinc/47/44/79/1041474479.db2.gz DGDVMFGZWCGHSV-FUHWJXTLSA-N 2 0 344.449 4.150 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)C2=CCCCC2)[C@H](C)C1 ZINC000480693759 1041475680 /nfs/dbraw/zinc/47/56/80/1041475680.db2.gz NDDNXLGUXHNUAM-QUCCMNQESA-N 2 0 336.564 4.240 20 0 EIADRP COCCC[C@H](C)[NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000480693542 1041476292 /nfs/dbraw/zinc/47/62/92/1041476292.db2.gz CMYZSRXIODLASE-OTWHNJEPSA-N 2 0 332.532 4.069 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000195132195 1041484734 /nfs/dbraw/zinc/48/47/34/1041484734.db2.gz WJKCORPLOJQRGP-AEFFLSMTSA-N 2 0 342.458 4.007 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C)c(Br)c2)C[C@@H]1C ZINC000538718943 1041490752 /nfs/dbraw/zinc/49/07/52/1041490752.db2.gz YBRDCWWMOVARIR-HOCLYGCPSA-N 2 0 339.321 4.062 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1F ZINC000480714260 1041493035 /nfs/dbraw/zinc/49/30/35/1041493035.db2.gz YGMDWABIOPVABH-DMUMMCEESA-N 2 0 346.490 4.077 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)[C@H]1CCOC1 ZINC000480732589 1041494672 /nfs/dbraw/zinc/49/46/72/1041494672.db2.gz ZFZAYCFHVHXCDI-UDKICSLYSA-N 2 0 344.543 4.069 20 0 EIADRP CC[C@H](CSc1ccc(Cl)cc1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000480733986 1041496806 /nfs/dbraw/zinc/49/68/06/1041496806.db2.gz BLHRAZKPJLFGAW-BRWVUGGUSA-N 2 0 338.948 4.427 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)[C@@H](C)C1 ZINC000540496205 1041498292 /nfs/dbraw/zinc/49/82/92/1041498292.db2.gz YDYQNCIAKAJSCR-UMGGQSCQSA-N 2 0 342.527 4.389 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)[C@@H](C)C1 ZINC000540496203 1041499206 /nfs/dbraw/zinc/49/92/06/1041499206.db2.gz YDYQNCIAKAJSCR-LCLWPZTBSA-N 2 0 342.527 4.389 20 0 EIADRP CC[N@@H+](Cc1ccc(OC)cc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000538761882 1041536599 /nfs/dbraw/zinc/53/65/99/1041536599.db2.gz IUEOQTNFRBUIQR-OAQYLSRUSA-N 2 0 338.495 4.039 20 0 EIADRP c1ccc(CC[C@H](Cc2ccccc2)[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000461799871 1041592943 /nfs/dbraw/zinc/59/29/43/1041592943.db2.gz XEAKXVZMZKISIX-SMIHKQSGSA-N 2 0 348.534 4.447 20 0 EIADRP Cn1cncc1CCC[NH2+][C@](C)(Cc1ccccc1)c1ccccc1 ZINC000516782694 1041751523 /nfs/dbraw/zinc/75/15/23/1041751523.db2.gz ZQMYMUYZACDGNO-JOCHJYFZSA-N 2 0 333.479 4.100 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000540984009 1041766211 /nfs/dbraw/zinc/76/62/11/1041766211.db2.gz VEULDVVLLLTERW-HOIFWPIMSA-N 2 0 342.527 4.326 20 0 EIADRP Cc1ccccc1O[C@H]1CCCC[C@H]1[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000541078949 1041800336 /nfs/dbraw/zinc/80/03/36/1041800336.db2.gz VHTVRRZKNVAIIV-CTNGQTDRSA-N 2 0 330.516 4.147 20 0 EIADRP CC[C@H](C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000402486991 1041819400 /nfs/dbraw/zinc/81/94/00/1041819400.db2.gz ASRVHNKRKAKRDR-RYRKJORJSA-N 2 0 342.449 4.465 20 0 EIADRP CC[NH+]1CCC(C[NH2+]Cc2ccc(-c3ccccc3OC)cc2)CC1 ZINC000517048097 1041852931 /nfs/dbraw/zinc/85/29/31/1041852931.db2.gz KTTOCGBLVQSPTM-UHFFFAOYSA-N 2 0 338.495 4.184 20 0 EIADRP C[C@H](CCC(F)(F)F)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000541555753 1042011966 /nfs/dbraw/zinc/01/19/66/1042011966.db2.gz IRZJHNOWVWWJBG-INMHGKMJSA-N 2 0 328.422 4.218 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCCOCc2ccccc2)C1 ZINC000541579336 1042013711 /nfs/dbraw/zinc/01/37/11/1042013711.db2.gz WQKWBZKFLLMJIS-RBBKRZOGSA-N 2 0 344.543 4.180 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCCOCc2ccccc2)C1 ZINC000541579339 1042014726 /nfs/dbraw/zinc/01/47/26/1042014726.db2.gz WQKWBZKFLLMJIS-UNMCSNQZSA-N 2 0 344.543 4.180 20 0 EIADRP FC1(F)CC(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000425940695 1042017368 /nfs/dbraw/zinc/01/73/68/1042017368.db2.gz XNIPNMOUVJKIMA-SLFFLAALSA-N 2 0 348.481 4.312 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000438087599 1042040172 /nfs/dbraw/zinc/04/01/72/1042040172.db2.gz LXNMXOLEXHIJNW-TWMKSMIVSA-N 2 0 334.470 4.455 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]C2CCC(C)CC2)cc1OC ZINC000517638842 1042114159 /nfs/dbraw/zinc/11/41/59/1042114159.db2.gz YMJDMKRKYUURND-UHFFFAOYSA-N 2 0 348.531 4.084 20 0 EIADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CCCOc2cccc3ccccc32)C1 ZINC000464776222 1042158303 /nfs/dbraw/zinc/15/83/03/1042158303.db2.gz KWPCDNSDTKQVGJ-IBGZPJMESA-N 2 0 340.511 4.272 20 0 EIADRP CC[N@H+](C)C[C@@H]1CC[NH+](CCCSc2ccccc2Cl)C1 ZINC000464792244 1042169539 /nfs/dbraw/zinc/16/95/39/1042169539.db2.gz WCRXDXGUHJTXFC-HNNXBMFYSA-N 2 0 326.937 4.096 20 0 EIADRP C[N@H+](CCSc1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464833802 1042180412 /nfs/dbraw/zinc/18/04/12/1042180412.db2.gz GCIMVBJBGAPILU-HXUWFJFHSA-N 2 0 340.536 4.233 20 0 EIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@@H](c1ccccc1)C1CCCCC1 ZINC000542084070 1042271088 /nfs/dbraw/zinc/27/10/88/1042271088.db2.gz AJFCAXCQVRZOPK-YADHBBJMSA-N 2 0 344.543 4.135 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H](c2ccccc2)C2CCCCC2)CC1 ZINC000542086022 1042272395 /nfs/dbraw/zinc/27/23/95/1042272395.db2.gz OZAOYLNYLOMPSX-QFIPXVFZSA-N 2 0 344.543 4.399 20 0 EIADRP Fc1cccc(-c2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)s2)c1 ZINC000509573135 1042385537 /nfs/dbraw/zinc/38/55/37/1042385537.db2.gz ZAKVTVPFASGJLJ-DLBZAZTESA-N 2 0 330.472 4.271 20 0 EIADRP CSc1ccc([C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1 ZINC000173419255 1042571714 /nfs/dbraw/zinc/57/17/14/1042571714.db2.gz PRRYGVLLWGTNDY-AWEZNQCLSA-N 2 0 332.488 4.460 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCC[N@H+](C)Cc2ccccc2)cc1F ZINC000304618827 1042578958 /nfs/dbraw/zinc/57/89/58/1042578958.db2.gz NUUBBMIYQPFZPS-MRXNPFEDSA-N 2 0 330.447 4.007 20 0 EIADRP CC(C)Oc1ccc(C[NH2+]CCC[N@H+](C)Cc2ccccc2)cc1 ZINC000304728535 1042587052 /nfs/dbraw/zinc/58/70/52/1042587052.db2.gz XHYHGSXRKKEWQW-UHFFFAOYSA-N 2 0 326.484 4.086 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1ccc2[nH]cnc2c1 ZINC000518765609 1042675494 /nfs/dbraw/zinc/67/54/94/1042675494.db2.gz QCKCQNXWVRMDBT-QGZVFWFLSA-N 2 0 348.494 4.227 20 0 EIADRP c1ccc2c(c1)C=C(C[NH2+]Cc1ccc(C[NH+]3CCCCC3)cc1)CO2 ZINC000518771226 1042678926 /nfs/dbraw/zinc/67/89/26/1042678926.db2.gz NBFQDZYLEBAJJC-UHFFFAOYSA-N 2 0 348.490 4.238 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1cccc2c1NCCC2 ZINC000894386174 1042712455 /nfs/dbraw/zinc/71/24/55/1042712455.db2.gz ZXQSLXROIIZDGQ-UHFFFAOYSA-N 2 0 337.511 4.175 20 0 EIADRP CC(C)c1ccc(-c2ncc(CN3CC[C@H](C[NH+](C)C)C3)s2)cc1 ZINC000174861615 1042716282 /nfs/dbraw/zinc/71/62/82/1042716282.db2.gz CVOVNMFEYCKOOI-MRXNPFEDSA-N 2 0 343.540 4.317 20 0 EIADRP c1csc(C[N@H+]2CCC[C@@H](CNc3cc[nH+]c4ccccc34)C2)c1 ZINC000518893855 1042742132 /nfs/dbraw/zinc/74/21/32/1042742132.db2.gz ILTDTPPHBCAOLA-INIZCTEOSA-N 2 0 337.492 4.042 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000415006318 1042804007 /nfs/dbraw/zinc/80/40/07/1042804007.db2.gz QIFKHLKIHBFUAY-FRFSOERESA-N 2 0 328.422 4.134 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](c1ccccc1)c1ccc(C)cc1 ZINC000493075094 1042811208 /nfs/dbraw/zinc/81/12/08/1042811208.db2.gz BIOFOMOEGYKOMV-FGZHOGPDSA-N 2 0 340.511 4.031 20 0 EIADRP CCc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000309710701 1042819340 /nfs/dbraw/zinc/81/93/40/1042819340.db2.gz JESXOHUZMZRMCF-SJLPKXTDSA-N 2 0 328.525 4.483 20 0 EIADRP CCc1ncc(CNC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)s1 ZINC000310422760 1042836743 /nfs/dbraw/zinc/83/67/43/1042836743.db2.gz QXTJIKRHAYEAQQ-SFHVURJKSA-N 2 0 343.540 4.097 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)[C@H](C)C2 ZINC000493206340 1042843513 /nfs/dbraw/zinc/84/35/13/1042843513.db2.gz QIQZHFIGICTPRM-VFNWGFHPSA-N 2 0 326.459 4.219 20 0 EIADRP COc1ccc(C)cc1[C@H](C)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310970366 1042848444 /nfs/dbraw/zinc/84/84/44/1042848444.db2.gz DDQQVYWGAWSCGW-AZUAARDMSA-N 2 0 338.495 4.176 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2cc[nH]c21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311064193 1042851444 /nfs/dbraw/zinc/85/14/44/1042851444.db2.gz JCQRFOBBWYZVPE-DYESRHJHSA-N 2 0 333.479 4.168 20 0 EIADRP COCCC[C@@H](C)[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000177859980 1042852494 /nfs/dbraw/zinc/85/24/94/1042852494.db2.gz MKOVSZHSVYZHCT-GOSISDBHSA-N 2 0 340.511 4.320 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2cccnc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311609396 1042862579 /nfs/dbraw/zinc/86/25/79/1042862579.db2.gz DZEDYWIJGNPCND-XMSQKQJNSA-N 2 0 345.490 4.235 20 0 EIADRP CC[C@@H]1C[C@H](C[NH+]2CCC(CC[N@H+](CC)CC3CC3)CC2)CCO1 ZINC000507774388 1042875924 /nfs/dbraw/zinc/87/59/24/1042875924.db2.gz KAIQIBJWPBKJSN-NHCUHLMSSA-N 2 0 336.564 4.026 20 0 EIADRP CC[C@@H]1C[C@H](C[N@H+](CC)C[C@H]2CC[NH+](Cc3ccccc3)C2)CCO1 ZINC000507784522 1042929065 /nfs/dbraw/zinc/92/90/65/1042929065.db2.gz RNPZIUSHFZEVPR-YPAWHYETSA-N 2 0 344.543 4.036 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)[C@H](OC)c1ccccc1 ZINC000493915906 1042976173 /nfs/dbraw/zinc/97/61/73/1042976173.db2.gz GGEYUNGIIGEPJN-AVRDEDQJSA-N 2 0 340.511 4.394 20 0 EIADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000493937913 1042986726 /nfs/dbraw/zinc/98/67/26/1042986726.db2.gz UNDHOMVZOSWUOA-XMSQKQJNSA-N 2 0 338.495 4.148 20 0 EIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000493937910 1042987230 /nfs/dbraw/zinc/98/72/30/1042987230.db2.gz UNDHOMVZOSWUOA-AVRDEDQJSA-N 2 0 338.495 4.148 20 0 EIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000493978304 1042990749 /nfs/dbraw/zinc/99/07/49/1042990749.db2.gz RMCJMPHOFFAYNX-AVRDEDQJSA-N 2 0 340.511 4.393 20 0 EIADRP C[C@@H]1C[C@@H](n2c3ccccc3nc2C[NH3+])C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168007392 1043016922 /nfs/dbraw/zinc/01/69/22/1043016922.db2.gz RVXLTIIIXJXPQS-IZZQQSIFSA-N 2 0 348.494 4.109 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000190817439 1043039620 /nfs/dbraw/zinc/03/96/20/1043039620.db2.gz UBVXCYXOOMCTED-UHFFFAOYSA-N 2 0 336.401 4.365 20 0 EIADRP CC[C@@H]1C[C@H](C[N@H+](C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000507813144 1043058044 /nfs/dbraw/zinc/05/80/44/1043058044.db2.gz JDTJNAOBNBVIIP-PSWRPDDJSA-N 2 0 344.543 4.177 20 0 EIADRP Cc1cncc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)c1 ZINC000184278800 1043086945 /nfs/dbraw/zinc/08/69/45/1043086945.db2.gz UWRVKOANJQPJJY-PKOBYXMFSA-N 2 0 337.511 4.473 20 0 EIADRP COc1cccc(C[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168009155 1043090635 /nfs/dbraw/zinc/09/06/35/1043090635.db2.gz YWFYCMQZUMKAHG-ROUUACIJSA-N 2 0 338.495 4.226 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3cc(O)cc(F)c3)cc2)C1 ZINC000185467230 1043187770 /nfs/dbraw/zinc/18/77/70/1043187770.db2.gz NRZRYQXBKZAWJY-INIZCTEOSA-N 2 0 342.458 4.053 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2cnc3ccccc3c2)C1 ZINC000727467013 1043227309 /nfs/dbraw/zinc/22/73/09/1043227309.db2.gz LOFLVANVEKGTRC-ROUUACIJSA-N 2 0 325.500 4.083 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(c2ccc(F)cc2Cl)CCCC1 ZINC000427886274 1043249405 /nfs/dbraw/zinc/24/94/05/1043249405.db2.gz LOSFNZAAYVTJSF-KBXCAEBGSA-N 2 0 338.898 4.221 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(c2ccc(F)cc2Cl)CCCC1 ZINC000427886279 1043249433 /nfs/dbraw/zinc/24/94/33/1043249433.db2.gz LOSFNZAAYVTJSF-RDTXWAMCSA-N 2 0 338.898 4.221 20 0 EIADRP COc1cccc2cc(C[NH2+]CCCC[N@@H+]3CCCC[C@H]3C)oc21 ZINC000727643644 1043255230 /nfs/dbraw/zinc/25/52/30/1043255230.db2.gz IEQMPYJGRGAGFB-MRXNPFEDSA-N 2 0 330.472 4.186 20 0 EIADRP CC(C)Oc1ccc(CC[C@H](C)[NH2+][C@@H](C)C2CC[NH+](C)CC2)cc1 ZINC000166012321 1043268001 /nfs/dbraw/zinc/26/80/01/1043268001.db2.gz RKZXZLUUSNSDPO-ROUUACIJSA-N 2 0 332.532 4.115 20 0 EIADRP C[NH+](C)CCC1CC[NH+](CCCc2ccc(C(F)(F)F)cc2)CC1 ZINC000674005494 1043279531 /nfs/dbraw/zinc/27/95/31/1043279531.db2.gz JFTOIHYCXRYIPI-UHFFFAOYSA-N 2 0 342.449 4.302 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)s2)cc1 ZINC000166764802 1043311467 /nfs/dbraw/zinc/31/14/67/1043311467.db2.gz WPTKUWCJBCUTSK-IAGOWNOFSA-N 2 0 342.508 4.140 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2cccnc2c1 ZINC000674067644 1043385913 /nfs/dbraw/zinc/38/59/13/1043385913.db2.gz MRFXEFYUGRPDEB-AVRDEDQJSA-N 2 0 345.490 4.235 20 0 EIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)C1CCC(F)(F)CC1 ZINC000474027458 1043431792 /nfs/dbraw/zinc/43/17/92/1043431792.db2.gz DDZKZOCSCPEYAP-OAHLLOKOSA-N 2 0 337.458 4.102 20 0 EIADRP CC(C)Oc1cccc(C[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)c1 ZINC000520948960 1043453046 /nfs/dbraw/zinc/45/30/46/1043453046.db2.gz KSUYSYBSZIJHMJ-OALUTQOASA-N 2 0 332.532 4.322 20 0 EIADRP CC(C)Oc1cccc(C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC000520948959 1043453478 /nfs/dbraw/zinc/45/34/78/1043453478.db2.gz KSUYSYBSZIJHMJ-KDURUIRLSA-N 2 0 332.532 4.322 20 0 EIADRP CCc1nc(C)c(CN(C)[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)o1 ZINC000428242678 1043461382 /nfs/dbraw/zinc/46/13/82/1043461382.db2.gz WEBWELBOWQSTNO-APWZRJJASA-N 2 0 341.499 4.030 20 0 EIADRP Cc1cscc1C[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12 ZINC000494465825 1043500933 /nfs/dbraw/zinc/50/09/33/1043500933.db2.gz NYCQACMNNREOKP-MISYRCLQSA-N 2 0 326.509 4.057 20 0 EIADRP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+]CC1CC[NH+](C)CC1 ZINC000521222092 1043655909 /nfs/dbraw/zinc/65/59/09/1043655909.db2.gz JUNLHDKIIOTFCT-GXDHUFHOSA-N 2 0 326.406 4.040 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)[C@H]1CCCCO1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000681394485 1043734027 /nfs/dbraw/zinc/73/40/27/1043734027.db2.gz SHHQWXJWQPWNHM-SESVDKBCSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)[C@H]1CCCCO1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000681394479 1043734691 /nfs/dbraw/zinc/73/46/91/1043734691.db2.gz SHHQWXJWQPWNHM-CEWLAPEOSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1csc(Cl)c1 ZINC000191184350 1043793198 /nfs/dbraw/zinc/79/31/98/1043793198.db2.gz IBQBFLSRZWSKHZ-ZDUSSCGKSA-N 2 0 338.904 4.193 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H]1Cc2[nH]c3ccccc3c2C1 ZINC000442714656 1043816195 /nfs/dbraw/zinc/81/61/95/1043816195.db2.gz KNZXCKPJXQAWKJ-LJQANCHMSA-N 2 0 347.506 4.265 20 0 EIADRP Clc1cccc2c1C[C@@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)C2 ZINC001168707179 1043895264 /nfs/dbraw/zinc/89/52/64/1043895264.db2.gz KCYJLMGCIRMGAX-KRWDZBQOSA-N 2 0 332.919 4.194 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1C ZINC000658168044 1043948539 /nfs/dbraw/zinc/94/85/39/1043948539.db2.gz RRSFPPIESVSVLD-IBGZPJMESA-N 2 0 337.511 4.261 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000443008867 1043962013 /nfs/dbraw/zinc/96/20/13/1043962013.db2.gz WBVPYZUVWWHXTF-OAHLLOKOSA-N 2 0 328.422 4.224 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2cnc(-c3ccco3)s2)C1 ZINC000193007334 1043991072 /nfs/dbraw/zinc/99/10/72/1043991072.db2.gz JQPAICRKGJTQBL-HOTGVXAUSA-N 2 0 347.528 4.251 20 0 EIADRP Cc1ccccc1C[NH+]1CCC(Nc2cc[nH+]c3ccccc23)CC1 ZINC000521953779 1044101662 /nfs/dbraw/zinc/10/16/62/1044101662.db2.gz UHQSPJDISMSSFI-UHFFFAOYSA-N 2 0 331.463 4.042 20 0 EIADRP COc1ccc(-c2csc(C[NH2+][C@H](C)C3CC[NH+](C)CC3)c2)cc1 ZINC000157669048 1044144435 /nfs/dbraw/zinc/14/44/35/1044144435.db2.gz ZUSQUXHDHSEJHO-OAHLLOKOSA-N 2 0 344.524 4.244 20 0 EIADRP CS[C@@H](C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)C(C)(C)C ZINC000542497586 1044145361 /nfs/dbraw/zinc/14/53/61/1044145361.db2.gz ABGZKNPAUDAPOY-YJBOKZPZSA-N 2 0 338.561 4.055 20 0 EIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1cccc(F)c1 ZINC000174452228 1044273914 /nfs/dbraw/zinc/27/39/14/1044273914.db2.gz YAOWRYHOSVTRGO-UHFFFAOYSA-N 2 0 338.426 4.341 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[NH+]1CCC([NH3+])(c2cccc(Cl)c2)CC1 ZINC001168470172 1044276271 /nfs/dbraw/zinc/27/62/71/1044276271.db2.gz XDEWLUUUICLHKU-OAHLLOKOSA-N 2 0 346.877 4.360 20 0 EIADRP CCC(C)(C)[NH2+][C@H](C)C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000542515436 1044395206 /nfs/dbraw/zinc/39/52/06/1044395206.db2.gz YGUPKMUGHAVJQG-IAGOWNOFSA-N 2 0 345.531 4.024 20 0 EIADRP CCC[NH+]1CCC(N[C@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000675733625 1044450949 /nfs/dbraw/zinc/45/09/49/1044450949.db2.gz HWGOLUNWCYZEGI-INIZCTEOSA-N 2 0 327.299 4.445 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(COc2ccccc2)c1)C1CC[NH+](C)CC1 ZINC000675763323 1044473152 /nfs/dbraw/zinc/47/31/52/1044473152.db2.gz KBIPEZBJLOQDEZ-SFHVURJKSA-N 2 0 338.495 4.086 20 0 EIADRP COc1ccc(C2(C[NH2+][C@@H](C)C3CC[NH+](C)CC3)CCCCC2)cc1 ZINC000675771193 1044485653 /nfs/dbraw/zinc/48/56/53/1044485653.db2.gz NYFUIOZOTSQERY-SFHVURJKSA-N 2 0 344.543 4.217 20 0 EIADRP C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000675801088 1044503823 /nfs/dbraw/zinc/50/38/23/1044503823.db2.gz UTSPSUZQINMYEE-CHWSQXEVSA-N 2 0 329.315 4.244 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H]2CCCC[C@H]2c2ccc(OC)c(F)c2)CC1 ZINC000675818721 1044516079 /nfs/dbraw/zinc/51/60/79/1044516079.db2.gz IPAUVTJYKUKGNT-ICSRJNTNSA-N 2 0 348.506 4.182 20 0 EIADRP CC(C)(C[NH2+][C@@H](C[C@H]1CCOC1)c1ccc(F)cc1)C[NH+]1CCCC1 ZINC000494937811 1044535036 /nfs/dbraw/zinc/53/50/36/1044535036.db2.gz GBNQSQVRKSUPFS-XLIONFOSSA-N 2 0 348.506 4.005 20 0 EIADRP c1ccc(C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C2CCCCC2)cc1 ZINC000480742559 1044580783 /nfs/dbraw/zinc/58/07/83/1044580783.db2.gz CKUDWWFRSXWQEU-FSSWDIPSSA-N 2 0 326.528 4.394 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2C)C[C@H]1C ZINC000443650242 1044621591 /nfs/dbraw/zinc/62/15/91/1044621591.db2.gz CNRDIWCSZUYYLO-RHSMWYFYSA-N 2 0 328.422 4.318 20 0 EIADRP C[C@@H]1C[C@@H](n2cc3ccc(C[NH3+])cc3n2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168025354 1044656626 /nfs/dbraw/zinc/65/66/26/1044656626.db2.gz JRGZGOTUOXNCJY-UPHUGPLXSA-N 2 0 348.494 4.109 20 0 EIADRP C[C@H]([NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1)c1cccc(N)c1 ZINC001168026956 1044721984 /nfs/dbraw/zinc/72/19/84/1044721984.db2.gz MPVSXSRFJAWQRC-BZSNNMDCSA-N 2 0 337.511 4.361 20 0 EIADRP CC1([NH+]2CCCC2)CCC([NH2+]Cc2cc3ccncc3s2)CC1 ZINC000922505494 1044789857 /nfs/dbraw/zinc/78/98/57/1044789857.db2.gz SRLZNUNILLUHLC-UHFFFAOYSA-N 2 0 329.513 4.183 20 0 EIADRP CC1([NH+]2CCCC2)CCC([NH2+]Cc2cc3cc(Cl)cnc3o2)CC1 ZINC000922505610 1044790133 /nfs/dbraw/zinc/79/01/33/1044790133.db2.gz UQVMSSVIERSVBL-UHFFFAOYSA-N 2 0 347.890 4.368 20 0 EIADRP Clc1cc(Cl)cc(C2=CC[N@H+](CC3CC[NH2+]CC3)CC2)c1 ZINC001205001373 1044804665 /nfs/dbraw/zinc/80/46/65/1044804665.db2.gz RAJSPXROMGBWMM-UHFFFAOYSA-N 2 0 325.283 4.082 20 0 EIADRP c1ccc([C@@H]([NH2+]Cc2ccccc2C[NH+]2CCCCC2)C2CC2)nc1 ZINC000922584788 1044829120 /nfs/dbraw/zinc/82/91/20/1044829120.db2.gz AFATYZJQXXLJSX-QFIPXVFZSA-N 2 0 335.495 4.308 20 0 EIADRP CC(C)[NH2+]C1CC[NH+](CCCCc2cccc(C(F)(F)F)c2)CC1 ZINC000474282895 1044833493 /nfs/dbraw/zinc/83/34/93/1044833493.db2.gz LDNZPLVFHFHESW-UHFFFAOYSA-N 2 0 342.449 4.491 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCCN(Cc2cccs2)C1)C(C)(C)C(F)F ZINC000657861473 1044833807 /nfs/dbraw/zinc/83/38/07/1044833807.db2.gz TVGCUDSIDLIMQX-KGLIPLIRSA-N 2 0 330.488 4.230 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3ccncc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168032457 1044839928 /nfs/dbraw/zinc/83/99/28/1044839928.db2.gz GIVAUBMIBKHGGC-OXHIVJRSSA-N 2 0 349.522 4.490 20 0 EIADRP Fc1ccccc1C[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccccc1 ZINC000191693369 1044915215 /nfs/dbraw/zinc/91/52/15/1044915215.db2.gz QZVQIMHCSYXDAF-HTAPYJJXSA-N 2 0 338.470 4.183 20 0 EIADRP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000302982104 1044931345 /nfs/dbraw/zinc/93/13/45/1044931345.db2.gz DHGAGTFZHOLJKR-GOSISDBHSA-N 2 0 344.543 4.089 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cscc1Br ZINC000512148701 1044968727 /nfs/dbraw/zinc/96/87/27/1044968727.db2.gz XVWISMMKMHIPOS-CYBMUJFWSA-N 2 0 345.350 4.255 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCN(Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000922836938 1044983283 /nfs/dbraw/zinc/98/32/83/1044983283.db2.gz FIBCOBMCMXYNCX-BHIYHBOVSA-N 2 0 330.541 4.057 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)CC1 ZINC000922844822 1044998340 /nfs/dbraw/zinc/99/83/40/1044998340.db2.gz HOOVMZDSJCTKMO-MAKTXDPSSA-N 2 0 327.516 4.104 20 0 EIADRP COC1(C[C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)CCC1 ZINC000429374655 1045038490 /nfs/dbraw/zinc/03/84/90/1045038490.db2.gz WJEMZVWXPGBKOO-GOSISDBHSA-N 2 0 330.516 4.110 20 0 EIADRP COC1(C[C@H](C)[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)CCC1 ZINC000429402543 1045085371 /nfs/dbraw/zinc/08/53/71/1045085371.db2.gz IZBZQAHCIDPFQL-YOUFYPILSA-N 2 0 344.543 4.080 20 0 EIADRP O[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2CCC3(CCCCC3)CC2)CC1 ZINC000466747149 1045179250 /nfs/dbraw/zinc/17/92/50/1045179250.db2.gz FDMUNLGCCXLHFB-SFTDATJTSA-N 2 0 348.575 4.237 20 0 EIADRP C[C@@H](NCc1scnc1C1CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000487567673 1045228230 /nfs/dbraw/zinc/22/82/30/1045228230.db2.gz YJPUMVZNOLODDQ-QAPCUYQASA-N 2 0 341.524 4.021 20 0 EIADRP Fc1cc2c(c(F)c1)CC[C@@H]2[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000154567464 1045350712 /nfs/dbraw/zinc/35/07/12/1045350712.db2.gz OGFYIZUJIRKYDW-NRFANRHFSA-N 2 0 342.433 4.338 20 0 EIADRP CC(C)[C@H](C[NH2+][C@H](CC(C)(C)C)c1ccccc1)N1CC[NH+](C)CC1 ZINC000326429352 1045808750 /nfs/dbraw/zinc/80/87/50/1045808750.db2.gz VTYJDEZPQXGTRD-RTWAWAEBSA-N 2 0 345.575 4.026 20 0 EIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC000247074155 1045839359 /nfs/dbraw/zinc/83/93/59/1045839359.db2.gz OLGXFWKXISFRPE-FGTMMUONSA-N 2 0 345.531 4.054 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1cc[n+](C[C@H]2CCC3(CCCCC3)O2)cc1 ZINC000249121900 1045893408 /nfs/dbraw/zinc/89/34/08/1045893408.db2.gz UEPZIYZFRQBTPZ-PZJWPPBQSA-N 2 0 343.535 4.230 20 0 EIADRP CC[C@H]1C[C@H]([N@H+]2C[C@H]3c4ccccc4[C@H]([NH+](C)C(C)C)[C@H]3C2)CCO1 ZINC001170222650 1045952407 /nfs/dbraw/zinc/95/24/07/1045952407.db2.gz OMOUBGBLPIMZCG-VDWMVFLBSA-N 2 0 342.527 4.055 20 0 EIADRP CC(C)O[C@@H]1C[C@H]([NH2+]Cc2cccc(C[NH+]3CCCCC3)c2)C1(C)C ZINC001170397920 1046030091 /nfs/dbraw/zinc/03/00/91/1046030091.db2.gz BEJGTFBTXAPIDW-LEWJYISDSA-N 2 0 344.543 4.354 20 0 EIADRP CCc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc(C[NH+](CC)CC)cc1 ZINC000769866500 1046083277 /nfs/dbraw/zinc/08/32/77/1046083277.db2.gz GFWQIUFGMRHKRO-OAHLLOKOSA-N 2 0 329.488 4.238 20 0 EIADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000261658760 1046131725 /nfs/dbraw/zinc/13/17/25/1046131725.db2.gz BLLDDEIDVFBFJL-MAUKXSAKSA-N 2 0 344.449 4.156 20 0 EIADRP C[NH2+]CCC1CC[NH+](Cc2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000261983149 1046171074 /nfs/dbraw/zinc/17/10/74/1046171074.db2.gz IUYQVBDEYJDFIV-UHFFFAOYSA-N 2 0 349.931 4.285 20 0 EIADRP [NH3+]C1CC[NH+](Cc2ccc(-c3ccccc3Br)cc2)CC1 ZINC000262044266 1046175502 /nfs/dbraw/zinc/17/55/02/1046175502.db2.gz YUDURQRBYPJXEV-UHFFFAOYSA-N 2 0 345.284 4.039 20 0 EIADRP COc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000123706284 1046194658 /nfs/dbraw/zinc/19/46/58/1046194658.db2.gz RJOHPIDEVPQDHN-AWEZNQCLSA-N 2 0 332.875 4.261 20 0 EIADRP CCC(C)(C)[NH2+][C@@H](C)C(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000476006312 1046196058 /nfs/dbraw/zinc/19/60/58/1046196058.db2.gz BCSIFLTXAXHIBN-SJORKVTESA-N 2 0 345.531 4.166 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(Cl)nc2)CC1)CC1CC1 ZINC000770598032 1046234282 /nfs/dbraw/zinc/23/42/82/1046234282.db2.gz VPAVEBZFWSJQGV-UHFFFAOYSA-N 2 0 335.923 4.069 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(SCC(F)F)cc1 ZINC000126178599 1046451071 /nfs/dbraw/zinc/45/10/71/1046451071.db2.gz WFIORBFRWOKFJM-CYBMUJFWSA-N 2 0 328.472 4.036 20 0 EIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C3CC3)C1)CCCO2 ZINC000126535510 1046494647 /nfs/dbraw/zinc/49/46/47/1046494647.db2.gz XDDJVTJLBSAVKD-JXFKEZNVSA-N 2 0 328.500 4.098 20 0 EIADRP Cc1[nH+]ccc(NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1Cl ZINC000497251758 1046517306 /nfs/dbraw/zinc/51/73/06/1046517306.db2.gz ZWHMYUZBWDUWEV-GUYCJALGSA-N 2 0 335.904 4.022 20 0 EIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000509699070 1046574504 /nfs/dbraw/zinc/57/45/04/1046574504.db2.gz PWIYSYBJDASZCS-GOSISDBHSA-N 2 0 338.495 4.099 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCCN(Cc3cccs3)C2)cc1 ZINC000126875517 1046578037 /nfs/dbraw/zinc/57/80/37/1046578037.db2.gz BGHQYWRUORUJCS-IRXDYDNUSA-N 2 0 344.524 4.320 20 0 EIADRP CCCCOc1ccc(C[N@H+](C)[C@H]2CC[NH+](CC)C[C@@H]2C)cc1OC ZINC000536662343 1046631820 /nfs/dbraw/zinc/63/18/20/1046631820.db2.gz YEVPUQCZOXRDQR-HKUYNNGSSA-N 2 0 348.531 4.036 20 0 EIADRP c1ccc(C[C@H]2CCC[C@@H]2[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459436205 1046647133 /nfs/dbraw/zinc/64/71/33/1046647133.db2.gz QESRFYDVWIHMEQ-KNQAVFIVSA-N 2 0 335.495 4.051 20 0 EIADRP c1ccc(CC2(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)CCC2)cc1 ZINC000459440233 1046670842 /nfs/dbraw/zinc/67/08/42/1046670842.db2.gz JTUFOBHYXPCMKG-UHFFFAOYSA-N 2 0 335.495 4.053 20 0 EIADRP COc1ccc(-c2ccccc2C)cc1C[NH2+]CC1=CC[N@H+](C)CC1 ZINC000459459451 1046697608 /nfs/dbraw/zinc/69/76/08/1046697608.db2.gz HQGLMZGFCPJDBB-UHFFFAOYSA-N 2 0 336.479 4.022 20 0 EIADRP C[C@H]1C[C@@H](NCc2ccc(F)cc2F)CC[N@@H+]1Cc1ccccc1 ZINC000379622202 1046716531 /nfs/dbraw/zinc/71/65/31/1046716531.db2.gz GEOHMLPKQHEPCZ-KXBFYZLASA-N 2 0 330.422 4.108 20 0 EIADRP C[N@@H+](C/C=C/c1ccccc1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000536729686 1046725575 /nfs/dbraw/zinc/72/55/75/1046725575.db2.gz MQOLZXHQMDDQOX-VMPITWQZSA-N 2 0 335.495 4.333 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1 ZINC000379641554 1046746750 /nfs/dbraw/zinc/74/67/50/1046746750.db2.gz YKEBXQKZHBLVLA-LQWHRVPQSA-N 2 0 338.495 4.399 20 0 EIADRP c1cc(-c2ccccc2)oc1C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000536754736 1046758893 /nfs/dbraw/zinc/75/88/93/1046758893.db2.gz CBQJYQYLGIPDOX-UHFFFAOYSA-N 2 0 347.462 4.348 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCc4c3cccc4F)CC2)CC1 ZINC000536826204 1046808703 /nfs/dbraw/zinc/80/87/03/1046808703.db2.gz JFZAYPMKHQKXRT-BPZDKFOGSA-N 2 0 330.491 4.446 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cc1 ZINC000536833503 1046809512 /nfs/dbraw/zinc/80/95/12/1046809512.db2.gz PTOCXSMJNMKQNP-GUDVDZBRSA-N 2 0 332.532 4.145 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+]CCCO[C@H]2CCCc3ccccc32)CC1 ZINC000536871351 1046835300 /nfs/dbraw/zinc/83/53/00/1046835300.db2.gz QYVPPLZUCULGGR-NRFANRHFSA-N 2 0 344.543 4.323 20 0 EIADRP C(CCC[NH2+][C@@H]1CCC[C@@H]([C@H]2CCOC2)C1)CCC[NH+]1CCCC1 ZINC000798493107 1046853201 /nfs/dbraw/zinc/85/32/01/1046853201.db2.gz LJZVURUWKCIFFJ-QHAWAJNXSA-N 2 0 336.564 4.218 20 0 EIADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000786834613 1046872078 /nfs/dbraw/zinc/87/20/78/1046872078.db2.gz GMYFXYMKGWSAFS-WYNBGMTASA-N 2 0 330.516 4.149 20 0 EIADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000786820031 1046875879 /nfs/dbraw/zinc/87/58/79/1046875879.db2.gz MEUHQANTAXXMCO-XMSQKQJNSA-N 2 0 344.543 4.397 20 0 EIADRP Fc1ccc(CC[NH2+]C2CC[NH+](CC3CCCCC3)CC2)cc1F ZINC000786940225 1046889216 /nfs/dbraw/zinc/88/92/16/1046889216.db2.gz RBQKPCUJTXLOIW-UHFFFAOYSA-N 2 0 336.470 4.142 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCc2nc(Cl)ccc21 ZINC000806131036 1047155344 /nfs/dbraw/zinc/15/53/44/1047155344.db2.gz FPYYJZKDYWFBBI-GOSISDBHSA-N 2 0 343.902 4.352 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@H]2COCc3cccc(Cl)c32)C1 ZINC000788525001 1047202831 /nfs/dbraw/zinc/20/28/31/1047202831.db2.gz ADTAJWLIMVPGOI-YJBOKZPZSA-N 2 0 336.907 4.013 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCc3ccc(Cl)nc32)cc1 ZINC000788504022 1047206964 /nfs/dbraw/zinc/20/69/64/1047206964.db2.gz FOSDJNZYWVHUBW-SFHVURJKSA-N 2 0 343.902 4.354 20 0 EIADRP COc1ccc(CCC[NH2+][C@@H]2CCN(C)[C@@H](c3ccccc3)C2)cc1 ZINC000556058597 1047421649 /nfs/dbraw/zinc/42/16/49/1047421649.db2.gz ABNDWSSEBUJJAJ-IFMALSPDSA-N 2 0 338.495 4.053 20 0 EIADRP C[C@H]1CC[C@@H]([NH+]2CCC([NH3+])(Cc3cccc(C(F)(F)F)c3)CC2)C1 ZINC001170121910 1047485567 /nfs/dbraw/zinc/48/55/67/1047485567.db2.gz ORXZUXAISJCOQH-WMLDXEAASA-N 2 0 340.433 4.230 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000129725485 1047495637 /nfs/dbraw/zinc/49/56/37/1047495637.db2.gz JZQMFMKZEQMDBW-DLBZAZTESA-N 2 0 328.422 4.349 20 0 EIADRP Cn1nccc1[C@H]1CCC[C@@H]([NH2+]CCCCCCC[NH+]2CCCC2)C1 ZINC000790486955 1047596632 /nfs/dbraw/zinc/59/66/32/1047596632.db2.gz RCVYVMVWZNNMAF-VQTJNVASSA-N 2 0 346.563 4.082 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@@H]2CCCc3c(O)cccc32)C1 ZINC000556236332 1047602693 /nfs/dbraw/zinc/60/26/93/1047602693.db2.gz QNECRCSOTKRISO-MBOZVWFJSA-N 2 0 330.516 4.117 20 0 EIADRP C[C@H]([NH2+][C@H](c1ccncc1)C1CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000898322422 1047615042 /nfs/dbraw/zinc/61/50/42/1047615042.db2.gz KZRGPLZIMLCPAU-HSQYWUDLSA-N 2 0 335.495 4.033 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](CCC(=O)c2ccccc2)CC1 ZINC000537517095 1047665881 /nfs/dbraw/zinc/66/58/81/1047665881.db2.gz YIEATYIHOJMBGC-IBGZPJMESA-N 2 0 342.527 4.236 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H]2CCc3c2cccc3OC(F)(F)F)CC1 ZINC001168298148 1047677307 /nfs/dbraw/zinc/67/73/07/1047677307.db2.gz AYNBPUVRJYDALV-SEEARECTSA-N 2 0 342.405 4.035 20 0 EIADRP C[NH+](C)C1CCC([NH2+]CCCc2cccc(C(F)(F)F)c2)CC1 ZINC001168298211 1047678884 /nfs/dbraw/zinc/67/88/84/1047678884.db2.gz FOOIYUCQCYMQRV-UHFFFAOYSA-N 2 0 328.422 4.100 20 0 EIADRP C[N@H+](CCCN[C@H]1CC[NH+](C)[C@H](c2ccccc2)C1)C1CCCCC1 ZINC000550608680 1047758428 /nfs/dbraw/zinc/75/84/28/1047758428.db2.gz LGJMVKAZCANWIW-UNMCSNQZSA-N 2 0 343.559 4.066 20 0 EIADRP COc1ncc([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1Cl ZINC000556591831 1047835730 /nfs/dbraw/zinc/83/57/30/1047835730.db2.gz NEAROMYZHHBQKU-HUUCEWRRSA-N 2 0 339.911 4.049 20 0 EIADRP C[NH+](C)CC1CCC([NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)CC1 ZINC000498782393 1047845692 /nfs/dbraw/zinc/84/56/92/1047845692.db2.gz DESCHULRJRHFLY-VYHPPPRESA-N 2 0 330.491 4.472 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000131271235 1047851705 /nfs/dbraw/zinc/85/17/05/1047851705.db2.gz ZGFFCWDEUZLLAV-HZPDHXFCSA-N 2 0 345.531 4.077 20 0 EIADRP CCCC[NH+]1CCC([N@H+](C)[C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171058836 1047882393 /nfs/dbraw/zinc/88/23/93/1047882393.db2.gz LVMLFHUDLQKYRA-SFHVURJKSA-N 2 0 334.935 4.394 20 0 EIADRP CC1(C)[C@@H]2C[C@@H]([NH+]3CCC4(CC[N@H+](Cc5cccs5)C4)CC3)C[C@@H]21 ZINC001170751433 1048058001 /nfs/dbraw/zinc/05/80/01/1048058001.db2.gz DMCRUDZQDWSGTP-LUPIEILUSA-N 2 0 344.568 4.471 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)C1 ZINC000556857533 1048074711 /nfs/dbraw/zinc/07/47/11/1048074711.db2.gz CKSDQMAWLNNSAC-GGPKGHCWSA-N 2 0 346.563 4.379 20 0 EIADRP CCC(CC)(CCO)C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000556869932 1048091035 /nfs/dbraw/zinc/09/10/35/1048091035.db2.gz CBIROHUABOAUJG-UHFFFAOYSA-N 2 0 346.559 4.208 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@H]2CCC[C@@H]21)c1ccc(C(F)(F)F)cc1 ZINC000556890740 1048132411 /nfs/dbraw/zinc/13/24/11/1048132411.db2.gz RQUCCLGEJLYEIC-PILAGYSTSA-N 2 0 340.433 4.271 20 0 EIADRP Clc1ccc2c(c1)CC[C@@H]([NH2+]C1CC[NH+](C3CCCC3)CC1)C2 ZINC001171105369 1048200581 /nfs/dbraw/zinc/20/05/81/1048200581.db2.gz SWFIDBONIJLUNA-LJQANCHMSA-N 2 0 332.919 4.194 20 0 EIADRP Clc1ccc2c(c1)CC[C@H]([NH+]1CCC([NH+]3CCCCC3)CC1)C2 ZINC001171117292 1048288136 /nfs/dbraw/zinc/28/81/36/1048288136.db2.gz WOUVGUPUJXWKPV-FQEVSTJZSA-N 2 0 332.919 4.148 20 0 EIADRP C(=C/c1ccccc1)\C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499136338 1048331988 /nfs/dbraw/zinc/33/19/88/1048331988.db2.gz QMSQLGKQPZZYMG-ZILBUFEYSA-N 2 0 332.491 4.485 20 0 EIADRP CCCCCC[C@@H](CC)[NH2+]C1(C(=O)OC(C)(C)C)CCC([NH3+])CC1 ZINC001170579349 1048362975 /nfs/dbraw/zinc/36/29/75/1048362975.db2.gz RTMQMSBAZRUTBS-OHTSDLOESA-N 2 0 340.552 4.307 20 0 EIADRP Cc1ccc(Oc2cccc(C[NH+]3CC4(C3)CC[NH+](C)CC4)c2)cc1 ZINC001144090495 1048408253 /nfs/dbraw/zinc/40/82/53/1048408253.db2.gz LABLYNSHIZVTSB-UHFFFAOYSA-N 2 0 336.479 4.315 20 0 EIADRP c1ccc(C[C@@H]2C[C@@H]2[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499215471 1048425150 /nfs/dbraw/zinc/42/51/50/1048425150.db2.gz QDIBNRAWADIYQP-VDLPQLTJSA-N 2 0 346.518 4.403 20 0 EIADRP [NH3+]CCCCCCC[NH2+][C@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171147743 1048483178 /nfs/dbraw/zinc/48/31/78/1048483178.db2.gz JWLZRQDHGOQAAS-HNNXBMFYSA-N 2 0 329.315 4.350 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)C/C=C\c2ccc(F)cc2F)cc1 ZINC000809738705 1048511106 /nfs/dbraw/zinc/51/11/06/1048511106.db2.gz GBFYCXWNTZAZAV-PLNGDYQASA-N 2 0 330.422 4.172 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccc(OCC(F)F)cc2)cc1 ZINC000809739152 1048511168 /nfs/dbraw/zinc/51/11/68/1048511168.db2.gz ZBPTWQYGXIRZAF-UHFFFAOYSA-N 2 0 348.437 4.024 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)CC1 ZINC000844924471 1048549523 /nfs/dbraw/zinc/54/95/23/1048549523.db2.gz XYKHQHGAXOUBPS-HNNXBMFYSA-N 2 0 326.456 4.097 20 0 EIADRP CCCCCC[C@@H](CC)[NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC001170589655 1048564467 /nfs/dbraw/zinc/56/44/67/1048564467.db2.gz YTABDTDUPNOGAX-OAQYLSRUSA-N 2 0 346.559 4.352 20 0 EIADRP Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3cc(N4CCCCC4)cc[nH+]3)c2c1 ZINC001171164796 1048606301 /nfs/dbraw/zinc/60/63/01/1048606301.db2.gz HDLLYRAUYKRJCD-QGZVFWFLSA-N 2 0 348.494 4.214 20 0 EIADRP Clc1ccc2c(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)c[nH]c2n1 ZINC001144414481 1048649063 /nfs/dbraw/zinc/64/90/63/1048649063.db2.gz ICWLVDXKTKDYAD-INIZCTEOSA-N 2 0 346.906 4.057 20 0 EIADRP ClC1(Cl)C[C@@H]1CCC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000846106060 1048823421 /nfs/dbraw/zinc/82/34/21/1048823421.db2.gz XEIHATLXEYNZOJ-AWEZNQCLSA-N 2 0 333.347 4.347 20 0 EIADRP CC[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc2c(c1)CCCO2 ZINC000772953072 1048897570 /nfs/dbraw/zinc/89/75/70/1048897570.db2.gz RFZNAAWOMFUCAJ-LJQANCHMSA-N 2 0 330.516 4.315 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccc(Br)cc1 ZINC000817946627 1049062544 /nfs/dbraw/zinc/06/25/44/1049062544.db2.gz BQKMSOHCZAEBCV-SFHVURJKSA-N 2 0 347.300 4.191 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccc(SC(F)F)cc1 ZINC000817950552 1049063463 /nfs/dbraw/zinc/06/34/63/1049063463.db2.gz ZRLVSWOVMBOLSL-ZDUSSCGKSA-N 2 0 336.451 4.353 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc(SC(F)F)cc1 ZINC000817985444 1049081212 /nfs/dbraw/zinc/08/12/12/1049081212.db2.gz KDIUJHJTAHNEJQ-PMOUVXMZSA-N 2 0 326.456 4.040 20 0 EIADRP Clc1cccc2c1C[C@@H]([NH2+]CC1CC[NH+](CC3CCC3)CC1)CC2 ZINC001170910378 1049177870 /nfs/dbraw/zinc/17/78/70/1049177870.db2.gz GYYGKPCAXJKGFH-IBGZPJMESA-N 2 0 346.946 4.299 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]C[C@H](O)c1cccc(Cl)c1 ZINC000818962347 1049215037 /nfs/dbraw/zinc/21/50/37/1049215037.db2.gz PENBANIVHAUBQA-FQEVSTJZSA-N 2 0 346.902 4.003 20 0 EIADRP Cc1cc(N([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)cc(C)[nH+]1 ZINC001170645188 1049269795 /nfs/dbraw/zinc/26/97/95/1049269795.db2.gz AUMGLFVIOBREGD-IJZHQTRZSA-N 2 0 335.495 4.331 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@H]2CCc3c(F)cc(F)cc3C2)CC1(C)C ZINC001171349276 1049501083 /nfs/dbraw/zinc/50/10/83/1049501083.db2.gz HNXQYSDOQXXJRK-HNNXBMFYSA-N 2 0 336.470 4.063 20 0 EIADRP CCCCC[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)c1ccccc1 ZINC000773069311 1049564703 /nfs/dbraw/zinc/56/47/03/1049564703.db2.gz NXNBSPAQALVQKW-FDFHNCONSA-N 2 0 344.543 4.275 20 0 EIADRP Fc1cccc2c1CC[C@@H]([NH2+]CC1CC[NH+](CC3CCCC3)CC1)C2 ZINC001171411629 1049644366 /nfs/dbraw/zinc/64/43/66/1049644366.db2.gz KSZBYDDPVNGYGS-HXUWFJFHSA-N 2 0 344.518 4.175 20 0 EIADRP Fc1cccc2c1CC[C@H]([NH2+]C1CC[NH+](C[C@H]3CC=CCC3)CC1)C2 ZINC001171419776 1049656265 /nfs/dbraw/zinc/65/62/65/1049656265.db2.gz UWLNMZPOMAETSC-PXNSSMCTSA-N 2 0 342.502 4.093 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@H]2CCc3cccc(F)c3C2)CC1 ZINC001170970685 1049684229 /nfs/dbraw/zinc/68/42/29/1049684229.db2.gz MGNUUCDWRBRMRU-WDSOQIARSA-N 2 0 330.491 4.198 20 0 EIADRP Fc1cccc2c1C[C@@H]([NH2+]CC1CC[NH+](CC3CCCC3)CC1)CC2 ZINC001170971175 1049688781 /nfs/dbraw/zinc/68/87/81/1049688781.db2.gz OGEISNCBQJCGOT-FQEVSTJZSA-N 2 0 344.518 4.175 20 0 EIADRP C[C@@H](C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)CC(F)(F)F ZINC000716680027 1049701693 /nfs/dbraw/zinc/70/16/93/1049701693.db2.gz PKASZECXGJWRAE-UBDQQSCGSA-N 2 0 340.433 4.218 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CCc2cc(F)c(F)c(F)c2C1 ZINC001171505599 1049739740 /nfs/dbraw/zinc/73/97/40/1049739740.db2.gz KHDFLCBSIDPHLF-ZFWWWQNUSA-N 2 0 342.449 4.061 20 0 EIADRP Cc1cccc2c1CC[C@@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)C2 ZINC001171559564 1049755338 /nfs/dbraw/zinc/75/53/38/1049755338.db2.gz IKUHLHKDQPUXOV-HXUWFJFHSA-N 2 0 326.528 4.239 20 0 EIADRP COc1cccc([C@H]([NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)C2CC2)c1 ZINC001171630485 1049761887 /nfs/dbraw/zinc/76/18/87/1049761887.db2.gz OYAFFYYEHKEFOY-LJQANCHMSA-N 2 0 330.516 4.387 20 0 EIADRP C[NH+]1C(C)(C)CC(NC2CC[NH+](C[C@H]3CC=CCC3)CC2)CC1(C)C ZINC001171629924 1049762003 /nfs/dbraw/zinc/76/20/03/1049762003.db2.gz ZTTBSGQMDKEKMW-SFHVURJKSA-N 2 0 347.591 4.048 20 0 EIADRP C[C@@H]([NH3+])Cc1cn(C2CC(C)(C)[NH+](C)C(C)(C)C2)c2ccccc12 ZINC001171624840 1049768667 /nfs/dbraw/zinc/76/86/67/1049768667.db2.gz ZKYBRFJLRISEOJ-OAHLLOKOSA-N 2 0 327.516 4.355 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CC2(Cc3ccc(F)cc3)CC2)CC1(C)C ZINC001171626822 1049769352 /nfs/dbraw/zinc/76/93/52/1049769352.db2.gz CIPYSNBPORCRCH-UHFFFAOYSA-N 2 0 332.507 4.389 20 0 EIADRP C[C@H](C[NH3+])C[N@H+](C)C1CCC(c2ccc(Br)cc2)CC1 ZINC001171648206 1049769407 /nfs/dbraw/zinc/76/94/07/1049769407.db2.gz QNVULFCTQMFYHT-BZOOQXSSSA-N 2 0 339.321 4.002 20 0 EIADRP C[NH+]1C(C)(C)CC([N@@H+]2CCSC[C@H]2c2ccccc2)CC1(C)C ZINC001171640036 1049779316 /nfs/dbraw/zinc/77/93/16/1049779316.db2.gz ZXYCUUNCSIXLQH-SFHVURJKSA-N 2 0 332.557 4.428 20 0 EIADRP Cc1cccnc1C[NH+]1CCC2(CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001171642701 1049781454 /nfs/dbraw/zinc/78/14/54/1049781454.db2.gz ZWSGEKVEBDIDDY-UHFFFAOYSA-N 2 0 349.522 4.268 20 0 EIADRP C[C@@H]1C[C@H](n2cc(CCC[NH3+])c3ccccc32)C[N@@H+]1Cc1ccccc1 ZINC001171724898 1049785740 /nfs/dbraw/zinc/78/57/40/1049785740.db2.gz DWJZEQKCPYGLPQ-NQIIRXRSSA-N 2 0 347.506 4.368 20 0 EIADRP Fc1cccc2c1C[C@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)CC2 ZINC001170997067 1049807509 /nfs/dbraw/zinc/80/75/09/1049807509.db2.gz QMHYUUJDASMPIQ-RBUKOAKNSA-N 2 0 330.491 4.023 20 0 EIADRP Fc1cccc2c1C[C@@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)CC2 ZINC001170997062 1049808110 /nfs/dbraw/zinc/80/81/10/1049808110.db2.gz QMHYUUJDASMPIQ-MOPGFXCFSA-N 2 0 330.491 4.023 20 0 EIADRP CC1(C)C[C@H]([NH2+]CCCc2ccncc2)CC[N@@H+]1Cc1ccccc1 ZINC001171965608 1049826448 /nfs/dbraw/zinc/82/64/48/1049826448.db2.gz IJYUGEAMADSSQJ-OAQYLSRUSA-N 2 0 337.511 4.047 20 0 EIADRP CC(C)(C)OCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171974809 1049836056 /nfs/dbraw/zinc/83/60/56/1049836056.db2.gz AMPDCYBKZQYDQB-LJQANCHMSA-N 2 0 332.532 4.224 20 0 EIADRP CC1(C)C[C@@H]([NH2+][C@@H]2CCCc3ccncc32)CC[N@@H+]1Cc1ccccc1 ZINC001171978818 1049838371 /nfs/dbraw/zinc/83/83/71/1049838371.db2.gz LXYKHVYJZMYIQL-RBBKRZOGSA-N 2 0 349.522 4.492 20 0 EIADRP CC1(C)C[C@H]([NH+]2C[C@H]3[C@H](CCC3(F)F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171983628 1049839018 /nfs/dbraw/zinc/83/90/18/1049839018.db2.gz ZFXWOYZGPWQWFI-QRVBRYPASA-N 2 0 348.481 4.407 20 0 EIADRP CC1(C)C[C@@H](n2ncc3c2cccc3C[NH3+])CC[N@@H+]1Cc1ccccc1 ZINC001171981986 1049839206 /nfs/dbraw/zinc/83/92/06/1049839206.db2.gz FSZWIBFUCBRRQG-IBGZPJMESA-N 2 0 348.494 4.111 20 0 EIADRP CC1(C)C[C@@H](N2CC[C@@H]([NH3+])c3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC001171984475 1049840593 /nfs/dbraw/zinc/84/05/93/1049840593.db2.gz WBDLPIVSTRLZID-PZJWPPBQSA-N 2 0 349.522 4.340 20 0 EIADRP CC1(C)C[C@H](n2cnc3ccc(C[NH3+])cc32)CC[N@@H+]1Cc1ccccc1 ZINC001171984370 1049840882 /nfs/dbraw/zinc/84/08/82/1049840882.db2.gz VDWURTKYANVWHT-LJQANCHMSA-N 2 0 348.494 4.111 20 0 EIADRP CCSCC[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245737343 1049842639 /nfs/dbraw/zinc/84/26/39/1049842639.db2.gz QZQGFFKAEDZWGR-FFGOWVMKSA-N 2 0 332.557 4.303 20 0 EIADRP CCOC1CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172073847 1049843773 /nfs/dbraw/zinc/84/37/73/1049843773.db2.gz DACGTFIMTHEKFR-WKCHPHFGSA-N 2 0 342.527 4.073 20 0 EIADRP CCO[C@@H]1CCC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172075208 1049844520 /nfs/dbraw/zinc/84/45/20/1049844520.db2.gz OROAGRMQZDFVLN-CLAROIROSA-N 2 0 342.527 4.073 20 0 EIADRP FC1(F)C[C@]12CC[N@@H+]([C@H]1C[C@H]3CCC[C@@H](C1)[NH+]3Cc1ccccc1)C2 ZINC001172074409 1049844860 /nfs/dbraw/zinc/84/48/60/1049844860.db2.gz IRDZIINYEOOPCE-NMLBUPMWSA-N 2 0 346.465 4.303 20 0 EIADRP c1cc(CC[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)cs1 ZINC001172064680 1049850927 /nfs/dbraw/zinc/85/09/27/1049850927.db2.gz IVKCNOYSJKXWHP-MZADTFQBSA-N 2 0 340.536 4.466 20 0 EIADRP F[C@@H]1CC[C@@H](C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172067399 1049851996 /nfs/dbraw/zinc/85/19/96/1049851996.db2.gz NKDYNZFSJXWLSB-ONUIULTDSA-N 2 0 330.491 4.300 20 0 EIADRP FC1CCC([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172069820 1049853912 /nfs/dbraw/zinc/85/39/12/1049853912.db2.gz XVPIOUWFWIHORO-SMCZBRLRSA-N 2 0 330.491 4.442 20 0 EIADRP COc1ccc(CC2(C[NH2+][C@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4C)CCC2)cc1 ZINC001172110954 1049858149 /nfs/dbraw/zinc/85/81/49/1049858149.db2.gz MOZYXYLHYPPARU-ACDBMABISA-N 2 0 342.527 4.013 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC1(Cc3ccc(F)cc3)CCC1)C2 ZINC001172111982 1049858240 /nfs/dbraw/zinc/85/82/40/1049858240.db2.gz YMQFVLLVWLSGFJ-OWZKRDHZSA-N 2 0 330.491 4.143 20 0 EIADRP c1ccc2c(c1)C[C@H]([NH2+]C1CC[NH+](C[C@H]3CC=CCC3)CC1)CS2 ZINC001172194595 1049868529 /nfs/dbraw/zinc/86/85/29/1049868529.db2.gz VMPIFZKLXLKWKE-PXNSSMCTSA-N 2 0 342.552 4.114 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H](CC(C)C)c2cccc(F)c2)CC1 ZINC001172246847 1049872253 /nfs/dbraw/zinc/87/22/53/1049872253.db2.gz XBESEDUEWBCENS-FQEVSTJZSA-N 2 0 336.495 4.003 20 0 EIADRP [NH3+]C1(CC2CCC2)CC[NH+]([C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171030017 1049875140 /nfs/dbraw/zinc/87/51/40/1049875140.db2.gz KMHGZAPERWIIHY-QGZVFWFLSA-N 2 0 332.919 4.181 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172315734 1049876558 /nfs/dbraw/zinc/87/65/58/1049876558.db2.gz DCVBEVZVAASJQQ-OALUTQOASA-N 2 0 332.532 4.082 20 0 EIADRP Fc1c(C[NH2+]CCCCCCC[NH+]2CCCC2)ccnc1Cl ZINC000823813095 1049876933 /nfs/dbraw/zinc/87/69/33/1049876933.db2.gz VQRJUXLSRRIADS-UHFFFAOYSA-N 2 0 327.875 4.010 20 0 EIADRP C[C@@H]1CC[C@@H]([NH+]2CCC3(CC[N@H+](Cc4cccnc4)C3)CC2)C[C@H]1C ZINC001172381013 1049885626 /nfs/dbraw/zinc/88/56/26/1049885626.db2.gz ZSPZFTBVVNIWFL-SFHLNBCPSA-N 2 0 341.543 4.194 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC001172344327 1049889859 /nfs/dbraw/zinc/88/98/59/1049889859.db2.gz AOXQDIUGAREQQK-SEIRJHJZSA-N 2 0 344.543 4.034 20 0 EIADRP Cc1ccc(C[N@@H+]([C@@H](C)CCOC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001172445536 1049914124 /nfs/dbraw/zinc/91/41/24/1049914124.db2.gz RINDMENROHRHFC-JBACZVJFSA-N 2 0 332.532 4.271 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H](C)CCc2c(F)cc(Cl)cc2F)CC1 ZINC001172566996 1049936325 /nfs/dbraw/zinc/93/63/25/1049936325.db2.gz BHLQBLGZEMZYFS-CYBMUJFWSA-N 2 0 344.877 4.403 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]C(C)(C)CC[NH+](C)C ZINC001172567259 1049936492 /nfs/dbraw/zinc/93/64/92/1049936492.db2.gz BGDZDOFQNKPSIT-LBPRGKRZSA-N 2 0 332.866 4.259 20 0 EIADRP CC(C)([NH3+])CCNCCC(C)(C)[NH2+][C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172535810 1049942788 /nfs/dbraw/zinc/94/27/88/1049942788.db2.gz JKIORAYWSZSHDZ-WOJBJXKFSA-N 2 0 345.575 4.188 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]Cc1ccccc1C[NH3+] ZINC001172579502 1049951594 /nfs/dbraw/zinc/95/15/94/1049951594.db2.gz WYNXTPWXGXOBOF-LBPRGKRZSA-N 2 0 338.829 4.188 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)[C@H](C)c1nc2ccccc2s1)C[NH+]1CCCC1 ZINC000247046273 1050011389 /nfs/dbraw/zinc/01/13/89/1050011389.db2.gz NABFLIATXLWRBM-PMPSAXMXSA-N 2 0 331.529 4.110 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(CN2CCO[C@@H](C)C2)c1)c1cccs1 ZINC000247196606 1050016698 /nfs/dbraw/zinc/01/66/98/1050016698.db2.gz WCXUCJDFWSVSNH-LPHOPBHVSA-N 2 0 344.524 4.210 20 0 EIADRP CCc1nc(C)c([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)s1 ZINC000248404244 1050053478 /nfs/dbraw/zinc/05/34/78/1050053478.db2.gz PUNVBVCRHVONDB-DZKIICNBSA-N 2 0 335.561 4.318 20 0 EIADRP c1ccc(CC2CCC([NH+]3CCC([NH+]4CCCC4)CC3)CC2)cc1 ZINC001172823550 1050163546 /nfs/dbraw/zinc/16/35/46/1050163546.db2.gz VOLAHZRCNMXTEW-UHFFFAOYSA-N 2 0 326.528 4.348 20 0 EIADRP COC(=O)[C@@H]1CCC[C@@H]([NH2+]CCCCCCCCCCC[NH3+])CC1 ZINC001172801088 1050173228 /nfs/dbraw/zinc/17/32/28/1050173228.db2.gz UATAXXRWKDLPSM-RTBURBONSA-N 2 0 340.552 4.168 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1c(F)ccc(F)c1Cl ZINC001177299341 1050180889 /nfs/dbraw/zinc/18/08/89/1050180889.db2.gz OWVYYCLFNDFUKD-ZDUSSCGKSA-N 2 0 330.850 4.362 20 0 EIADRP CC(C)[N@H+]([C@@H](C)Cc1c(F)cccc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172847546 1050186802 /nfs/dbraw/zinc/18/68/02/1050186802.db2.gz KMFGNHOLLXTQPW-KKUMJFAQSA-N 2 0 326.887 4.390 20 0 EIADRP C[C@H](C[NH2+]Cc1ccc(-c2cccc(F)c2)s1)C[NH+]1CCCC1 ZINC001177328104 1050192181 /nfs/dbraw/zinc/19/21/81/1050192181.db2.gz HNJRYTCAJGFLME-OAHLLOKOSA-N 2 0 332.488 4.376 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH2+]CCCC[NH+]1CCCC1 ZINC001172875401 1050214136 /nfs/dbraw/zinc/21/41/36/1050214136.db2.gz ONDNWTKZVXCJQA-OAHLLOKOSA-N 2 0 326.937 4.286 20 0 EIADRP COc1cc(C)ccc1C[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC001177562155 1050252516 /nfs/dbraw/zinc/25/25/16/1050252516.db2.gz JGAIYJKMEKYHAS-UHFFFAOYSA-N 2 0 344.524 4.067 20 0 EIADRP COc1ccc([C@H]([NH2+]CCCCNc2ccccn2)C2CC2)cc1 ZINC000091318758 1050253141 /nfs/dbraw/zinc/25/31/41/1050253141.db2.gz LOERWOIRHXPONI-HXUWFJFHSA-N 2 0 325.456 4.023 20 0 EIADRP [NH3+][C@H]1CC[N@H+](Cc2ccc(Oc3ccc(Cl)cc3)cc2)CC[C@@H]1F ZINC001206187038 1050266444 /nfs/dbraw/zinc/26/64/44/1050266444.db2.gz SPPOBVFIHDKCNA-OALUTQOASA-N 2 0 348.849 4.394 20 0 EIADRP C[N@H+](C1CC[NH+](C2CCCCC2)CC1)C1CCC2(CCOCC2)CC1 ZINC001173049516 1050273548 /nfs/dbraw/zinc/27/35/48/1050273548.db2.gz UUJSFUCRFNEIOR-UHFFFAOYSA-N 2 0 348.575 4.455 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC001173102804 1050304968 /nfs/dbraw/zinc/30/49/68/1050304968.db2.gz BYTHIHXQPVJYEG-UHFFFAOYSA-N 2 0 344.421 4.328 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](c2cncc(Cl)c2)C2CC2)CC1 ZINC001173105696 1050305049 /nfs/dbraw/zinc/30/50/49/1050305049.db2.gz BDALSWKJYMXEAS-ACBHZAAOSA-N 2 0 335.923 4.429 20 0 EIADRP c1nn2ccccc2c1C[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC001177803823 1050305046 /nfs/dbraw/zinc/30/50/46/1050305046.db2.gz IDXXTTXWGDCDJJ-UHFFFAOYSA-N 2 0 348.494 4.000 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](c2ccc(OC)cc2)C2CC2)CC1 ZINC001173104806 1050306316 /nfs/dbraw/zinc/30/63/16/1050306316.db2.gz WGKIPEMJFNMIEU-GZNCHQMQSA-N 2 0 330.516 4.389 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2c(F)ccc(Cl)c2F)CC1 ZINC001173105853 1050308138 /nfs/dbraw/zinc/30/81/38/1050308138.db2.gz WZLHQZPWNNSCND-UHFFFAOYSA-N 2 0 330.850 4.361 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CC2(Cc3ccccc3OC)CC2)CC1 ZINC001173106318 1050308182 /nfs/dbraw/zinc/30/81/82/1050308182.db2.gz LWESQNNLHVBGEW-UHFFFAOYSA-N 2 0 344.543 4.261 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@@H](Oc3ccccc3)C2)CC1 ZINC001173112378 1050310103 /nfs/dbraw/zinc/31/01/03/1050310103.db2.gz WTITZIIEUCBGQW-GZNCHQMQSA-N 2 0 330.516 4.183 20 0 EIADRP [NH3+]C1(CC2CCC2)CC[NH+](C2CCC(Oc3ccccc3)CC2)CC1 ZINC001173197741 1050342087 /nfs/dbraw/zinc/34/20/87/1050342087.db2.gz LIZASHMOUVBYTG-UHFFFAOYSA-N 2 0 342.527 4.360 20 0 EIADRP CC[N@H+](CCC1CC[NH+](C[C@@H]2CC2(Cl)Cl)CC1)CC(C)C ZINC000773730254 1050415053 /nfs/dbraw/zinc/41/50/53/1050415053.db2.gz HGGIWIURGJIUHP-INIZCTEOSA-N 2 0 335.363 4.260 20 0 EIADRP C[C@H]([NH2+]Cc1cccc2ccoc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001178330263 1050436453 /nfs/dbraw/zinc/43/64/53/1050436453.db2.gz ALMSVPXXIXCOGO-LAUBAEHRSA-N 2 0 334.463 4.433 20 0 EIADRP CCSC[C@H](C)[N@@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001173316896 1050438518 /nfs/dbraw/zinc/43/85/18/1050438518.db2.gz ZXJXFAKGJBTVDR-AZUAARDMSA-N 2 0 332.557 4.116 20 0 EIADRP Cc1csc([C@H](C)C[NH2+]CC(C)(C)C[N@H+](C)Cc2ccccc2)n1 ZINC001178445370 1050459791 /nfs/dbraw/zinc/45/97/91/1050459791.db2.gz VXHRNEOBIDIIFC-MRXNPFEDSA-N 2 0 345.556 4.303 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)C2Cc3cc(F)c(F)cc3C2)CC1 ZINC001173477527 1050461018 /nfs/dbraw/zinc/46/10/18/1050461018.db2.gz QKAHFVHUXWLJCO-IYARVYRRSA-N 2 0 348.481 4.194 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]CC1CC[NH+](C)CC1 ZINC001173543519 1050476665 /nfs/dbraw/zinc/47/66/65/1050476665.db2.gz LYCIAGAEURBWMH-CYBMUJFWSA-N 2 0 329.315 4.246 20 0 EIADRP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]CC1CC[NH+](C)CC1 ZINC001173543520 1050477689 /nfs/dbraw/zinc/47/76/89/1050477689.db2.gz LYCIAGAEURBWMH-ZDUSSCGKSA-N 2 0 329.315 4.246 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCCOC(C)C)cc1C[NH+]1CCCCC1 ZINC000182212413 1050543898 /nfs/dbraw/zinc/54/38/98/1050543898.db2.gz CMYQPMGHEHYNMZ-GOSISDBHSA-N 2 0 348.531 4.147 20 0 EIADRP CC(C)[C@@H](C[NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1ccccc1 ZINC001179015938 1050612335 /nfs/dbraw/zinc/61/23/35/1050612335.db2.gz RKSWAKXMCWGYHH-ZLNRFVROSA-N 2 0 336.523 4.361 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+]Cc2cccc(OC(C)(C)C)c2)CC1 ZINC001179277423 1050669342 /nfs/dbraw/zinc/66/93/42/1050669342.db2.gz FUSGAFZUHXDVST-UHFFFAOYSA-N 2 0 332.532 4.464 20 0 EIADRP Cc1cccc([C@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)C(C)C)c1 ZINC001179325359 1050674768 /nfs/dbraw/zinc/67/47/68/1050674768.db2.gz VTMLIPAVFRJYLT-JOCHJYFZSA-N 2 0 340.511 4.422 20 0 EIADRP CN(C)Cc1csc(C[NH2+][C@H]2CCCC[C@@H](c3ccccc3)C2)n1 ZINC001179607785 1050731074 /nfs/dbraw/zinc/73/10/74/1050731074.db2.gz JXZVVJYMOHPRSB-MSOLQXFVSA-N 2 0 343.540 4.411 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2cccc(-c3ccccn3)c2)CC1 ZINC001179717726 1050763274 /nfs/dbraw/zinc/76/32/74/1050763274.db2.gz YVKQEAJKEQSGJU-UHFFFAOYSA-N 2 0 335.495 4.245 20 0 EIADRP Cc1nc(C)c(C[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)s1 ZINC000076868892 1051010702 /nfs/dbraw/zinc/01/07/02/1051010702.db2.gz ZDZQVPNBZPYBAZ-UHFFFAOYSA-N 2 0 343.540 4.282 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000775378988 1051169822 /nfs/dbraw/zinc/16/98/22/1051169822.db2.gz OTMRNVPXJFQJPN-SUMWQHHRSA-N 2 0 340.483 4.310 20 0 EIADRP Clc1ccc([C@H]2CC[C@H]([NH2+]CC3CC[NH+](C4CC4)CC3)C2)cc1 ZINC001181234158 1051191582 /nfs/dbraw/zinc/19/15/82/1051191582.db2.gz HWJPFHFCKJAPLH-HKUYNNGSSA-N 2 0 332.919 4.440 20 0 EIADRP CC[C@H](C)[C@H](C[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)OC ZINC001181458728 1051231398 /nfs/dbraw/zinc/23/13/98/1051231398.db2.gz ZEBCWCWZTVDILK-RXVVDRJESA-N 2 0 332.532 4.069 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cnn(C3CCC3)c2)CC1)CC(C)C ZINC001181514231 1051243673 /nfs/dbraw/zinc/24/36/73/1051243673.db2.gz BQIHNLHFNJCVPQ-UHFFFAOYSA-N 2 0 346.563 4.188 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[N@H+]1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC001181514339 1051243987 /nfs/dbraw/zinc/24/39/87/1051243987.db2.gz GCADNEFXOKPYPC-QGZVFWFLSA-N 2 0 340.433 4.178 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(SCC(F)F)cc2)C1 ZINC000163221303 1051251862 /nfs/dbraw/zinc/25/18/62/1051251862.db2.gz AXVUSPKFOGBSMF-UONOGXRCSA-N 2 0 328.472 4.036 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)c1cncs1 ZINC000268780973 1051390655 /nfs/dbraw/zinc/39/06/55/1051390655.db2.gz PSIDJEGWTZRNMK-BRWVUGGUSA-N 2 0 343.540 4.472 20 0 EIADRP Cc1c(C)c(C)c(C[NH+]2CC[C@H](C[N@H+](C)CC3CC3)C2)c(C)c1C ZINC001191444109 1051460499 /nfs/dbraw/zinc/46/04/99/1051460499.db2.gz IEJFIRAZNXXCQP-OAQYLSRUSA-N 2 0 328.544 4.392 20 0 EIADRP C[C@H](CC[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000155862743 1051469680 /nfs/dbraw/zinc/46/96/80/1051469680.db2.gz NEGOSMYXOVFGLO-CKEIUWERSA-N 2 0 328.422 4.271 20 0 EIADRP CCc1ccc(C[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)s1 ZINC000156285507 1051517677 /nfs/dbraw/zinc/51/76/77/1051517677.db2.gz XIVDFLQBRZNTQW-OAHLLOKOSA-N 2 0 332.513 4.102 20 0 EIADRP c1ccc(C[N@H+]2CC=C(Nc3cccc(C[NH+]4CCCC4)c3)CC2)cc1 ZINC001175506361 1051640664 /nfs/dbraw/zinc/64/06/64/1051640664.db2.gz WFLMYABRCFHLPI-UHFFFAOYSA-N 2 0 347.506 4.484 20 0 EIADRP C1CCC([NH+]2CCC(NC3CC[NH+](C4CCCCC4)CC3)CC2)CC1 ZINC000157511664 1051645809 /nfs/dbraw/zinc/64/58/09/1051645809.db2.gz JDUQHBNZMQCBCU-UHFFFAOYSA-N 3 0 347.591 4.170 20 0 EIADRP COc1ccc(-c2csc(C[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@H]3C)c2)cc1 ZINC000157653768 1051661487 /nfs/dbraw/zinc/66/14/87/1051661487.db2.gz NYURUBODSGXAKA-STXHMFSFSA-N 2 0 344.524 4.242 20 0 EIADRP CCCC[C@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC001182783854 1051710594 /nfs/dbraw/zinc/71/05/94/1051710594.db2.gz YNGAHHOHLUMWKK-SFTDATJTSA-N 2 0 329.532 4.242 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1cnc2ccsc2c1 ZINC000158195538 1051725002 /nfs/dbraw/zinc/72/50/02/1051725002.db2.gz XQWFVUQCIQQDJO-MRXNPFEDSA-N 2 0 331.529 4.459 20 0 EIADRP CCc1ccc(C)[nH+]c1NC1CC[NH+](CCc2ccc(F)cc2)CC1 ZINC001182873455 1051728048 /nfs/dbraw/zinc/72/80/48/1051728048.db2.gz LBWGZGKXUWOLJI-UHFFFAOYSA-N 2 0 341.474 4.211 20 0 EIADRP C[C@@H]1CC[N@H+](Cc2cccc(C(F)(F)F)c2Cl)CC[C@H]1C[NH3+] ZINC001205602228 1051756018 /nfs/dbraw/zinc/75/60/18/1051756018.db2.gz HUAYSQCOFGMPIQ-NEPJUHHUSA-N 2 0 334.813 4.166 20 0 EIADRP Fc1ccc(C2=CC[C@H]([NH2+]CC3CC[NH+](CC4CC4)CC3)CC2)cc1 ZINC001183074708 1051773433 /nfs/dbraw/zinc/77/34/33/1051773433.db2.gz JWPZVJLUEISGAY-QFIPXVFZSA-N 2 0 342.502 4.473 20 0 EIADRP CC[NH+]1CCN(c2ccc(Nc3cc[nH+]c(C4CCC4)c3)cc2)CC1 ZINC001175782683 1051783181 /nfs/dbraw/zinc/78/31/81/1051783181.db2.gz USSUCMCKWUIVIF-UHFFFAOYSA-N 2 0 336.483 4.235 20 0 EIADRP C[C@H]1CC[N@H+](CCCc2ccc(Cl)c(Cl)c2)CC[C@@H]1C[NH3+] ZINC001205604866 1051792622 /nfs/dbraw/zinc/79/26/22/1051792622.db2.gz YIORDIYVIJNARP-DZGCQCFKSA-N 2 0 329.315 4.233 20 0 EIADRP C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]CC1(c2ccccc2)CC[NH+](C)CC1 ZINC001183354475 1051826151 /nfs/dbraw/zinc/82/61/51/1051826151.db2.gz CQZLDHRJJWBQRZ-UYAOXDASSA-N 2 0 328.544 4.454 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H]2CCC[C@@H](C3CC3)C2)(c2ccccc2)CC1 ZINC001183355477 1051826818 /nfs/dbraw/zinc/82/68/18/1051826818.db2.gz QQMYHONBMKCULH-TZIWHRDSSA-N 2 0 326.528 4.208 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC001183408593 1051836572 /nfs/dbraw/zinc/83/65/72/1051836572.db2.gz JRNYDADQPIPYTK-BELGNNRLSA-N 2 0 326.887 4.263 20 0 EIADRP CCCOc1cccc(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC001193251615 1051892154 /nfs/dbraw/zinc/89/21/54/1051892154.db2.gz VFFRQDNUKCHGGU-HKUYNNGSSA-N 2 0 330.516 4.218 20 0 EIADRP c1cc(C[NH+]2CCCC2)cc(Nc2c[nH+]ccc2N2CCCCC2)c1 ZINC001176196345 1051939058 /nfs/dbraw/zinc/93/90/58/1051939058.db2.gz VRHOHCAXQODQTI-UHFFFAOYSA-N 2 0 336.483 4.411 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2)CC1 ZINC001184135354 1051952902 /nfs/dbraw/zinc/95/29/02/1051952902.db2.gz OYSOAFKRABOLOK-AEAFLJPSSA-N 2 0 326.528 4.394 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C/C=C/c2ccc(OCc3ccccc3)cc2)C1 ZINC000414913735 1051982845 /nfs/dbraw/zinc/98/28/45/1051982845.db2.gz JPUQDRZYYVKOQO-HEPPIXLFSA-N 2 0 336.479 4.138 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccccc2OC)c1 ZINC000163550502 1051996250 /nfs/dbraw/zinc/99/62/50/1051996250.db2.gz USURAOFUIKBIMP-KRWDZBQOSA-N 2 0 326.484 4.388 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)cc1OC ZINC000163595872 1051997124 /nfs/dbraw/zinc/99/71/24/1051997124.db2.gz MDLMDQSZGHAIIM-QGZVFWFLSA-N 2 0 348.531 4.113 20 0 EIADRP Cc1cccc2c(CC[NH2+]C3CC[NH+](C4CCCCC4)CC3)c[nH]c21 ZINC000164400873 1052028804 /nfs/dbraw/zinc/02/88/04/1052028804.db2.gz SNZJFMWNOYTKGT-UHFFFAOYSA-N 2 0 339.527 4.406 20 0 EIADRP Cc1nc(-c2ccc(CC[NH2+][C@@H]3C[C@@H](C)[N@@H+](C)C[C@@H]3C)s2)cs1 ZINC000164469862 1052031207 /nfs/dbraw/zinc/03/12/07/1052031207.db2.gz WFPMFNCRTBEFOW-WOSRLPQWSA-N 2 0 349.569 4.041 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cc(Cl)sc1Cl ZINC000165983669 1052081608 /nfs/dbraw/zinc/08/16/08/1052081608.db2.gz LIEQRJFOGNGPEY-QWRGUYRKSA-N 2 0 339.332 4.062 20 0 EIADRP Cc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)CC34CCC(CC3)C4)C2)s1 ZINC001194152444 1052089215 /nfs/dbraw/zinc/08/92/15/1052089215.db2.gz BCRJKCUBJZEZDN-QPIRBTGLSA-N 2 0 332.557 4.391 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H](c2ccccc2)c2ccc(OC)cc2)CC1 ZINC000326824532 1052102146 /nfs/dbraw/zinc/10/21/46/1052102146.db2.gz YYTKCCUASFJRCD-JOCHJYFZSA-N 2 0 338.495 4.106 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cccc(OC(F)F)c1 ZINC000658356885 1052152649 /nfs/dbraw/zinc/15/26/49/1052152649.db2.gz PZYVJOHKVQREPD-CQSZACIVSA-N 2 0 338.442 4.061 20 0 EIADRP C[N@@H+]1CC[C@@]2(C1)CCC[NH+](CCCc1ccc(C(F)(F)F)cc1)C2 ZINC001194505162 1052161858 /nfs/dbraw/zinc/16/18/58/1052161858.db2.gz LPCUOZOSZNNFBC-GOSISDBHSA-N 2 0 340.433 4.056 20 0 EIADRP C[N@@H+]1CCC[C@]2(CC[NH+](CCCOc3cccc(C(C)(C)C)c3)C2)C1 ZINC001194641023 1052183130 /nfs/dbraw/zinc/18/31/30/1052183130.db2.gz LEEWUXXFUFXLRO-QFIPXVFZSA-N 2 0 344.543 4.171 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000339068804 1052551659 /nfs/dbraw/zinc/55/16/59/1052551659.db2.gz QJXPYHUQLBFOPO-SBHAEUEKSA-N 2 0 330.516 4.008 20 0 EIADRP C[N@@H+]1CC[C@@H]([NH2+]CC2(c3cccc(C(F)(F)F)c3)CC2)CC1(C)C ZINC000623398803 1052646912 /nfs/dbraw/zinc/64/69/12/1052646912.db2.gz PDMKDUOIPRTQNN-MRXNPFEDSA-N 2 0 340.433 4.199 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@@H](C)[C@@H](C)c2nc3ccccc3s2)CC1 ZINC000177836368 1052691862 /nfs/dbraw/zinc/69/18/62/1052691862.db2.gz MDUOHUVGOKYRQE-CVEARBPZSA-N 2 0 345.556 4.498 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(Cl)s1)c1ccc(OCC[NH+](C)C)cc1 ZINC000177860653 1052692893 /nfs/dbraw/zinc/69/28/93/1052692893.db2.gz XCIOSVLSBNLMNX-ZDUSSCGKSA-N 2 0 338.904 4.193 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ncc(Br)s1 ZINC000179188281 1052725680 /nfs/dbraw/zinc/72/56/80/1052725680.db2.gz ZFPKRJWWROMTIG-VXGBXAGGSA-N 2 0 348.354 4.067 20 0 EIADRP Clc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000623755266 1052779818 /nfs/dbraw/zinc/77/98/18/1052779818.db2.gz ABWLZIDAEWAULR-KHYOSLBOSA-N 2 0 343.902 4.415 20 0 EIADRP Cc1csc([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)n1 ZINC000623880876 1052830156 /nfs/dbraw/zinc/83/01/56/1052830156.db2.gz WWOOBUNKQQCVMJ-AWEZNQCLSA-N 2 0 335.542 4.076 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1cc(-c2ccccc2)n(C)n1 ZINC000623989946 1052851427 /nfs/dbraw/zinc/85/14/27/1052851427.db2.gz NGUQOCCOLRWRJV-GOSISDBHSA-N 2 0 340.515 4.004 20 0 EIADRP Cc1cccc([C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C(C)C)c1 ZINC000624010496 1052852107 /nfs/dbraw/zinc/85/21/07/1052852107.db2.gz QPJLFLNLHSNDHS-JOCHJYFZSA-N 2 0 344.543 4.173 20 0 EIADRP CC[C@H](C)Oc1cc(C[NH2+]C[C@H](C)C[NH+]2CCCCC2)ccc1OC ZINC000624019774 1052853425 /nfs/dbraw/zinc/85/34/25/1052853425.db2.gz ZAKIFPTXTZLEKB-ROUUACIJSA-N 2 0 348.531 4.084 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCCC[C@@H]2Sc2ccc(F)cc2)C1 ZINC000624008964 1052855371 /nfs/dbraw/zinc/85/53/71/1052855371.db2.gz LWIFCDRUTWPOJY-HYEGPXJVSA-N 2 0 336.520 4.159 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)[C@H](C)c1nc2ccccc2s1 ZINC000624121277 1052867513 /nfs/dbraw/zinc/86/75/13/1052867513.db2.gz SCYUWCGFGVJXEN-HRCADAONSA-N 2 0 331.529 4.110 20 0 EIADRP CCC(F)(F)C(C)(C)C[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000624155001 1052869962 /nfs/dbraw/zinc/86/99/62/1052869962.db2.gz CFMKVZITYHUVSW-OAHLLOKOSA-N 2 0 342.474 4.349 20 0 EIADRP Cc1cc(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c2ccccc2n1 ZINC000185694756 1053020580 /nfs/dbraw/zinc/02/05/80/1053020580.db2.gz MEMZAHOUNBGOPK-MSOLQXFVSA-N 2 0 337.511 4.286 20 0 EIADRP C[C@@H]([NH2+]CCSc1ccccc1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185706672 1053021070 /nfs/dbraw/zinc/02/10/70/1053021070.db2.gz JJEFSPWWSXWCRU-HZPDHXFCSA-N 2 0 336.520 4.160 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000381210925 1053058298 /nfs/dbraw/zinc/05/82/98/1053058298.db2.gz UMPYGVHSJCBSQG-KGVIQGDOSA-N 2 0 338.495 4.084 20 0 EIADRP CCOc1ccccc1C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381307073 1053065310 /nfs/dbraw/zinc/06/53/10/1053065310.db2.gz BYIFGXXADYLXQX-NQIIRXRSSA-N 2 0 338.495 4.086 20 0 EIADRP CCOc1ccccc1C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381307077 1053065643 /nfs/dbraw/zinc/06/56/43/1053065643.db2.gz BYIFGXXADYLXQX-WIYYLYMNSA-N 2 0 338.495 4.086 20 0 EIADRP Cc1cc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(C)s1 ZINC000381862483 1053106686 /nfs/dbraw/zinc/10/66/86/1053106686.db2.gz JAUMRKJKSPTQCJ-QFBILLFUSA-N 2 0 328.525 4.365 20 0 EIADRP FC1(F)CCCC[C@@H]1C[N@@H+]1C[C@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC000381874515 1053111689 /nfs/dbraw/zinc/11/16/89/1053111689.db2.gz JUQCFDHXBDZFCH-VAMGGRTRSA-N 2 0 348.481 4.266 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cc2ccccc2[nH]1 ZINC000775628273 1053222451 /nfs/dbraw/zinc/22/24/51/1053222451.db2.gz QSTOMFVCZAVHFI-ICSRJNTNSA-N 2 0 347.506 4.383 20 0 EIADRP Cc1c([C@@H](C)NCCC[N@@H+]2CCCC[C@H]2C)cnn1-c1ccccc1 ZINC000764627579 1053238761 /nfs/dbraw/zinc/23/87/61/1053238761.db2.gz JKQFUUUMTAZEOM-QZTJIDSGSA-N 2 0 340.515 4.096 20 0 EIADRP CCCCC[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)C(C)(C)C ZINC000850482777 1053253899 /nfs/dbraw/zinc/25/38/99/1053253899.db2.gz LPWJQRLAFGQAIR-HXUWFJFHSA-N 2 0 338.580 4.462 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000383360166 1053329924 /nfs/dbraw/zinc/32/99/24/1053329924.db2.gz SHQAORAQKSFPSW-NVXWUHKLSA-N 2 0 330.422 4.138 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc2c(c1)CCO2 ZINC000764973530 1053394704 /nfs/dbraw/zinc/39/47/04/1053394704.db2.gz QSHIXLAIBUKJAC-KURKYZTESA-N 2 0 330.516 4.030 20 0 EIADRP COc1ccc(CC[C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000764963362 1053399181 /nfs/dbraw/zinc/39/91/81/1053399181.db2.gz NRHJYGAQVXGWIT-RTBURBONSA-N 2 0 332.532 4.261 20 0 EIADRP c1ccc(CC2CC[NH+](CCC[N@@H+]3CCC34CCCC4)CC2)cc1 ZINC001195843944 1053503704 /nfs/dbraw/zinc/50/37/04/1053503704.db2.gz WOVDNVLCJJNLMF-UHFFFAOYSA-N 2 0 326.528 4.350 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3cnc(Cl)c(F)c3)CC2)CC1 ZINC000865507656 1053530081 /nfs/dbraw/zinc/53/00/81/1053530081.db2.gz DMMASWLLMIVSFK-UHFFFAOYSA-N 2 0 339.886 4.007 20 0 EIADRP C[C@H](Cc1ccc(F)cc1)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000385671901 1053541227 /nfs/dbraw/zinc/54/12/27/1053541227.db2.gz DXSHQXWENFQPIQ-DBXWQHBBSA-N 2 0 340.486 4.257 20 0 EIADRP c1cc2ccc(C[NH2+]C[C@@H]3CCC[N@H+](Cc4ccccc4)C3)cc2[nH]1 ZINC000386050268 1053574727 /nfs/dbraw/zinc/57/47/27/1053574727.db2.gz BUGQAOJMHWNZCK-FQEVSTJZSA-N 2 0 333.479 4.170 20 0 EIADRP c1ccc(CN2CC[C@@H]([NH2+]CC[C@@H]3CCCS3)CC23CC3)cc1 ZINC000865725613 1053578914 /nfs/dbraw/zinc/57/89/14/1053578914.db2.gz NCPJRROVXDZHGU-MOPGFXCFSA-N 2 0 330.541 4.059 20 0 EIADRP Clc1nc2ccccc2cc1C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000852754085 1053611052 /nfs/dbraw/zinc/61/10/52/1053611052.db2.gz ONSJDEYCIBUDEF-KRWDZBQOSA-N 2 0 343.902 4.100 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc2c(ccnc2Cl)o1 ZINC000866222674 1053656099 /nfs/dbraw/zinc/65/60/99/1053656099.db2.gz PKJYYMVFFTVYHX-CYBMUJFWSA-N 2 0 343.858 4.394 20 0 EIADRP Cc1c([C@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)cnn1-c1ccccc1 ZINC000866516367 1053763870 /nfs/dbraw/zinc/76/38/70/1053763870.db2.gz QBHAQDPMDIDCEQ-AFJQURTJSA-N 2 0 340.515 4.094 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@@H](Cc2ccncc2)c2cccs2)CC1 ZINC000866517649 1053764011 /nfs/dbraw/zinc/76/40/11/1053764011.db2.gz MBQWBNWSGYJDAK-FDYSRKEFSA-N 2 0 343.540 4.279 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@H]2CCOC(C)(C)C2)ccc1OC ZINC000121110005 1053766725 /nfs/dbraw/zinc/76/67/25/1053766725.db2.gz HHLRBCFUCMNSMK-LPHOPBHVSA-N 2 0 348.531 4.145 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H]2CCOC(C)(C)C2)ccc1OC ZINC000121109671 1053767472 /nfs/dbraw/zinc/76/74/72/1053767472.db2.gz HHLRBCFUCMNSMK-QFBILLFUSA-N 2 0 348.531 4.145 20 0 EIADRP C[N@@H+]1CC[C@H]2CN(CCCCc3ccc(Cl)c(Cl)c3)CC[C@@H]21 ZINC001197031949 1053828418 /nfs/dbraw/zinc/82/84/18/1053828418.db2.gz NFLNZDJNOSRVLI-YJBOKZPZSA-N 2 0 341.326 4.342 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](Cc2ccccc2F)c2ccccc2)C1 ZINC000429515146 1053853795 /nfs/dbraw/zinc/85/37/95/1053853795.db2.gz AYHXBRLUSRFHAI-LAUBAEHRSA-N 2 0 326.459 4.041 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H](Cc2ccccc2F)c2ccccc2)CC1 ZINC000429518446 1053886052 /nfs/dbraw/zinc/88/60/52/1053886052.db2.gz UKHOKALITNIDAN-NRFANRHFSA-N 2 0 326.459 4.041 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CC[C@H]2CC2(Cl)Cl)CC1 ZINC000857064916 1054170236 /nfs/dbraw/zinc/17/02/36/1054170236.db2.gz GEJNDEKAJRIHOY-YCPHGPKFSA-N 2 0 333.347 4.203 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H]3CCOC4(CCCC4)C3)CC2)c1 ZINC000872029800 1054346952 /nfs/dbraw/zinc/34/69/52/1054346952.db2.gz SUAMGRJZQWEFQK-GOSISDBHSA-N 2 0 348.556 4.042 20 0 EIADRP CC[C@@H](CCC(F)(F)F)[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000872032510 1054351095 /nfs/dbraw/zinc/35/10/95/1054351095.db2.gz VICIDGYXKIORFS-ROUUACIJSA-N 2 0 342.449 4.262 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)CCO1 ZINC001199275046 1054372344 /nfs/dbraw/zinc/37/23/44/1054372344.db2.gz CGUXRPGAJZDKRD-BWAGFHJFSA-N 2 0 344.543 4.354 20 0 EIADRP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)CC1 ZINC001199265543 1054375620 /nfs/dbraw/zinc/37/56/20/1054375620.db2.gz BJYQTINGSNXSEQ-YUXAGFNASA-N 2 0 344.543 4.356 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cccc3ncccc23)c1 ZINC000873025930 1054480091 /nfs/dbraw/zinc/48/00/91/1054480091.db2.gz DZIJQUHMQLYINA-UHFFFAOYSA-N 2 0 333.479 4.365 20 0 EIADRP Cc1cccc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c1F ZINC001199896477 1054484569 /nfs/dbraw/zinc/48/45/69/1054484569.db2.gz LZZPJGWGJWPIMV-UHFFFAOYSA-N 2 0 332.488 4.197 20 0 EIADRP COc1ccc(-c2ccccc2C)cc1CN[C@H](C)CC[NH+](C)C ZINC001199907472 1054487714 /nfs/dbraw/zinc/48/77/14/1054487714.db2.gz XAYBTGNAWZFHPQ-QGZVFWFLSA-N 2 0 326.484 4.100 20 0 EIADRP C[C@H]1CCCC[C@@H]1C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC001199926914 1054497597 /nfs/dbraw/zinc/49/75/97/1054497597.db2.gz ZOVYVFJPLNGBSK-RBUKOAKNSA-N 2 0 343.559 4.133 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccc(SC(F)F)cc1 ZINC000858490898 1054498436 /nfs/dbraw/zinc/49/84/36/1054498436.db2.gz RUNKDZPYWUVZSI-ZIAGYGMSSA-N 2 0 328.472 4.384 20 0 EIADRP CCC[C@H]([NH2+]Cc1cc2c(s1)CC[NH2+]C2)c1ccc(F)cc1F ZINC000873212951 1054510167 /nfs/dbraw/zinc/51/01/67/1054510167.db2.gz SEIYWBJRAJSGOQ-KRWDZBQOSA-N 2 0 336.451 4.303 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000873254605 1054514171 /nfs/dbraw/zinc/51/41/71/1054514171.db2.gz YECMPUKVKKLMOO-KKFJDGPESA-N 2 0 340.311 4.112 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(SCC(F)F)cc1 ZINC000873262643 1054516622 /nfs/dbraw/zinc/51/66/22/1054516622.db2.gz AVPLNHNMLVYFQC-UGQVUOCMSA-N 2 0 340.483 4.225 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1csc(-c2ccccc2F)n1 ZINC000873260462 1054517386 /nfs/dbraw/zinc/51/73/86/1054517386.db2.gz ARLNWNHJQLBHJE-XQLPTFJDSA-N 2 0 345.487 4.130 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCCc2nc(-c3ccccc3)sc21)C1CC[NH2+]CC1 ZINC000873271764 1054518896 /nfs/dbraw/zinc/51/88/96/1054518896.db2.gz KTQZHOXQHWLSEO-WMLDXEAASA-N 2 0 341.524 4.165 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2c(Cl)cncc2Cl)CC1 ZINC001200871931 1054562850 /nfs/dbraw/zinc/56/28/50/1054562850.db2.gz GXFADHLVAVANKD-UHFFFAOYSA-N 2 0 344.330 4.236 20 0 EIADRP CSc1ccc(CN[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)o1 ZINC001200880370 1054564862 /nfs/dbraw/zinc/56/48/62/1054564862.db2.gz SIMJNHSDFTZRMG-RDJZCZTQSA-N 2 0 330.497 4.144 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccccc2CC(F)(F)F)C1 ZINC001201566938 1054852117 /nfs/dbraw/zinc/85/21/17/1054852117.db2.gz QJBLCRULSRMEAL-MRXNPFEDSA-N 2 0 342.449 4.249 20 0 EIADRP COc1cccc(C[NH+]2CCC3(CC[NH+](CCC(C)C)CC3)CC2)c1 ZINC001201616591 1054865061 /nfs/dbraw/zinc/86/50/61/1054865061.db2.gz APNHLOSMYCREFH-UHFFFAOYSA-N 2 0 344.543 4.419 20 0 EIADRP COc1cccc(C[N@@H+]2CCC3(C2)CC[NH+](CCC(C)C)CC3)c1 ZINC001201620541 1054866779 /nfs/dbraw/zinc/86/67/79/1054866779.db2.gz PWTTZAWVBPNJID-UHFFFAOYSA-N 2 0 330.516 4.029 20 0 EIADRP CSCCC[NH+]1CCC2(CCC[N@H+](Cc3ccc(C)cc3)C2)CC1 ZINC001201689065 1054888889 /nfs/dbraw/zinc/88/88/89/1054888889.db2.gz SZKHCEUHIVEKBQ-UHFFFAOYSA-N 2 0 346.584 4.426 20 0 EIADRP C[C@H](CC[NH2+]Cc1cc2nc(Cl)ccc2s1)[NH+]1CCCCC1 ZINC001201962953 1054968062 /nfs/dbraw/zinc/96/80/62/1054968062.db2.gz KHDJKCPFZKYODU-CYBMUJFWSA-N 2 0 337.920 4.304 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2cc3c(ccnc3Cl)o2)C1 ZINC000876933410 1054985966 /nfs/dbraw/zinc/98/59/66/1054985966.db2.gz OKPYOSUFNPDUIJ-CQSZACIVSA-N 2 0 335.879 4.083 20 0 EIADRP c1ccc([C@H]([NH2+]CCCCC[NH+]2CCCCC2)c2ccccn2)cc1 ZINC000109826137 1055024762 /nfs/dbraw/zinc/02/47/62/1055024762.db2.gz DUEVLJWUXFJFJC-QFIPXVFZSA-N 2 0 337.511 4.417 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@@H]2CCC(F)(F)C2)ccc1OC ZINC000777242763 1055041877 /nfs/dbraw/zinc/04/18/77/1055041877.db2.gz PUKMSKRYMGGYAY-RHSMWYFYSA-N 2 0 340.458 4.375 20 0 EIADRP C[NH+]1CCC2(CCC[N@H+](Cc3ccsc3C(F)(F)F)C2)CC1 ZINC000862352288 1055051377 /nfs/dbraw/zinc/05/13/77/1055051377.db2.gz CKJDUPCZTZLRQY-UHFFFAOYSA-N 2 0 332.435 4.075 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]C2CCC(c3ccc(O)cc3)CC2)CC1 ZINC000877711493 1055108427 /nfs/dbraw/zinc/10/84/27/1055108427.db2.gz LPBGQJCQDTVVPJ-UHFFFAOYSA-N 2 0 330.516 4.271 20 0 EIADRP C[C@H](CCCC(F)(F)F)[NH2+]CC1(c2ccccc2)CC[NH+](C)CC1 ZINC000877718934 1055111191 /nfs/dbraw/zinc/11/11/91/1055111191.db2.gz YXFSHTGNQIAAAZ-MRXNPFEDSA-N 2 0 342.449 4.361 20 0 EIADRP FC(F)(F)CC[NH+]1CCC2(CC1)CC[NH+](Cc1ccccc1)CC2 ZINC001202352253 1055147560 /nfs/dbraw/zinc/14/75/60/1055147560.db2.gz FVELHHBXVJZEJX-UHFFFAOYSA-N 2 0 340.433 4.317 20 0 EIADRP FC(F)(F)CC[N@@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001202356351 1055148462 /nfs/dbraw/zinc/14/84/62/1055148462.db2.gz VZXRABCOVUWNMB-UHFFFAOYSA-N 2 0 340.433 4.317 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)C1CCC(C(F)(F)F)CC1 ZINC000475220694 1056296439 /nfs/dbraw/zinc/29/64/39/1056296439.db2.gz QJDCZERQKXQGRN-QQFBHYJXSA-N 2 0 334.470 4.455 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2nc3ccccc3o2)CC1 ZINC000057843877 1056379455 /nfs/dbraw/zinc/37/94/55/1056379455.db2.gz FDPWHKSKVFIXRI-UHFFFAOYSA-N 2 0 349.478 4.172 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCc3ccccc3OC2)CC1 ZINC000511007816 1056390256 /nfs/dbraw/zinc/39/02/56/1056390256.db2.gz CMXYHWUMGOULEM-DUXKGJEZSA-N 2 0 342.527 4.013 20 0 EIADRP Cc1n[nH]cc1[C@H](C)[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000180072791 1058344350 /nfs/dbraw/zinc/34/43/50/1058344350.db2.gz KWEMRMGXQSVATM-INIZCTEOSA-N 2 0 348.494 4.298 20 0 EIADRP Cc1n[nH]cc1[C@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000180137941 1058372061 /nfs/dbraw/zinc/37/20/61/1058372061.db2.gz LZOGSTFYARKRAZ-BBWFWOEESA-N 2 0 340.515 4.047 20 0 EIADRP CC[NH+]1CCC(CC[NH2+]Cc2cc(C)c(OC(F)F)c(C)c2)CC1 ZINC000742377242 1058602464 /nfs/dbraw/zinc/60/24/64/1058602464.db2.gz JJUZHQIOYPWPKO-UHFFFAOYSA-N 2 0 340.458 4.116 20 0 EIADRP CC[NH+]1CCC(CC[NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)CC1 ZINC000742377643 1058602971 /nfs/dbraw/zinc/60/29/71/1058602971.db2.gz PCRNBVVUOIZLHS-UHFFFAOYSA-N 2 0 330.516 4.002 20 0 EIADRP FC(F)(F)c1cccc(C2([NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)CCC2)c1 ZINC000182331422 1059811811 /nfs/dbraw/zinc/81/18/11/1059811811.db2.gz SCHWLBLEPDEOJM-DLBZAZTESA-N 2 0 338.417 4.301 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cccc3cnccc32)C1 ZINC000183201063 1059950041 /nfs/dbraw/zinc/95/00/41/1059950041.db2.gz TWOMJUITTMQFJZ-RBUKOAKNSA-N 2 0 337.511 4.321 20 0 EIADRP c1ccc(C[N@H+]2CCC[C@H](C[NH2+]Cc3ccc4cnccc4c3)C2)cc1 ZINC000388244821 1060277712 /nfs/dbraw/zinc/27/77/12/1060277712.db2.gz FRQWUVJKBABADU-OAQYLSRUSA-N 2 0 345.490 4.237 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2cnccc2c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000388982827 1060283181 /nfs/dbraw/zinc/28/31/81/1060283181.db2.gz RCJPPVGROIXVEJ-JPYJTQIMSA-N 2 0 345.490 4.235 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(SC(F)F)cc2)[C@H](C)C1 ZINC000746469511 1060373552 /nfs/dbraw/zinc/37/35/52/1060373552.db2.gz COFBAFZSOXPIOW-CJNGLKHVSA-N 2 0 328.472 4.163 20 0 EIADRP CO[C@@H](C[N@H+](C)Cc1ccc(C[NH+](C)C)cc1)c1ccc(Cl)cc1 ZINC001168836793 1060444318 /nfs/dbraw/zinc/44/43/18/1060444318.db2.gz FMIDTWOLVVQWHF-FQEVSTJZSA-N 2 0 346.902 4.221 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1ccc2c(c1)CCO2 ZINC000766512489 1060454416 /nfs/dbraw/zinc/45/44/16/1060454416.db2.gz LJRFWNGZLJLLFQ-DZIBYMRMSA-N 2 0 328.500 4.069 20 0 EIADRP CCc1nc2c(s1)[C@@H]([NH2+]C1CCC([NH+]3CCCCC3)CC1)CCC2 ZINC000766513417 1060461980 /nfs/dbraw/zinc/46/19/80/1060461980.db2.gz RFYARSGNBRMNKD-JCYILVPMSA-N 2 0 347.572 4.470 20 0 EIADRP Fc1ccc2c(c1)[C@@H]([NH2+]C1CCC([NH+]3CCCCC3)CC1)CCCO2 ZINC000766514479 1060472362 /nfs/dbraw/zinc/47/23/62/1060472362.db2.gz XJBQBWMJRMJIPT-QLOJAFMTSA-N 2 0 346.490 4.426 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CCC(c1ccccc1)c1ccccc1)C2 ZINC001169098612 1060637483 /nfs/dbraw/zinc/63/74/83/1060637483.db2.gz JSFIIWLFRAGESC-KOUNCHBCSA-N 2 0 334.507 4.423 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1(c3ccccc3C(F)(F)F)CCC1)C2 ZINC001169109311 1060658318 /nfs/dbraw/zinc/65/83/18/1060658318.db2.gz AMUNRFDXAIFHRZ-QDMKHBRRSA-N 2 0 338.417 4.299 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1ccc([C@@H]2CC[N@@H+](C)C2)cc1 ZINC001169690531 1060902144 /nfs/dbraw/zinc/90/21/44/1060902144.db2.gz WSWYFEDAXUMUDI-NQIIRXRSSA-N 2 0 335.495 4.346 20 0 EIADRP C[N@H+](CCC[NH2+]Cc1ccc(Br)cc1)Cc1ccccc1 ZINC000019913201 212083283 /nfs/dbraw/zinc/08/32/83/212083283.db2.gz UMRXAJCCJDQSEQ-UHFFFAOYSA-N 2 0 347.300 4.061 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)C1CCOCC1 ZINC000532192758 1032081472 /nfs/dbraw/zinc/08/14/72/1032081472.db2.gz KTJZSDOJBXNXNT-GCJKJVERSA-N 2 0 344.543 4.356 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000532218063 1032097691 /nfs/dbraw/zinc/09/76/91/1032097691.db2.gz VDJSGOYOTZDSFG-KRWDZBQOSA-N 2 0 344.474 4.397 20 0 EIADRP CC[C@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)c1ccccc1OC(F)F ZINC000151935493 1032136278 /nfs/dbraw/zinc/13/62/78/1032136278.db2.gz LJDYYPQBPBGPPQ-CJNGLKHVSA-N 2 0 326.431 4.059 20 0 EIADRP CC(C)[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1 ZINC000392157081 1032418929 /nfs/dbraw/zinc/41/89/29/1032418929.db2.gz PANDHVLGWWCETH-HXUWFJFHSA-N 2 0 327.447 4.176 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)C1CC(F)(F)C1 ZINC000529575082 1032456126 /nfs/dbraw/zinc/45/61/26/1032456126.db2.gz PTTVBMCICXBFGK-AEFFLSMTSA-N 2 0 336.470 4.312 20 0 EIADRP C[N@H+](C[C@@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1 ZINC000450569483 1032561710 /nfs/dbraw/zinc/56/17/10/1032561710.db2.gz WUQOOUBBXLQHOJ-SFHVURJKSA-N 2 0 336.470 4.408 20 0 EIADRP CCOc1ccc([C@@H](CC)[NH2+]C2CC[NH+](C(C)C)CC2)cc1OCC ZINC000180405669 1032588623 /nfs/dbraw/zinc/58/86/23/1032588623.db2.gz HMSIDXAFZIOOOL-LJQANCHMSA-N 2 0 348.531 4.398 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](CC)c2ccc(F)cc2)[C@@H](C)C1 ZINC000121298637 1032625118 /nfs/dbraw/zinc/62/51/18/1032625118.db2.gz ADSMFFUVCAJAEV-DBVUQKKJSA-N 2 0 336.495 4.003 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000512416742 1032722651 /nfs/dbraw/zinc/72/26/51/1032722651.db2.gz VGIFYLFUVQALJD-DGDHUYAWSA-N 2 0 330.516 4.090 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000512416744 1032723842 /nfs/dbraw/zinc/72/38/42/1032723842.db2.gz VGIFYLFUVQALJD-NZCCEVMUSA-N 2 0 330.516 4.090 20 0 EIADRP CCC[N@@H+]1CC[C@@H](CNCc2ccc(-c3ccccc3)cc2OC)C1 ZINC000512421914 1032729600 /nfs/dbraw/zinc/72/96/00/1032729600.db2.gz NDYXPASSZAGEPV-SFHVURJKSA-N 2 0 338.495 4.184 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1F ZINC000643546707 1018896850 /nfs/dbraw/zinc/89/68/50/1018896850.db2.gz TUEZKMLWPLHCBB-LNLFQRSKSA-N 2 0 346.490 4.125 20 0 EIADRP Brc1ccc([C@@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)C2CC2)cc1 ZINC000643547527 1018927933 /nfs/dbraw/zinc/92/79/33/1018927933.db2.gz GOJWEXIGJMPDEH-SJORKVTESA-N 2 0 349.316 4.165 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643548979 1018933162 /nfs/dbraw/zinc/93/31/62/1018933162.db2.gz YMLFKCHVMASXPX-PBHICJAKSA-N 2 0 340.433 4.291 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cn2)cc1 ZINC000274904656 1019850039 /nfs/dbraw/zinc/85/00/39/1019850039.db2.gz LXBUWPIWSXXDSR-OAHLLOKOSA-N 2 0 331.891 4.428 20 0 EIADRP CC(C)(C)C[C@H]([NH2+]C1CCN([C@@H]2CCOC2)CC1)c1ccc(F)cc1 ZINC000655693912 1020901056 /nfs/dbraw/zinc/90/10/56/1020901056.db2.gz ARCIPTCGQCHSPN-UXHICEINSA-N 2 0 348.506 4.146 20 0 EIADRP CCC[C@H]([NH2+]C1CCN([C@@H]2CCOC2)CC1)c1ccc(Cl)cc1 ZINC000655733389 1020924988 /nfs/dbraw/zinc/92/49/88/1020924988.db2.gz MUAOALSDJVDJFW-MOPGFXCFSA-N 2 0 336.907 4.024 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000655804786 1020972407 /nfs/dbraw/zinc/97/24/07/1020972407.db2.gz BLJNHRGXQSCYHH-TYCQWZJGSA-N 2 0 344.449 4.178 20 0 EIADRP c1cc2ccc(C[N@H+]3CCC[C@@H](C[NH+]4CCCCCC4)C3)cc2[nH]1 ZINC001167326856 1021130058 /nfs/dbraw/zinc/13/00/58/1021130058.db2.gz UWVMUIZNRBZRSR-IBGZPJMESA-N 2 0 325.500 4.256 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(Cn3ccnc3)cc2)c(C)c1 ZINC000414061126 1021761004 /nfs/dbraw/zinc/76/10/04/1021761004.db2.gz KCUCCBBRRJHNQO-QGZVFWFLSA-N 2 0 335.451 4.099 20 0 EIADRP FC(F)(F)Oc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c[nH+]cn3c1)CC2 ZINC000414162732 1022003047 /nfs/dbraw/zinc/00/30/47/1022003047.db2.gz DZXOLDPPMRGJRY-KRWDZBQOSA-N 2 0 347.340 4.010 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc2c[nH+]cn2c1)c1cc(Cl)ccc1OC ZINC000414186780 1022073926 /nfs/dbraw/zinc/07/39/26/1022073926.db2.gz PKEKHXJWCHDTMZ-KRWDZBQOSA-N 2 0 329.831 4.237 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414192279 1022092952 /nfs/dbraw/zinc/09/29/52/1022092952.db2.gz SWAICKQTGRIBCU-HXUWFJFHSA-N 2 0 330.435 4.291 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)C(F)(F)F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000549032162 1022160285 /nfs/dbraw/zinc/16/02/85/1022160285.db2.gz LNPKMDUPMZZCSE-ZBFHGGJFSA-N 2 0 328.422 4.075 20 0 EIADRP Cc1ncc([C@H](C)NC2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)s1 ZINC000245572056 1033035810 /nfs/dbraw/zinc/03/58/10/1033035810.db2.gz CCMFRKIOLJHHHY-OAGGEKHMSA-N 2 0 343.540 4.259 20 0 EIADRP CCCCCOc1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000580637148 1022332927 /nfs/dbraw/zinc/33/29/27/1022332927.db2.gz VTGTXIGXFLRKPC-YOFSQIOKSA-N 2 0 330.516 4.313 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1cncc(Br)c1 ZINC000580659958 1022349370 /nfs/dbraw/zinc/34/93/70/1022349370.db2.gz MARLMWJFOQTYLG-UONOGXRCSA-N 2 0 342.325 4.005 20 0 EIADRP C[NH+](C)CCC1CCN(Cc2cc(C(F)(F)F)ccc2F)CC1 ZINC000511537366 1022362610 /nfs/dbraw/zinc/36/26/10/1022362610.db2.gz NSAVGTNIEFLGQY-UHFFFAOYSA-N 2 0 332.385 4.008 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000564435585 1022395262 /nfs/dbraw/zinc/39/52/62/1022395262.db2.gz JMNJOAOUXSCSLL-CABCVRRESA-N 2 0 328.422 4.130 20 0 EIADRP C[C@H](Cc1ccc(F)cc1)[NH2+][C@@H]1CCN(Cc2ccccc2)C[C@H]1C ZINC000398165573 1022408389 /nfs/dbraw/zinc/40/83/89/1022408389.db2.gz GSYBSAHFRJSWIH-JBYIUTFZSA-N 2 0 340.486 4.257 20 0 EIADRP CSC1(C[NH2+][C@H](C)c2cc3c(s2)CCCC3)CC[NH+](C)CC1 ZINC000580744560 1022447775 /nfs/dbraw/zinc/44/77/75/1022447775.db2.gz YTZPHNZLFVJRNA-CQSZACIVSA-N 2 0 338.586 4.105 20 0 EIADRP Cc1nc([C@@H](C)[NH2+]CC2CC[NH+](CCc3ccccc3)CC2)cs1 ZINC000378206378 1022516856 /nfs/dbraw/zinc/51/68/56/1022516856.db2.gz YZNMDDBVWMBZDD-MRXNPFEDSA-N 2 0 343.540 4.057 20 0 EIADRP C[C@H]([NH2+][C@@H](c1ccccc1)[C@H]1CCOC1)c1ccc(-n2ccnc2)cc1 ZINC000378389942 1022785571 /nfs/dbraw/zinc/78/55/71/1022785571.db2.gz BFWWKEGMRKPNMR-XJABCFGWSA-N 2 0 347.462 4.301 20 0 EIADRP c1sc(-c2ccccc2)nc1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647543412 1022794533 /nfs/dbraw/zinc/79/45/33/1022794533.db2.gz MXXAHMSQWSYYQT-ZWKOTPCHSA-N 2 0 341.524 4.022 20 0 EIADRP Brc1ccc([C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C2CC2)cc1 ZINC000378431632 1022816682 /nfs/dbraw/zinc/81/66/82/1022816682.db2.gz ODKQNFPVEZOZLG-KZNAEPCWSA-N 2 0 349.316 4.117 20 0 EIADRP C[N@@H+](Cc1ccc(Cl)cc1C(F)(F)F)CC1CC[NH+](C)CC1 ZINC001143505847 1022979920 /nfs/dbraw/zinc/97/99/20/1022979920.db2.gz POTJRLGFHRRHIW-UHFFFAOYSA-N 2 0 334.813 4.132 20 0 EIADRP CC[NH+]1CCC([NH2+]Cc2ccc(OCc3ccc(C)cc3)cc2)CC1 ZINC000236920020 1033094467 /nfs/dbraw/zinc/09/44/67/1033094467.db2.gz QJNSSVKUZRXJGU-UHFFFAOYSA-N 2 0 338.495 4.148 20 0 EIADRP Cc1nc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@@H]4CCC[C@@H]43)cc2)cs1 ZINC000581326326 1023023508 /nfs/dbraw/zinc/02/35/08/1023023508.db2.gz TWKUHOPVVGUNGE-QWFCFKBJSA-N 2 0 341.524 4.081 20 0 EIADRP C[C@H]([NH2+]C(Cc1ccccc1)Cc1ccccc1)C1CC[NH+](C)CC1 ZINC000396472947 1023033543 /nfs/dbraw/zinc/03/35/43/1023033543.db2.gz ZCXCCVXWIJHROG-IBGZPJMESA-N 2 0 336.523 4.160 20 0 EIADRP CN1CC[C@H]([NH2+][C@H]2CCCN(c3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000584581444 1023036312 /nfs/dbraw/zinc/03/63/12/1023036312.db2.gz VNRAMWUDGAKDEF-QNWVGRARSA-N 2 0 349.522 4.081 20 0 EIADRP COc1ccc([C@H]([NH2+][C@H](C)C2CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000396471675 1023038561 /nfs/dbraw/zinc/03/85/61/1023038561.db2.gz YBZVXCAHNXRHEO-VGOFRKELSA-N 2 0 338.495 4.105 20 0 EIADRP COc1ccc([C@@H]([NH2+][C@@H](C)C2CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000396471673 1023039542 /nfs/dbraw/zinc/03/95/42/1023039542.db2.gz YBZVXCAHNXRHEO-JTSKRJEESA-N 2 0 338.495 4.105 20 0 EIADRP CCn1cc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)cn1 ZINC000156181227 1023086992 /nfs/dbraw/zinc/08/69/92/1023086992.db2.gz HVBCAFDYUAKRLT-ZWKOTPCHSA-N 2 0 340.515 4.128 20 0 EIADRP Cc1ccccc1SC[C@H](C)C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC001167457588 1023099668 /nfs/dbraw/zinc/09/96/68/1023099668.db2.gz FXWIEXUNKHSYHR-MJGOQNOKSA-N 2 0 332.557 4.141 20 0 EIADRP Cc1nc(C)c([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000178635280 1023163918 /nfs/dbraw/zinc/16/39/18/1023163918.db2.gz HAAZKNGDAIXBOH-HNNXBMFYSA-N 2 0 343.540 4.323 20 0 EIADRP CC[C@@H](CC(F)F)C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000660167146 1023190329 /nfs/dbraw/zinc/19/03/29/1023190329.db2.gz ZMKBGHLEUACPRT-INIZCTEOSA-N 2 0 339.474 4.301 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417347038 1023274478 /nfs/dbraw/zinc/27/44/78/1023274478.db2.gz VOFFRVCFZYDUPB-AFQPOQBFSA-N 2 0 332.557 4.483 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1nc(-c2ccccc2)cs1)c1ccccc1 ZINC000415044003 1023407050 /nfs/dbraw/zinc/40/70/50/1023407050.db2.gz AATHSVDBKLBDKI-GOSISDBHSA-N 2 0 337.492 4.380 20 0 EIADRP CCOCc1ccccc1C[NH2+][C@H](C)c1ccc(-n2ccnc2)cc1 ZINC000119553693 1023410644 /nfs/dbraw/zinc/41/06/44/1023410644.db2.gz PVXJFELXKLIIBS-QGZVFWFLSA-N 2 0 335.451 4.260 20 0 EIADRP COc1ccc(C[C@H](C)C[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1F ZINC000415057564 1023410774 /nfs/dbraw/zinc/41/07/74/1023410774.db2.gz RQUQIJZXASCAKQ-JXFKEZNVSA-N 2 0 344.474 4.083 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+]C2C[C@H]3CC[C@@H](C2)S3)C[N@@H+]1Cc1ccccc1 ZINC000925617564 1023411093 /nfs/dbraw/zinc/41/10/93/1023411093.db2.gz XGNRCHOAPCEBGI-AHSZXGJYSA-N 2 0 344.568 4.303 20 0 EIADRP COc1ccc([C@@H]([NH2+]CC2CC[NH2+]CC2)c2ccccc2Cl)cc1 ZINC000415095227 1023440506 /nfs/dbraw/zinc/44/05/06/1023440506.db2.gz YYTZWIRAPHQSKL-HXUWFJFHSA-N 2 0 344.886 4.027 20 0 EIADRP c1ccc(OC2CCCC2)c(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)c1 ZINC000415095481 1023441115 /nfs/dbraw/zinc/44/11/15/1023441115.db2.gz ZXIBBDKWFLAVJV-XUVXKRRUSA-N 2 0 328.500 4.018 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCN[C@@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000415121016 1023452031 /nfs/dbraw/zinc/45/20/31/1023452031.db2.gz YSKPEYXAAKBRNR-WIBUTAKZSA-N 2 0 330.422 4.151 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC(c2c[nH]c3cc(F)ccc32)CC1 ZINC000472732179 1023469174 /nfs/dbraw/zinc/46/91/74/1023469174.db2.gz FQZNOOFDVBAFIT-SFHVURJKSA-N 2 0 343.490 4.361 20 0 EIADRP CC[NH+](CC)C[C@H]1CC[N@H+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500077005 1023483650 /nfs/dbraw/zinc/48/36/50/1023483650.db2.gz VVPQDPXBAIKMFR-HZPDHXFCSA-N 2 0 342.449 4.473 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Br)c(C)c2)C[C@H]1C ZINC000500088698 1023495152 /nfs/dbraw/zinc/49/51/52/1023495152.db2.gz FQDAPNMFPWXYDZ-GDBMZVCRSA-N 2 0 339.321 4.062 20 0 EIADRP COc1ccsc1[C@H](C)[NH2+]C[C@@H]1CC[N@H+](C)[C@H]1c1ccccc1 ZINC000364312267 1023604203 /nfs/dbraw/zinc/60/42/03/1023604203.db2.gz BTBQEGLLVHVWBE-ZVZYQTTQSA-N 2 0 330.497 4.100 20 0 EIADRP C[C@@H](c1ccccc1C(F)(F)F)[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000377629040 1023644085 /nfs/dbraw/zinc/64/40/85/1023644085.db2.gz PBABHVVHQHQAEG-RDGKXADDSA-N 2 0 326.406 4.323 20 0 EIADRP Cc1c([C@H](C)[NH2+]C[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)cnn1C(C)C ZINC000364467977 1023804347 /nfs/dbraw/zinc/80/43/47/1023804347.db2.gz WSROPOXYKFETSX-SCWSEQNSSA-N 2 0 340.515 4.116 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+]CC[C@@H]3CCC[N@@H+]3C)cc2)cs1 ZINC000341588623 1023895619 /nfs/dbraw/zinc/89/56/19/1023895619.db2.gz BXJBIMBPUBSSLY-KSSFIOAISA-N 2 0 329.513 4.253 20 0 EIADRP C[NH2+]CC1CC[NH+](Cc2ccc(Oc3ccccc3F)c(F)c2)CC1 ZINC000430923619 1024229355 /nfs/dbraw/zinc/22/93/55/1024229355.db2.gz FHEMHXKWXHKGAJ-UHFFFAOYSA-N 2 0 346.421 4.189 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2nn(CC)c3ccccc23)CC1 ZINC000473140033 1024398856 /nfs/dbraw/zinc/39/88/56/1024398856.db2.gz QXBJKFBCZPMPJD-UHFFFAOYSA-N 2 0 342.531 4.000 20 0 EIADRP Cc1cc(C)c([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc1C ZINC000090524023 1024422464 /nfs/dbraw/zinc/42/24/64/1024422464.db2.gz TZKVRCFXXPVOHI-BWAGFHJFSA-N 2 0 344.543 4.030 20 0 EIADRP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1 ZINC000652347859 1024687141 /nfs/dbraw/zinc/68/71/41/1024687141.db2.gz NGVKBXAPAJGLOC-JCHJZTRSSA-N 2 0 336.907 4.009 20 0 EIADRP C[C@H]([NH2+]C/C=C\c1ccc(F)c(F)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000511909683 1024746964 /nfs/dbraw/zinc/74/69/64/1024746964.db2.gz FRJMJEVRSDFNCZ-XQONNYOLSA-N 2 0 334.454 4.221 20 0 EIADRP O=C1CCCC12CC[NH+](Cc1cccc(C[NH+]3CCCCC3)c1)CC2 ZINC000661961650 1024781270 /nfs/dbraw/zinc/78/12/70/1024781270.db2.gz OQYAHABNPZHORP-UHFFFAOYSA-N 2 0 340.511 4.008 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2cnc(-c3ccsc3)s2)CC1 ZINC000092381130 1024799508 /nfs/dbraw/zinc/79/95/08/1024799508.db2.gz CYMSLEPYBZWFCY-UHFFFAOYSA-N 2 0 335.542 4.035 20 0 EIADRP Cc1ccc(C[C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000548483352 1024830380 /nfs/dbraw/zinc/83/03/80/1024830380.db2.gz NPJZKVMHVJGIBO-HQRMLTQVSA-N 2 0 342.552 4.488 20 0 EIADRP CC[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)C(C)C ZINC000342005173 1025034679 /nfs/dbraw/zinc/03/46/79/1025034679.db2.gz QDEVZFCPGCDDPA-OAQYLSRUSA-N 2 0 332.532 4.082 20 0 EIADRP Cc1oc(-c2ccsc2)nc1C[N@H+]1CCC[C@@H](C)[C@H]1CCC[NH3+] ZINC000662314011 1025070002 /nfs/dbraw/zinc/07/00/02/1025070002.db2.gz BCEWAZHWOFEULJ-CXAGYDPISA-N 2 0 333.501 4.051 20 0 EIADRP COCC[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)(C)C ZINC000510993679 1025271163 /nfs/dbraw/zinc/27/11/63/1025271163.db2.gz GEZQVOSMCFXMIE-MXEMCNAFSA-N 2 0 344.543 4.223 20 0 EIADRP CC(C)Oc1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1 ZINC000123681629 1025329904 /nfs/dbraw/zinc/32/99/04/1025329904.db2.gz UNQUCVRONAYIRS-KRWDZBQOSA-N 2 0 326.484 4.386 20 0 EIADRP COCC[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)(C)C ZINC000510994270 1025331525 /nfs/dbraw/zinc/33/15/25/1025331525.db2.gz GEZQVOSMCFXMIE-PLACYPQZSA-N 2 0 344.543 4.223 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1nc(C(F)(F)F)cs1 ZINC000467743348 1025379034 /nfs/dbraw/zinc/37/90/34/1025379034.db2.gz YVWBUVROKLIJOH-CYBMUJFWSA-N 2 0 349.466 4.325 20 0 EIADRP CSc1ccccc1C[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663467335 1025397125 /nfs/dbraw/zinc/39/71/25/1025397125.db2.gz DWCAFYHQDXYNPX-WMZOPIPTSA-N 2 0 332.557 4.051 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cccc(OC(F)F)c1 ZINC000663468248 1025409150 /nfs/dbraw/zinc/40/91/50/1025409150.db2.gz KXTMEOYPHLOFCH-HOCLYGCPSA-N 2 0 338.442 4.061 20 0 EIADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]C1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 ZINC000643458559 1025555840 /nfs/dbraw/zinc/55/58/40/1025555840.db2.gz DJLKVDJHTPWSFU-WGBDABJCSA-N 2 0 346.359 4.003 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@H](Oc2ccccc2OC)C1 ZINC001167827181 1025632515 /nfs/dbraw/zinc/63/25/15/1025632515.db2.gz UMYFNHCHSMEUCU-MOPGFXCFSA-N 2 0 348.531 4.049 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@H](Oc2ccccc2OC)C1 ZINC001167827183 1025635931 /nfs/dbraw/zinc/63/59/31/1025635931.db2.gz UMYFNHCHSMEUCU-OALUTQOASA-N 2 0 348.531 4.049 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(Oc2ccc(C)cc2)CC1 ZINC001167827442 1025656330 /nfs/dbraw/zinc/65/63/30/1025656330.db2.gz WBHXOCGKGJCZTF-LJQANCHMSA-N 2 0 332.532 4.349 20 0 EIADRP Clc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCc3nccn3C1)CCCS2 ZINC000278933294 1025721718 /nfs/dbraw/zinc/72/17/18/1025721718.db2.gz JKFFDRZDYKGTDT-BBRMVZONSA-N 2 0 347.915 4.316 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000512022201 1025748284 /nfs/dbraw/zinc/74/82/84/1025748284.db2.gz FXSCHFIVVNDKQS-WJDWOHSUSA-N 2 0 330.516 4.135 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)sc1Br ZINC000643547892 1025749763 /nfs/dbraw/zinc/74/97/63/1025749763.db2.gz KKIYIDIBJDKESO-NWDGAFQWSA-N 2 0 343.334 4.144 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000512030522 1025800679 /nfs/dbraw/zinc/80/06/79/1025800679.db2.gz JFLVGWIEKNVPOZ-LDADJPATSA-N 2 0 338.495 4.088 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]C/C=C\c2ccc(F)c(F)c2)c1 ZINC000512036364 1025816841 /nfs/dbraw/zinc/81/68/41/1025816841.db2.gz HQAXKJMEXSTOSF-YVMONPNESA-N 2 0 330.422 4.220 20 0 EIADRP CCC[N@H+](Cc1ccc(OC)cc1)Cc1ccc(-n2ccnc2)cc1 ZINC000585749509 1025817795 /nfs/dbraw/zinc/81/77/95/1025817795.db2.gz MKYLDSUBUWFXQA-UHFFFAOYSA-N 2 0 335.451 4.293 20 0 EIADRP C[C@@H]([NH2+][C@@H](c1cccc(Cl)c1)c1ccccn1)C1CC[NH+](C)CC1 ZINC000124640131 1025829251 /nfs/dbraw/zinc/82/92/51/1025829251.db2.gz UMSWXEJLZLHECM-QRWLVFNGSA-N 2 0 343.902 4.144 20 0 EIADRP C[C@@H](Cc1ccsc1)[NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000690063470 1025853385 /nfs/dbraw/zinc/85/33/85/1025853385.db2.gz ZFVOCVKHCDQZRF-PXNSSMCTSA-N 2 0 328.525 4.181 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc(OC(F)(F)F)cc1)c1ccccc1 ZINC000415059609 1025863711 /nfs/dbraw/zinc/86/37/11/1025863711.db2.gz VBYXOXRQVGSMSS-QGZVFWFLSA-N 2 0 338.373 4.155 20 0 EIADRP CCO[C@@H]1C[C@@H]([NH2+]Cc2ccc(Cn3ccnc3)cc2)C1(CC)CC ZINC000344033680 1025889480 /nfs/dbraw/zinc/88/94/80/1025889480.db2.gz LPXHNRVSHVIAFV-WOJBJXKFSA-N 2 0 341.499 4.005 20 0 EIADRP CCOC(=O)C[N@H+]([C@H](C)CCC[NH+](CC)CC)[C@H](C)c1ccccc1 ZINC001167842439 1025913281 /nfs/dbraw/zinc/91/32/81/1025913281.db2.gz XIICLOQCDBFPRP-RTBURBONSA-N 2 0 348.531 4.123 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cc(C)c(Br)s2)C1 ZINC000512130021 1026077541 /nfs/dbraw/zinc/07/75/41/1026077541.db2.gz MNMSTUIGANKHDT-OLZOCXBDSA-N 2 0 345.350 4.202 20 0 EIADRP Clc1cncc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C2CC2)c1 ZINC001167975031 1026220144 /nfs/dbraw/zinc/22/01/44/1026220144.db2.gz FWGSBQPCHJIAKS-NXEWRWPSSA-N 2 0 345.918 4.181 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000657348549 1026221634 /nfs/dbraw/zinc/22/16/34/1026221634.db2.gz ZOJMXYRYQQBFFI-GOSISDBHSA-N 2 0 343.540 4.329 20 0 EIADRP CCC(CC)[N@@H+](C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001167975897 1026306902 /nfs/dbraw/zinc/30/69/02/1026306902.db2.gz ZNXJGVUQGLKOAY-LTKMZVMPSA-N 3 0 347.591 4.152 20 0 EIADRP c1cc(N2CCC(C[NH2+]Cc3ccc(C4CCC4)cc3)CC2)cc[nH+]1 ZINC000550200148 1026317970 /nfs/dbraw/zinc/31/79/70/1026317970.db2.gz XUDHCCGGYHCIBF-UHFFFAOYSA-N 2 0 335.495 4.355 20 0 EIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3cc(Cl)cc4cccnc43)C2)CC1 ZINC000550200411 1026334589 /nfs/dbraw/zinc/33/45/89/1026334589.db2.gz IVKZSZDJVLZVCD-KRWDZBQOSA-N 2 0 343.902 4.052 20 0 EIADRP Fc1c(Cl)cccc1CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167978529 1026346273 /nfs/dbraw/zinc/34/62/73/1026346273.db2.gz OKXAADOLDMUNIS-ALOPSCKCSA-N 2 0 336.882 4.017 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3CC1CC1)CCC2 ZINC001167981741 1026367912 /nfs/dbraw/zinc/36/79/12/1026367912.db2.gz HUEPIUPQOCHDQY-SOUXKNCUSA-N 2 0 340.511 4.068 20 0 EIADRP Fc1c(CNC2CC[NH+](C3CCCCC3)CC2)cccc1OC1CC1 ZINC000657384330 1026401122 /nfs/dbraw/zinc/40/11/22/1026401122.db2.gz OVHNEGCHXMNVLJ-UHFFFAOYSA-N 2 0 346.490 4.254 20 0 EIADRP Cc1ccc(COc2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H](C)C3)cc2)cc1 ZINC000608061368 1026407447 /nfs/dbraw/zinc/40/74/47/1026407447.db2.gz RGXOILJNFWAARJ-GHTZIAJQSA-N 2 0 338.495 4.146 20 0 EIADRP COc1ccc2ccccc2c1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000506926922 1026533181 /nfs/dbraw/zinc/53/31/81/1026533181.db2.gz OAKQCVTXZNOOOJ-UHFFFAOYSA-N 2 0 338.495 4.156 20 0 EIADRP c1cc(C[N@@H+]2CC[C@@H](c3ccncc3)C2)cc(C[NH+]2CCCCC2)c1 ZINC000563363148 1026674321 /nfs/dbraw/zinc/67/43/21/1026674321.db2.gz HNTQOUVNFTVUPY-JOCHJYFZSA-N 2 0 335.495 4.057 20 0 EIADRP CCc1cccnc1[C@H](C)[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000507520671 1026827115 /nfs/dbraw/zinc/82/71/15/1026827115.db2.gz SFKXZDIRAAPHOB-KRWDZBQOSA-N 2 0 325.500 4.335 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH2+]CCCC[N@@H+](C)C2CC2)cc1 ZINC000657489347 1026849783 /nfs/dbraw/zinc/84/97/83/1026849783.db2.gz ZVBODFMQMJKWTP-UHFFFAOYSA-N 2 0 329.513 4.083 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@@H]3CCCc4cccnc43)cc2)C1 ZINC000684954079 1026888704 /nfs/dbraw/zinc/88/87/04/1026888704.db2.gz PJDFCSLTKCFGES-XMSQKQJNSA-N 2 0 349.522 4.481 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000519771078 1026982704 /nfs/dbraw/zinc/98/27/04/1026982704.db2.gz KBIPRUUTLCQPSB-NPFVIJTESA-N 2 0 338.495 4.039 20 0 EIADRP CC1(C)C[C@H]([NH2+]CCc2noc3ccccc32)CN1Cc1ccccc1 ZINC000657534860 1026989734 /nfs/dbraw/zinc/98/97/34/1026989734.db2.gz UPMSTOWQYFOGAD-SFHVURJKSA-N 2 0 349.478 4.013 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)[C@H](C)C1 ZINC000342810181 1027093727 /nfs/dbraw/zinc/09/37/27/1027093727.db2.gz PDDILRIQBHIENG-CBGDNZLLSA-N 2 0 330.516 4.074 20 0 EIADRP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)[C@H](C)c1nc2ccccc2s1 ZINC000474477167 1027110595 /nfs/dbraw/zinc/11/05/95/1027110595.db2.gz QSWVSIHXSXNXPD-JKSUJKDBSA-N 2 0 331.529 4.254 20 0 EIADRP C[C@@H]([NH2+]CCC[NH+]1CCC(C)CC1)[C@@H](C)c1nc2ccccc2s1 ZINC000474483090 1027120126 /nfs/dbraw/zinc/12/01/26/1027120126.db2.gz SBSIELAPTJGYQV-IAGOWNOFSA-N 2 0 345.556 4.500 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)C1CCOCC1 ZINC000474483448 1027120972 /nfs/dbraw/zinc/12/09/72/1027120972.db2.gz AAALBMQDAJBZBG-OTWHNJEPSA-N 2 0 344.543 4.069 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)C1CCOCC1 ZINC000474484329 1027121080 /nfs/dbraw/zinc/12/10/80/1027121080.db2.gz HXOKRCNVJMDSJM-CEXWTWQISA-N 2 0 344.543 4.069 20 0 EIADRP c1ccc2c(c1)cccc2CSCC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000166278200 1027251158 /nfs/dbraw/zinc/25/11/58/1027251158.db2.gz PSHBKXVINBBEIP-VQTJNVASSA-N 2 0 340.536 4.289 20 0 EIADRP c1ccc2c(c1)cccc2C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657611672 1027283122 /nfs/dbraw/zinc/28/31/22/1027283122.db2.gz CBCCVEDOJSYCFM-UHFFFAOYSA-N 2 0 345.490 4.237 20 0 EIADRP Cc1ccc(C[NH+]2CCCCC2)cc1N1C(C)(C)CC([NH3+])CC1(C)C ZINC001167626232 1027489018 /nfs/dbraw/zinc/48/90/18/1027489018.db2.gz AJDUVTYYWPYZOM-UHFFFAOYSA-N 2 0 343.559 4.466 20 0 EIADRP CC(C)OC1CCC([NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)CC1 ZINC000090771725 1027594228 /nfs/dbraw/zinc/59/42/28/1027594228.db2.gz UNLLUJATOTVFOP-QHGAOEGBSA-N 2 0 348.531 4.014 20 0 EIADRP CCCc1nc(C)c(C[NH+]2CCC(CCC[NH+](CC)CC)CC2)o1 ZINC000428361353 1027661923 /nfs/dbraw/zinc/66/19/23/1027661923.db2.gz MGWMMDDTTFXQGC-UHFFFAOYSA-N 2 0 335.536 4.270 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1cncs1 ZINC000121642639 1027795867 /nfs/dbraw/zinc/79/58/67/1027795867.db2.gz DEMKXWAVXUXTST-INIZCTEOSA-N 2 0 329.513 4.370 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc(-c4ccsc4)cc3)CC[C@@H]21 ZINC001167648120 1027843449 /nfs/dbraw/zinc/84/34/49/1027843449.db2.gz RIYKVYBVUJUIQP-QUCCMNQESA-N 2 0 326.509 4.331 20 0 EIADRP CC(F)(F)CCC[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001167648718 1027852544 /nfs/dbraw/zinc/85/25/44/1027852544.db2.gz XLXFZCVLFLCJPK-MOPGFXCFSA-N 2 0 336.470 4.408 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2C[C@H]3[C@H](CCC3(F)F)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168045869 1027963924 /nfs/dbraw/zinc/96/39/24/1027963924.db2.gz LJMHOEHYZHJOGR-LHDHZVESSA-N 2 0 348.481 4.405 20 0 EIADRP C(=C/C[N@@H+]1CCC[C@H]1c1ccncc1)\C[NH+]1CCC[C@@H]1c1ccncc1 ZINC000153967963 1028068096 /nfs/dbraw/zinc/06/80/96/1028068096.db2.gz MMSJPTZXSMTSFJ-XFDDJKQHSA-N 2 0 348.494 4.007 20 0 EIADRP Cc1ccc2cc(C[NH2+][C@@H](C)[C@H]3CCC[N@@H+](C4CCC4)C3)ccc2n1 ZINC000189427169 1028134612 /nfs/dbraw/zinc/13/46/12/1028134612.db2.gz CAJGRTOOAQKREW-PXNSSMCTSA-N 2 0 337.511 4.286 20 0 EIADRP Cc1cccc([C@H](O)C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)c1 ZINC001167660090 1028268094 /nfs/dbraw/zinc/26/80/94/1028268094.db2.gz ZFKIRFZPWGYURR-SIKLNZKXSA-N 2 0 344.543 4.005 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC000346132383 1028273366 /nfs/dbraw/zinc/27/33/66/1028273366.db2.gz BWYYVVKMKXQPBB-HXUWFJFHSA-N 2 0 346.478 4.030 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1)c1cccs1 ZINC000124602678 1028273943 /nfs/dbraw/zinc/27/39/43/1028273943.db2.gz OJMWLTDNDWHDNS-ULQDDVLXSA-N 2 0 344.524 4.208 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000280995070 1028314212 /nfs/dbraw/zinc/31/42/12/1028314212.db2.gz XETVQZPTLZQUOZ-OFNKIYASSA-N 2 0 349.522 4.077 20 0 EIADRP CC(C)C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccncc1 ZINC000647289152 1028646250 /nfs/dbraw/zinc/64/62/50/1028646250.db2.gz DJUCVDMAMJELMT-HXUWFJFHSA-N 2 0 329.463 4.159 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2cnc(C(F)(F)F)s2)C1 ZINC000443991942 1028711548 /nfs/dbraw/zinc/71/15/48/1028711548.db2.gz XJEAHAHGWWJEEX-BETUJISGSA-N 2 0 349.466 4.010 20 0 EIADRP c1cc2c(cccc2C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C2)[nH]1 ZINC000583423339 1028716834 /nfs/dbraw/zinc/71/68/34/1028716834.db2.gz FEADJNLCWBKOGV-TZIWHRDSSA-N 2 0 345.490 4.122 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](CCOc2cccc3ccccc32)CC1 ZINC000524156299 1028723306 /nfs/dbraw/zinc/72/33/06/1028723306.db2.gz OJMSUGODUVBNQO-UHFFFAOYSA-N 2 0 340.511 4.271 20 0 EIADRP Clc1ccc([C@H]2C[C@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)cc1Cl ZINC000281644675 1028821772 /nfs/dbraw/zinc/82/17/72/1028821772.db2.gz PEJBTUTTXLYPJY-YHUYYLMFSA-N 2 0 339.310 4.456 20 0 EIADRP COCCC[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(F)cc1 ZINC000281880213 1028907928 /nfs/dbraw/zinc/90/79/28/1028907928.db2.gz GDUYVVSNFBZWAZ-OAQYLSRUSA-N 2 0 344.474 4.145 20 0 EIADRP Clc1ccc(OCCC[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1 ZINC000524594816 1029098496 /nfs/dbraw/zinc/09/84/96/1029098496.db2.gz WZKKRBNYAFSNNK-GOSISDBHSA-N 2 0 336.907 4.059 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(C(F)(F)F)cc1 ZINC000650752521 1029139010 /nfs/dbraw/zinc/13/90/10/1029139010.db2.gz SPONGPKQFVHBCL-NSHDSACASA-N 2 0 326.337 4.154 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCSc3ccc(Cl)cc32)c(F)c1 ZINC000650752564 1029141239 /nfs/dbraw/zinc/14/12/39/1029141239.db2.gz UFQJXLDAMJAEOX-INIZCTEOSA-N 2 0 336.863 4.265 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)c(F)c1 ZINC000650754227 1029172161 /nfs/dbraw/zinc/17/21/61/1029172161.db2.gz DJTJQVOYCDDFLK-HXUWFJFHSA-N 2 0 330.422 4.445 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CCSCc2cccc3ccccc32)CC[N@@H+]1C ZINC000151159371 1029217035 /nfs/dbraw/zinc/21/70/35/1029217035.db2.gz QMXJVMOVDKUQIQ-QFBILLFUSA-N 2 0 328.525 4.145 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000278480440 1029324792 /nfs/dbraw/zinc/32/47/92/1029324792.db2.gz OPJIILKYDKCCCB-CABCVRRESA-N 2 0 343.540 4.252 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)CCS2 ZINC000343493591 1029357979 /nfs/dbraw/zinc/35/79/79/1029357979.db2.gz DCBDPCXJCHHLIS-APWZRJJASA-N 2 0 348.556 4.476 20 0 EIADRP CCOCC1CC[NH+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168059679 1029440621 /nfs/dbraw/zinc/44/06/21/1029440621.db2.gz GHENJZRINXOISQ-OALUTQOASA-N 2 0 344.543 4.177 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1F ZINC000168503190 1029485712 /nfs/dbraw/zinc/48/57/12/1029485712.db2.gz RCRJDIVGLIYOLL-IAGOWNOFSA-N 2 0 344.474 4.486 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)CC(F)F ZINC000647319347 1029521770 /nfs/dbraw/zinc/52/17/70/1029521770.db2.gz WVDMGSMTBDSFAC-GDAAHCPNSA-N 2 0 336.470 4.168 20 0 EIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC000158563720 1029523741 /nfs/dbraw/zinc/52/37/41/1029523741.db2.gz OLGXFWKXISFRPE-KSZLIROESA-N 2 0 345.531 4.054 20 0 EIADRP C[C@@H]1CCC[C@H]([NH2+]C2CC(N3CCC(C(F)(F)F)CC3)C2)[C@@H]1C ZINC000475352775 1029565384 /nfs/dbraw/zinc/56/53/84/1029565384.db2.gz JAPIRBXHSGZGFP-WYEXVOONSA-N 2 0 332.454 4.206 20 0 EIADRP C[C@H]1CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CS1 ZINC000655710802 1029572314 /nfs/dbraw/zinc/57/23/14/1029572314.db2.gz FSTUBCMALRSBBL-NTHMGXEOSA-N 2 0 330.541 4.056 20 0 EIADRP Cc1ccc([C@@H]([NH2+]CCCC[N@@H+]2CCC[C@H]2CO)C2CCCC2)cc1 ZINC000446820467 1029588958 /nfs/dbraw/zinc/58/89/58/1029588958.db2.gz CWETZLZQBMBPDW-VXKWHMMOSA-N 2 0 344.543 4.053 20 0 EIADRP CCO[C@H](C[NH2+]C1CC[NH+]([C@H]2CCC[C@H](C)C2)CC1)c1ccccc1 ZINC000446838156 1029599225 /nfs/dbraw/zinc/59/92/25/1029599225.db2.gz FONBMHIUMUCABB-YUXAGFNASA-N 2 0 344.543 4.397 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)CCCO2 ZINC000359938932 1029602910 /nfs/dbraw/zinc/60/29/10/1029602910.db2.gz AMPAWYZQWOAJIZ-PXNSSMCTSA-N 2 0 346.515 4.153 20 0 EIADRP CCC[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccccn1 ZINC000158890175 1029611383 /nfs/dbraw/zinc/61/13/83/1029611383.db2.gz OTSJBYSSJHGYOE-LJQANCHMSA-N 2 0 343.540 4.486 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cc2cnccc2o1 ZINC000657828244 1029624702 /nfs/dbraw/zinc/62/47/02/1029624702.db2.gz QEMNUSRNDJXMFD-INIZCTEOSA-N 2 0 335.451 4.274 20 0 EIADRP FC(F)(F)c1ccc(Cl)c(C[NH2+]CC2CC[NH+](C3CC3)CC2)c1 ZINC000446885477 1029631307 /nfs/dbraw/zinc/63/13/07/1029631307.db2.gz WZBFNZFESIVWHX-UHFFFAOYSA-N 2 0 346.824 4.323 20 0 EIADRP CC1(c2ccccc2)CCC([NH2+]CC2CC[NH+](C3CC3)CC2)CC1 ZINC000446885660 1029631470 /nfs/dbraw/zinc/63/14/70/1029631470.db2.gz ASGNWPWMUHHBOH-UHFFFAOYSA-N 2 0 326.528 4.351 20 0 EIADRP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+]CCC[NH+]1CCCC1 ZINC000584135814 1029642112 /nfs/dbraw/zinc/64/21/12/1029642112.db2.gz WYDBKDLCKFPUHX-NTCAYCPXSA-N 2 0 326.406 4.184 20 0 EIADRP FC(F)(F)C1CCC([NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000192927839 1029648244 /nfs/dbraw/zinc/64/82/44/1029648244.db2.gz NHHDXNSBWWBEIS-AOCRQIFASA-N 2 0 340.433 4.219 20 0 EIADRP CC(C)N1CCc2nc(C[N@H+](C)[C@@H](C)C3CCCCC3)sc2C1 ZINC000447069639 1029686916 /nfs/dbraw/zinc/68/69/16/1029686916.db2.gz STCHPSQGLXDWSU-HNNXBMFYSA-N 2 0 335.561 4.310 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000708510417 1029743306 /nfs/dbraw/zinc/74/33/06/1029743306.db2.gz JXVSRBSVBCUHFN-JXFKEZNVSA-N 2 0 344.449 4.482 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cccc3cnccc32)C1 ZINC000248390306 1029807606 /nfs/dbraw/zinc/80/76/06/1029807606.db2.gz TWOMJUITTMQFJZ-MOPGFXCFSA-N 2 0 337.511 4.321 20 0 EIADRP CCOc1ccccc1[C@@H](C)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000089215729 1029846401 /nfs/dbraw/zinc/84/64/01/1029846401.db2.gz SLTPFIHFHWTJJL-QGZVFWFLSA-N 2 0 339.483 4.048 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)c(F)c1)c1cc2ccccc2o1 ZINC000090919860 1029865874 /nfs/dbraw/zinc/86/58/74/1029865874.db2.gz CQEIPNABZOKHRA-CQSZACIVSA-N 2 0 326.415 4.484 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1cccnc1Cl ZINC000090775351 1029869657 /nfs/dbraw/zinc/86/96/57/1029869657.db2.gz NGPSEJAPHDRHSE-KLAILNCOSA-N 2 0 335.923 4.429 20 0 EIADRP Cc1cc(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)cc(C)c1OC(F)F ZINC000092072038 1029898695 /nfs/dbraw/zinc/89/86/95/1029898695.db2.gz JKJSBAIZTOTIMU-HNNXBMFYSA-N 2 0 335.398 4.008 20 0 EIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)cc1 ZINC000092072859 1029899533 /nfs/dbraw/zinc/89/95/33/1029899533.db2.gz DMSQHTKSJWTHRD-LJQANCHMSA-N 2 0 347.462 4.465 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1ccc(F)cn1 ZINC000092739200 1029931639 /nfs/dbraw/zinc/93/16/39/1029931639.db2.gz IINWQCKZOMSQAU-IRXDYDNUSA-N 2 0 341.474 4.446 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1cc2ccncc2s1 ZINC000657884050 1030187471 /nfs/dbraw/zinc/18/74/71/1030187471.db2.gz IPZFTXUYNGJIMK-CYBMUJFWSA-N 2 0 343.471 4.348 20 0 EIADRP Cc1cc(Cl)c2c(c1)[C@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CCCO2 ZINC000447575849 1030204440 /nfs/dbraw/zinc/20/44/40/1030204440.db2.gz ZPGLWJUSGMWRAD-LJQANCHMSA-N 2 0 348.918 4.326 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C[C@@H]2CCC3(CCCC3)O2)C1 ZINC000530358419 1030337967 /nfs/dbraw/zinc/33/79/67/1030337967.db2.gz ZQKPMSQORVLIAF-AQNXPRMDSA-N 2 0 334.548 4.065 20 0 EIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccc(Oc4ccccc4)o3)C2)CC1 ZINC000685462860 1030343416 /nfs/dbraw/zinc/34/34/16/1030343416.db2.gz VFXUMRJATBYWMD-GOSISDBHSA-N 2 0 340.467 4.236 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C ZINC000708566638 1030384528 /nfs/dbraw/zinc/38/45/28/1030384528.db2.gz RHWMYNHBYYZAGA-DBXWQHBBSA-N 2 0 340.486 4.114 20 0 EIADRP C[C@H]([NH2+]CCc1ccc(F)c(F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000527041847 1030421220 /nfs/dbraw/zinc/42/12/20/1030421220.db2.gz BSTWTEHIJUHSFI-QFBILLFUSA-N 2 0 344.449 4.008 20 0 EIADRP C[C@H]([NH2+]CCCc1ccccc1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000530477272 1030447052 /nfs/dbraw/zinc/44/70/52/1030447052.db2.gz XBPRETQYAMNESR-RXVVDRJESA-N 2 0 340.486 4.259 20 0 EIADRP Cc1nccn1CCCCN1C[C@@H](c2cccc(Cl)c2)OC[C@@H]1C ZINC000189494622 1030472577 /nfs/dbraw/zinc/47/25/77/1030472577.db2.gz NIYCUVXXUYJCJW-KXBFYZLASA-N 2 0 347.890 4.087 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2ccc3sccc3c2)cc1 ZINC000685624857 1030582771 /nfs/dbraw/zinc/58/27/71/1030582771.db2.gz WGNRRCYYAJMJGJ-UHFFFAOYSA-N 2 0 340.492 4.132 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCOc2ccc3ccccc3c2)C[C@H]1C ZINC000530662947 1030620298 /nfs/dbraw/zinc/62/02/98/1030620298.db2.gz RXDWRDXVDHATOU-YLJYHZDGSA-N 2 0 326.484 4.023 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc3ccncc3s2)C1 ZINC000657932147 1030637191 /nfs/dbraw/zinc/63/71/91/1030637191.db2.gz UQPQMHBWDDNADY-CVEARBPZSA-N 2 0 331.529 4.315 20 0 EIADRP C[C@@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000657939003 1030650312 /nfs/dbraw/zinc/65/03/12/1030650312.db2.gz SRVYFQRIFYIWDJ-LBPRGKRZSA-N 2 0 346.824 4.141 20 0 EIADRP C[C@H]([NH2+]CCCCOc1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000527354936 1030661688 /nfs/dbraw/zinc/66/16/88/1030661688.db2.gz OAFPUEYSCGKFCQ-RBUKOAKNSA-N 2 0 330.516 4.088 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C)s2)cc1 ZINC000192926430 1030718392 /nfs/dbraw/zinc/71/83/92/1030718392.db2.gz HMTMLDBSEVSHKM-ALOPSCKCSA-N 2 0 342.508 4.139 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(C(F)F)nc1 ZINC000657999293 1030767489 /nfs/dbraw/zinc/76/74/89/1030767489.db2.gz TXCYQKJMBFALSV-NVXWUHKLSA-N 2 0 345.437 4.192 20 0 EIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2noc3ccccc32)CC1 ZINC000658067242 1030814557 /nfs/dbraw/zinc/81/45/57/1030814557.db2.gz TWKXKVPSLCGKKJ-OXJNMPFZSA-N 2 0 341.499 4.003 20 0 EIADRP C[C@@H]1[C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C[C@@H]1c1ccccc1 ZINC000658164475 1030860967 /nfs/dbraw/zinc/86/09/67/1030860967.db2.gz DKGAFRGGTXBZIQ-TZYHBYERSA-N 2 0 349.522 4.075 20 0 EIADRP Cc1ccsc1[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658164786 1030861041 /nfs/dbraw/zinc/86/10/41/1030861041.db2.gz FLTIBAHKVITGRB-MRXNPFEDSA-N 2 0 329.513 4.014 20 0 EIADRP Cc1ccccc1C1CC([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C1 ZINC000658166845 1030861958 /nfs/dbraw/zinc/86/19/58/1030861958.db2.gz QBFAKALMCLUMCQ-UHFFFAOYSA-N 2 0 349.522 4.138 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccsc1 ZINC000658166905 1030863128 /nfs/dbraw/zinc/86/31/28/1030863128.db2.gz WCFZTIYSXBLIOX-LJQANCHMSA-N 2 0 329.513 4.096 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)[C@H](C)C2 ZINC000658168495 1030865995 /nfs/dbraw/zinc/86/59/95/1030865995.db2.gz XNBGJWUZTURZRU-JPYJTQIMSA-N 2 0 349.522 4.125 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)cc1OCCC ZINC000392722151 1030946209 /nfs/dbraw/zinc/94/62/09/1030946209.db2.gz PTWYZTCJCPXEGI-ZWKOTPCHSA-N 2 0 348.531 4.257 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cnc2ccsc2c1 ZINC000658354929 1031024270 /nfs/dbraw/zinc/02/42/70/1031024270.db2.gz GIOHRGBWKZJKFK-AWEZNQCLSA-N 2 0 329.513 4.069 20 0 EIADRP CSc1ccccc1C[C@@H](C)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658357666 1031028250 /nfs/dbraw/zinc/02/82/50/1031028250.db2.gz VFQTVQZDQBQPDM-MRXNPFEDSA-N 2 0 332.557 4.051 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCSc2ccc(Cl)cc2)[C@H](C)C1 ZINC001167686155 1031029675 /nfs/dbraw/zinc/02/96/75/1031029675.db2.gz OICXACFCFZZISX-RHSMWYFYSA-N 2 0 326.937 4.094 20 0 EIADRP C[NH+]1CCC(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3Cl)C2)CC1 ZINC001207399062 1031055060 /nfs/dbraw/zinc/05/50/60/1031055060.db2.gz XMBDHENVRNCGAS-CQSZACIVSA-N 2 0 327.299 4.125 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H]1CCc2ccccc21 ZINC000532446487 1031082891 /nfs/dbraw/zinc/08/28/91/1031082891.db2.gz CMWPFEJCCNHKJL-NRFANRHFSA-N 2 0 338.495 4.184 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+][C@@H]1CSCCc2ccccc21 ZINC000532459794 1031099619 /nfs/dbraw/zinc/09/96/19/1031099619.db2.gz MGUXAHSFRAMYGF-FXAWDEMLSA-N 2 0 332.557 4.261 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCCOc1ccc(Cl)cc1Cl ZINC000532464689 1031123718 /nfs/dbraw/zinc/12/37/18/1031123718.db2.gz ZIBFIHXMECYVNM-XJKCOSOUSA-N 2 0 345.314 4.081 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1cccc(CO)c1 ZINC000305665113 1031213933 /nfs/dbraw/zinc/21/39/33/1031213933.db2.gz TZOQSYYUZNMIRA-GOSISDBHSA-N 2 0 338.495 4.016 20 0 EIADRP CCC(CC)(CN[C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C)[NH2+][C@H](C)c1ccccc1 ZINC000532517023 1031249572 /nfs/dbraw/zinc/24/95/72/1031249572.db2.gz MAWIRKASXQLFEJ-RCLSDMTESA-N 2 0 345.575 4.214 20 0 EIADRP CCC(CC)(CN[C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C)[NH2+][C@@H](C)c1ccccc1 ZINC000532517024 1031249756 /nfs/dbraw/zinc/24/97/56/1031249756.db2.gz MAWIRKASXQLFEJ-VNYTWHDVSA-N 2 0 345.575 4.214 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+]C2CCC(OC3CCCC3)CC2)cc1 ZINC000449060752 1031390560 /nfs/dbraw/zinc/39/05/60/1031390560.db2.gz GSNVHQSPXBCUII-UHFFFAOYSA-N 2 0 330.516 4.108 20 0 EIADRP C[C@H](CN1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1)c1cc(F)cc(F)c1 ZINC000449044072 1031395503 /nfs/dbraw/zinc/39/55/03/1031395503.db2.gz BJUZQIUZIQVOAR-SXGZJXTBSA-N 2 0 334.454 4.017 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)[C@@H](C)O1 ZINC000449074684 1031429196 /nfs/dbraw/zinc/42/91/96/1031429196.db2.gz LPAWPAPXKDYULF-DRSNIGMVSA-N 2 0 338.495 4.071 20 0 EIADRP Clc1ccc(C2=CC[C@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)CC2)cc1 ZINC000449089121 1031448825 /nfs/dbraw/zinc/44/88/25/1031448825.db2.gz JICCKKQQTOBXDY-UFYCRDLUSA-N 2 0 330.903 4.492 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CCN(Cc2ncccc2Cl)CC1 ZINC000528369070 1031452543 /nfs/dbraw/zinc/45/25/43/1031452543.db2.gz PUIMLUAHVODEID-UHFFFAOYSA-N 2 0 343.902 4.079 20 0 EIADRP CCC(CC)(CCO)C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449179599 1031515227 /nfs/dbraw/zinc/51/52/27/1031515227.db2.gz WSEYSYORENRVNC-UHFFFAOYSA-N 2 0 340.596 4.444 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ncc(-c2ccccc2)n1C ZINC000453065791 1031529981 /nfs/dbraw/zinc/52/99/81/1031529981.db2.gz XTHVYVBKSVMXIM-ZWKOTPCHSA-N 2 0 342.531 4.248 20 0 EIADRP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)CCCc1cccnc1 ZINC000453064828 1031530317 /nfs/dbraw/zinc/53/03/17/1031530317.db2.gz ULNHPGWHKRLYKE-LJQANCHMSA-N 2 0 339.527 4.423 20 0 EIADRP COc1cc(C[NH2+]C2CCC(C[NH+](C)C)CC2)cc2ccccc21 ZINC000449211967 1031538175 /nfs/dbraw/zinc/53/81/75/1031538175.db2.gz VNEFJLRBXDXRBP-UHFFFAOYSA-N 2 0 326.484 4.058 20 0 EIADRP C[C@@H](CC(F)(F)F)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449249482 1031565463 /nfs/dbraw/zinc/56/54/63/1031565463.db2.gz LVJZINZFTZKKHI-GJZGRUSLSA-N 2 0 328.422 4.013 20 0 EIADRP CN(Cc1ccccn1)[C@@H]1CCC[N@H+](Cc2cccc3ccoc32)CC1 ZINC000449264333 1031601466 /nfs/dbraw/zinc/60/14/66/1031601466.db2.gz LNMOAVNTUHBVED-OAQYLSRUSA-N 2 0 349.478 4.314 20 0 EIADRP FC(F)(F)CCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@H]21 ZINC000453122731 1031618115 /nfs/dbraw/zinc/61/81/15/1031618115.db2.gz PKDYFHQYRJQBTC-KSZLIROESA-N 2 0 340.433 4.362 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]C2CCN([C@@H](C)c3ccncc3)CC2)cs1 ZINC000453176531 1031649548 /nfs/dbraw/zinc/64/95/48/1031649548.db2.gz RCVJAULUTVYPEU-CVEARBPZSA-N 2 0 329.513 4.328 20 0 EIADRP CC(C)[C@@H](O)C1(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CC1 ZINC000453172014 1031680945 /nfs/dbraw/zinc/68/09/45/1031680945.db2.gz GAAZVVRKCUTCQO-GOSISDBHSA-N 2 0 338.580 4.052 20 0 EIADRP CC(C)[C@@H]1C[C@@H](C[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)CCO1 ZINC000449494501 1031786147 /nfs/dbraw/zinc/78/61/47/1031786147.db2.gz NIUDHAQZSWKYAZ-ZFMNYDKASA-N 2 0 336.564 4.070 20 0 EIADRP FC1(F)CC(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)C1 ZINC000453242257 1031795561 /nfs/dbraw/zinc/79/55/61/1031795561.db2.gz PYGGRXLLNVIYBE-OTWHNJEPSA-N 2 0 334.454 4.065 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCCCC1(F)F)c1ccc(OCC[NH+](C)C)cc1 ZINC000453242074 1031799846 /nfs/dbraw/zinc/79/98/46/1031799846.db2.gz FBEINZABQYEUEP-RDJZCZTQSA-N 2 0 340.458 4.103 20 0 EIADRP C[C@@H](Cc1c(Cl)cccc1Cl)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449560531 1031847075 /nfs/dbraw/zinc/84/70/75/1031847075.db2.gz MHYGMZJLCYFGNS-FUDCBSFHSA-N 2 0 327.299 4.139 20 0 EIADRP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000453351986 1031880758 /nfs/dbraw/zinc/88/07/58/1031880758.db2.gz NAIGBMBZPCDAOI-XYTVBORESA-N 2 0 338.948 4.426 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cc1 ZINC000531972879 1031908487 /nfs/dbraw/zinc/90/84/87/1031908487.db2.gz BEMRBFRKIGSERO-RTBURBONSA-N 2 0 332.532 4.433 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1cc(F)c(F)c(F)c1 ZINC000531973136 1031912716 /nfs/dbraw/zinc/91/27/16/1031912716.db2.gz TTWNDXNLNODWES-AWEZNQCLSA-N 2 0 328.422 4.411 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+]C1CCC2(CCOCC2)CC1 ZINC000531979783 1031921822 /nfs/dbraw/zinc/92/18/22/1031921822.db2.gz VSVWPYQAUCIGFK-AZUAARDMSA-N 2 0 336.564 4.216 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]C[C@@H]2CCOC(C)(C)C2)cc1 ZINC000453417279 1031952648 /nfs/dbraw/zinc/95/26/48/1031952648.db2.gz KCOWSAHJEAKWAT-DOTOQJQBSA-N 2 0 327.472 4.037 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453393313 1031960286 /nfs/dbraw/zinc/96/02/86/1031960286.db2.gz FYFHRPJKTLUNNH-HXUWFJFHSA-N 2 0 325.500 4.318 20 0 EIADRP C[C@H](C[NH2+]CCCC[N@H+](C)C1CC1)c1ccc(C(F)(F)F)cc1 ZINC000453591454 1032037404 /nfs/dbraw/zinc/03/74/04/1032037404.db2.gz CCAAJQZVGFDLBI-CQSZACIVSA-N 2 0 328.422 4.273 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1cccnc1Cl ZINC000178634845 1033360995 /nfs/dbraw/zinc/36/09/95/1033360995.db2.gz CQONWVJOVPAQLN-INIZCTEOSA-N 2 0 343.902 4.298 20 0 EIADRP FC(F)(F)CCC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000512653431 1033619316 /nfs/dbraw/zinc/61/93/16/1033619316.db2.gz FHIFODHMDTVILA-KZNAEPCWSA-N 2 0 340.433 4.219 20 0 EIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](CC3CCC(F)(F)CC3)C2)CC1 ZINC001307440786 1033780449 /nfs/dbraw/zinc/78/04/49/1033780449.db2.gz SUVIIVWKPJMILI-SFHVURJKSA-N 2 0 328.491 4.256 20 0 EIADRP COc1cc(-c2ccccc2)ccc1C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000512774052 1033914640 /nfs/dbraw/zinc/91/46/40/1033914640.db2.gz VRCBYLXJGRINQJ-UHFFFAOYSA-N 2 0 338.495 4.136 20 0 EIADRP Cc1ccc(F)c(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000397549976 1034284221 /nfs/dbraw/zinc/28/42/21/1034284221.db2.gz SBVVGXWRINDNPC-UHFFFAOYSA-N 2 0 326.459 4.136 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(F)c3cccnc23)CC1 ZINC000052210068 1034411484 /nfs/dbraw/zinc/41/14/84/1034411484.db2.gz PWPQSFAGKBYQNW-UHFFFAOYSA-N 2 0 343.490 4.318 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]C2CCC([NH3+])CC2)CCC3)cc1 ZINC000333232161 1034508707 /nfs/dbraw/zinc/50/87/07/1034508707.db2.gz CGSBVPUSCNMMOZ-OFLPRAFFSA-N 2 0 341.524 4.355 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000333272943 1034575111 /nfs/dbraw/zinc/57/51/11/1034575111.db2.gz KUXZVRLSFPOMMK-OAGGEKHMSA-N 2 0 345.487 4.186 20 0 EIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2)sc1Br ZINC000576465963 1034619351 /nfs/dbraw/zinc/61/93/51/1034619351.db2.gz PKKICDYUQDVISQ-NSHDSACASA-N 2 0 339.302 4.129 20 0 EIADRP Cc1ccc(C[N@@H+]2CCCC3(CC[NH+]([C@H]4C[C@H]5C[C@H]5C4)CC3)C2)cc1 ZINC001167941591 1034809051 /nfs/dbraw/zinc/80/90/51/1034809051.db2.gz QKTNVACZNILHEQ-ZBYYUNFXSA-N 2 0 338.539 4.472 20 0 EIADRP C[C@H](c1ccc(F)c(F)c1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501070252 1035368262 /nfs/dbraw/zinc/36/82/62/1035368262.db2.gz SDWTYXJEDBOMFJ-OAHLLOKOSA-N 2 0 345.437 4.269 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)CC1 ZINC000501476017 1035452919 /nfs/dbraw/zinc/45/29/19/1035452919.db2.gz UDEKJNIWDGWMHY-IFMALSPDSA-N 2 0 343.559 4.456 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000420328280 1035532565 /nfs/dbraw/zinc/53/25/65/1035532565.db2.gz ZVTDIVMAVVLURT-JKSUJKDBSA-N 2 0 329.513 4.111 20 0 EIADRP C[C@H](c1ccc2ccccc2c1)[NH+]1CCC([C@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000420383848 1035560871 /nfs/dbraw/zinc/56/08/71/1035560871.db2.gz FWFZXRZVOGUHEE-URZJWIJPSA-N 2 0 338.495 4.119 20 0 EIADRP FC(F)(F)c1cccc([C@@H]([NH2+]CC[C@H]2CCC[NH2+]C2)C2CC2)c1 ZINC000420402603 1035575336 /nfs/dbraw/zinc/57/53/36/1035575336.db2.gz KBQZNWLYRALYCT-DYVFJYSZSA-N 2 0 326.406 4.136 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000501777471 1035583796 /nfs/dbraw/zinc/58/37/96/1035583796.db2.gz UMPGJFBIDUXUNS-UHFFFAOYSA-N 2 0 339.321 4.003 20 0 EIADRP CC(C)=CCC[C@H](C)CC[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000668440055 1035728454 /nfs/dbraw/zinc/72/84/54/1035728454.db2.gz HZPIJBYNNXCVFB-IBGZPJMESA-N 2 0 336.564 4.240 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc3sccc3c2)[C@@H](C)C1 ZINC000575222287 1035730506 /nfs/dbraw/zinc/73/05/06/1035730506.db2.gz ZMWVFJIJQRIMIX-LPHOPBHVSA-N 2 0 346.540 4.128 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cc2ccncc2s1 ZINC000658353280 1035737551 /nfs/dbraw/zinc/73/75/51/1035737551.db2.gz KNFQGYLTLVKVNX-AWEZNQCLSA-N 2 0 329.513 4.069 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)CC3 ZINC000491043097 1035793293 /nfs/dbraw/zinc/79/32/93/1035793293.db2.gz YZIYFYSDOWEDAL-MSOLQXFVSA-N 2 0 339.527 4.044 20 0 EIADRP c1ccc(OCCC[N@@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000491057664 1035798375 /nfs/dbraw/zinc/79/83/75/1035798375.db2.gz FBNYDSHTQQGEBX-FQEVSTJZSA-N 2 0 330.516 4.044 20 0 EIADRP Cc1cc[nH+]c(NC2CC[NH+](CCC(F)(F)F)CC2)c1C1CC1 ZINC000668512005 1036006026 /nfs/dbraw/zinc/00/60/26/1036006026.db2.gz IOTXVOBUJCPURC-UHFFFAOYSA-N 2 0 327.394 4.096 20 0 EIADRP CC(C)[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1F ZINC000668517368 1036048456 /nfs/dbraw/zinc/04/84/56/1036048456.db2.gz YRDFKRJAKBWTFK-HXUWFJFHSA-N 2 0 327.447 4.176 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C[C@H]2CCCC(F)(F)C2)CC1 ZINC000502317417 1036072886 /nfs/dbraw/zinc/07/28/86/1036072886.db2.gz NCGMIHLFXBBAIJ-RYRKJORJSA-N 2 0 328.491 4.445 20 0 EIADRP Nc1ccc2cc(-c3ccc(C[NH+]4CCC([NH3+])CC4)cc3)ccc2c1 ZINC000906192215 1036138671 /nfs/dbraw/zinc/13/86/71/1036138671.db2.gz CQVDJWQBHLDNME-UHFFFAOYSA-N 2 0 331.463 4.012 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000502420482 1036204130 /nfs/dbraw/zinc/20/41/30/1036204130.db2.gz YNLNPXISQLMMLZ-YJMBLLCNSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCCC(F)(F)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000502511879 1036273071 /nfs/dbraw/zinc/27/30/71/1036273071.db2.gz VAAXEDHSRBNMKX-HOTGVXAUSA-N 2 0 340.458 4.103 20 0 EIADRP FC(F)C1CC[NH+](CCCCC[NH+]2CCC(C(F)F)CC2)CC1 ZINC000486115647 1036485010 /nfs/dbraw/zinc/48/50/10/1036485010.db2.gz AGESLJJHPRCPFX-UHFFFAOYSA-N 2 0 338.433 4.111 20 0 EIADRP c1nc2cc(C[NH2+]Cc3ccccc3C[NH+]3CCCCCC3)ccc2[nH]1 ZINC000602908853 1036660726 /nfs/dbraw/zinc/66/07/26/1036660726.db2.gz CBWZQVRUDQTGNU-UHFFFAOYSA-N 2 0 348.494 4.229 20 0 EIADRP C[C@H]([NH2+]C/C=C\c1ccc(F)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486472922 1036722808 /nfs/dbraw/zinc/72/28/08/1036722808.db2.gz DPKARZYRVMHYLF-KWBXCNMKSA-N 2 0 338.470 4.339 20 0 EIADRP CC(C)[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000613258911 1036811541 /nfs/dbraw/zinc/81/15/41/1036811541.db2.gz PIVJHXCCELJWNO-NRFANRHFSA-N 2 0 344.474 4.253 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cc3ccc(F)cc3[nH]2)c1 ZINC000486699032 1036820699 /nfs/dbraw/zinc/82/06/99/1036820699.db2.gz WCOUPBKLLJCZBZ-UHFFFAOYSA-N 2 0 339.458 4.437 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1CC12CCSCC2 ZINC000421869867 1036838821 /nfs/dbraw/zinc/83/88/21/1036838821.db2.gz DYFYOEIPJOPGHU-HOJAQTOUSA-N 2 0 344.568 4.020 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H]1CC12CCSCC2 ZINC000421869868 1036840301 /nfs/dbraw/zinc/84/03/01/1036840301.db2.gz DYFYOEIPJOPGHU-MISYRCLQSA-N 2 0 344.568 4.020 20 0 EIADRP CSCC[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000589726733 1036871691 /nfs/dbraw/zinc/87/16/91/1036871691.db2.gz MPUYJPMKHWGQGQ-IBGZPJMESA-N 2 0 338.536 4.332 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2c(F)cccc2Cl)C1 ZINC000589837211 1036880356 /nfs/dbraw/zinc/88/03/56/1036880356.db2.gz LPDHIDUHXQWPSJ-GASCZTMLSA-N 2 0 326.887 4.327 20 0 EIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CC3CCC(F)(F)CC3)CC2)C1 ZINC000503053484 1036889629 /nfs/dbraw/zinc/88/96/29/1036889629.db2.gz VCACOMPIALAVEO-YJBOKZPZSA-N 2 0 328.491 4.445 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]C/C=C\c2ccncc2)C1 ZINC000486935521 1036907058 /nfs/dbraw/zinc/90/70/58/1036907058.db2.gz JKOJRLHJEKUGPQ-BQHGXPCASA-N 2 0 335.495 4.117 20 0 EIADRP C[NH+](C)CC1CC[NH+](CCCOc2ccc(C(C)(C)C)cc2)CC1 ZINC000590125959 1036981529 /nfs/dbraw/zinc/98/15/29/1036981529.db2.gz YDHPKVAQABFISJ-UHFFFAOYSA-N 2 0 332.532 4.027 20 0 EIADRP C(=C/c1ccccc1)\C[NH+]1CCN(c2cc[nH+]c3ccccc32)CC1 ZINC000599435369 1037013200 /nfs/dbraw/zinc/01/32/00/1037013200.db2.gz OOXVVPARYVYMMO-RMKNXTFCSA-N 2 0 329.447 4.070 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311088388 1037082408 /nfs/dbraw/zinc/08/24/08/1037082408.db2.gz NJNYOPFCJYHFPH-DBXWQHBBSA-N 2 0 340.486 4.257 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)nc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272265920 1037148326 /nfs/dbraw/zinc/14/83/26/1037148326.db2.gz AKVPTBQQKHUFBX-FRQCXROJSA-N 2 0 343.902 4.296 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](CC2CCCC2)CC1)[C@@H]1C[C@H]1c1cccs1 ZINC000669418428 1037572047 /nfs/dbraw/zinc/57/20/47/1037572047.db2.gz XMICPRCWBUUDIR-ZYSHUDEJSA-N 2 0 332.557 4.484 20 0 EIADRP c1ccc2cc(OCC[NH+]3CCC(C[NH+]4CCCC4)CC3)ccc2c1 ZINC000488423749 1037576403 /nfs/dbraw/zinc/57/64/03/1037576403.db2.gz YHJNOBZNWBMWON-UHFFFAOYSA-N 2 0 338.495 4.026 20 0 EIADRP C[C@@H]1C[C@@H]1C[NH2+]C[C@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000488415365 1037584916 /nfs/dbraw/zinc/58/49/16/1037584916.db2.gz AMULRZHPYCSPRT-IIVZCXTMSA-N 2 0 340.433 4.334 20 0 EIADRP CC[N@@H+]1CCC[C@H](C[NH2+]C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000573596136 1037596187 /nfs/dbraw/zinc/59/61/87/1037596187.db2.gz CXUZOHUXCCXLCQ-XBNGYDHASA-N 2 0 340.433 4.430 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC(C)(C)c1ccc(Cl)cc1 ZINC000422734212 1037809455 /nfs/dbraw/zinc/80/94/55/1037809455.db2.gz SJCJTKZTEVKKAC-CYBMUJFWSA-N 2 0 331.891 4.131 20 0 EIADRP c1ccc2c(c1)cccc2CSCC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000592468523 1037817622 /nfs/dbraw/zinc/81/76/22/1037817622.db2.gz BCCNLYCVSSMECD-YSIASYRMSA-N 2 0 340.536 4.051 20 0 EIADRP CCc1ccc([C@H]([NH2+][C@H](C)c2ccc(C[NH3+])nc2C)C(C)C)cc1 ZINC000422759574 1037820949 /nfs/dbraw/zinc/82/09/49/1037820949.db2.gz FPXNKDCIYIGWQN-IIBYNOLFSA-N 2 0 325.500 4.459 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C1CCC(C[NH3+])CC1 ZINC000422746405 1037823464 /nfs/dbraw/zinc/82/34/64/1037823464.db2.gz WKFISOISTIQTLJ-MKQDKFQKSA-N 2 0 347.503 4.426 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](Cc1ccccc1)c1ccccc1 ZINC000422773959 1037830799 /nfs/dbraw/zinc/83/07/99/1037830799.db2.gz ZLXBJHIPXYZSQE-MBSDFSHPSA-N 2 0 345.490 4.483 20 0 EIADRP C[C@H]([NH2+]CC1(c2cccc(C(F)(F)F)c2)CCCCC1)C1C[NH2+]C1 ZINC000422778716 1037833290 /nfs/dbraw/zinc/83/32/90/1037833290.db2.gz DWNVKWFCUGZZDD-AWEZNQCLSA-N 2 0 340.433 4.105 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)cc2)cs1 ZINC000422800880 1037835935 /nfs/dbraw/zinc/83/59/35/1037835935.db2.gz DEEOVPKAKPBSHK-FACVHXDRSA-N 2 0 327.497 4.052 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c(C)s1 ZINC000422808552 1037838210 /nfs/dbraw/zinc/83/82/10/1037838210.db2.gz OJLLKCGUGLPRQZ-QMIHWGKISA-N 2 0 342.508 4.271 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1ccc(Br)cc1 ZINC000422789894 1037839392 /nfs/dbraw/zinc/83/93/92/1037839392.db2.gz XCZAVJYORMPLGE-VXGBXAGGSA-N 2 0 348.288 4.023 20 0 EIADRP [NH3+][C@H]1C[C@H](NCc2ccc(C[NH+]3CCCCCC3)cc2)c2ccccc21 ZINC000422792885 1037839722 /nfs/dbraw/zinc/83/97/22/1037839722.db2.gz ZYSCPOHCGXBQJG-GOTSBHOMSA-N 2 0 349.522 4.297 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(Br)cc1 ZINC000422789888 1037840673 /nfs/dbraw/zinc/84/06/73/1037840673.db2.gz XCZAVJYORMPLGE-NWDGAFQWSA-N 2 0 348.288 4.023 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1C ZINC000422792021 1037840687 /nfs/dbraw/zinc/84/06/87/1037840687.db2.gz ZABIKJFVKNZBET-RBDMOPTHSA-N 2 0 336.479 4.210 20 0 EIADRP [NH3+][C@H]1C[C@@H](NCc2cccc(C[NH+]3CCCCCC3)c2)c2ccccc21 ZINC000422823500 1037842207 /nfs/dbraw/zinc/84/22/07/1037842207.db2.gz DKRCEIXNCKDGRW-XZOQPEGZSA-N 2 0 349.522 4.297 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@H](C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)C1 ZINC000422853089 1037846323 /nfs/dbraw/zinc/84/63/23/1037846323.db2.gz RVZUYMBYJUVYRR-BQJWPVKWSA-N 2 0 332.454 4.256 20 0 EIADRP Cc1ccc(-c2nc(CC[NH2+][C@H](C)C[C@@H]3CCCCC[NH2+]3)co2)cc1 ZINC000422878866 1037852892 /nfs/dbraw/zinc/85/28/92/1037852892.db2.gz LAEPUEYQLWSYIX-MJGOQNOKSA-N 2 0 341.499 4.093 20 0 EIADRP CC[NH+](CC)[C@H](CN[C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1)c1ccsc1 ZINC000422868786 1037855762 /nfs/dbraw/zinc/85/57/62/1037855762.db2.gz WAUGUVVCDYFZMO-VNTMZGSJSA-N 2 0 349.588 4.031 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CN[C@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000422874198 1037859375 /nfs/dbraw/zinc/85/93/75/1037859375.db2.gz CGFMFZGQGORYSN-VSDWSMLSSA-N 2 0 349.522 4.153 20 0 EIADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1cccc2ccccc21 ZINC000422902439 1037862918 /nfs/dbraw/zinc/86/29/18/1037862918.db2.gz DDWXNGVEVSZUDS-NFBKMPQASA-N 2 0 348.490 4.273 20 0 EIADRP c1sc(CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)nc1C1CCCCC1 ZINC000422914467 1037868632 /nfs/dbraw/zinc/86/86/32/1037868632.db2.gz UHXUVEMTMONYPW-KURKYZTESA-N 2 0 347.572 4.244 20 0 EIADRP Clc1ccc(OCCCC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000422934253 1037873351 /nfs/dbraw/zinc/87/33/51/1037873351.db2.gz JKBQQDVULYJUHJ-OTWHNJEPSA-N 2 0 336.907 4.009 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccc(Br)cc1)C1CCC1 ZINC000422935784 1037876118 /nfs/dbraw/zinc/87/61/18/1037876118.db2.gz DRBVASUXYUDQRJ-BLLLJJGKSA-N 2 0 325.294 4.007 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000422963742 1037880523 /nfs/dbraw/zinc/88/05/23/1037880523.db2.gz GUGCPJLJPLKWTI-SFHVURJKSA-N 3 0 339.527 4.022 20 0 EIADRP CC[C@@H](C[N@H+](Cc1ccccn1)[C@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000414706130 1037887979 /nfs/dbraw/zinc/88/79/79/1037887979.db2.gz AABSGHUCWCBEAR-UGKGYDQZSA-N 2 0 337.511 4.220 20 0 EIADRP CCC(C)(C)c1ccc(C[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)cc1 ZINC000423001885 1037897357 /nfs/dbraw/zinc/89/73/57/1037897357.db2.gz ITSWDRABASBDKH-HNNXBMFYSA-N 2 0 325.500 4.387 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)Cc1ccc(C(C)C)cc1 ZINC000423023355 1037906073 /nfs/dbraw/zinc/90/60/73/1037906073.db2.gz JQFXIDNPUIWJBM-HZPDHXFCSA-N 2 0 325.500 4.254 20 0 EIADRP CC(C)c1cccc(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000423050403 1037912392 /nfs/dbraw/zinc/91/23/92/1037912392.db2.gz LDUURPAKVMHHGF-RBBKRZOGSA-N 2 0 336.479 4.156 20 0 EIADRP Cc1cccc(C)c1[C@H](C)[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423041195 1037918473 /nfs/dbraw/zinc/91/84/73/1037918473.db2.gz WJSURXSWENLTEE-KPLVRAHFSA-N 2 0 336.479 4.210 20 0 EIADRP Cc1cccc(C)c1[C@H](C)[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423041194 1037921147 /nfs/dbraw/zinc/92/11/47/1037921147.db2.gz WJSURXSWENLTEE-JLMWRMLUSA-N 2 0 336.479 4.210 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC1(Cc2ccccc2)CCCC1 ZINC000423041300 1037921750 /nfs/dbraw/zinc/92/17/50/1037921750.db2.gz IQKMGNLQVHBJLD-QGZVFWFLSA-N 2 0 337.511 4.302 20 0 EIADRP CC[C@@H]([NH2+][C@H](C)CCCC[NH3+])c1cc(F)cc(Br)c1 ZINC000423059823 1037929590 /nfs/dbraw/zinc/92/95/90/1037929590.db2.gz GUHMCVQZXKDHRQ-IAQYHMDHSA-N 2 0 331.273 4.146 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cc2ccccc2o1 ZINC000423060287 1037928608 /nfs/dbraw/zinc/92/86/08/1037928608.db2.gz NZUULJMBPZZYBU-LDJQZATESA-N 2 0 348.446 4.339 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1cc2cccc(F)c2o1 ZINC000423074979 1037936214 /nfs/dbraw/zinc/93/62/14/1037936214.db2.gz VVJBTQXSRMLKSK-WCQYABFASA-N 2 0 327.403 4.146 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)C1(c2ccccc2)CCCC1 ZINC000423050781 1037938924 /nfs/dbraw/zinc/93/89/24/1037938924.db2.gz MAUOOPCMMYSTRD-WMZOPIPTSA-N 2 0 337.511 4.400 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@H](Cc1ccccc1)C(C)C ZINC000423076651 1037940225 /nfs/dbraw/zinc/94/02/25/1037940225.db2.gz ZPWIFXYKNHDVQF-APWZRJJASA-N 2 0 325.500 4.014 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1CC(F)(c2cccc(Cl)c2)C1 ZINC000423097014 1037959180 /nfs/dbraw/zinc/95/91/80/1037959180.db2.gz QJNHEDXUPGNJPC-LJSZUPLFSA-N 2 0 347.865 4.180 20 0 EIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc(OCc2ccccc2)c1 ZINC000423075808 1037963768 /nfs/dbraw/zinc/96/37/68/1037963768.db2.gz PITRYDAEBQQZHV-ZEDDUWKQSA-N 2 0 336.479 4.199 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](c1ccc(F)c(Cl)c1)C1CC1 ZINC000423152418 1038002650 /nfs/dbraw/zinc/00/26/50/1038002650.db2.gz DZJKQPQIASUSLD-BLVKFPJESA-N 2 0 347.865 4.443 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](Cc1ccccc1)c1nc2ccccc2s1 ZINC000423162331 1038019553 /nfs/dbraw/zinc/01/95/53/1038019553.db2.gz PCGKMOONBVANJQ-QAPCUYQASA-N 2 0 339.508 4.297 20 0 EIADRP Cc1cc([C@@H](Cc2ccccc2Cl)[NH2+]C2CC[NH2+]CC2)cs1 ZINC000423186397 1038020280 /nfs/dbraw/zinc/02/02/80/1038020280.db2.gz NYDDGOSWDLEVJW-GOSISDBHSA-N 2 0 334.916 4.335 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423209652 1038037616 /nfs/dbraw/zinc/03/76/16/1038037616.db2.gz JBSIBYPKCVVPDS-RDJZCZTQSA-N 2 0 341.524 4.085 20 0 EIADRP Cc1ccccc1COc1ccc([C@H](C)[NH2+]C2CCC([NH3+])CC2)cc1 ZINC000423211841 1038042708 /nfs/dbraw/zinc/04/27/08/1038042708.db2.gz HKKUJFRMFKUCFD-RPCJCACASA-N 2 0 338.495 4.495 20 0 EIADRP C[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1ccc(SCC(F)F)cc1 ZINC000423262850 1038072217 /nfs/dbraw/zinc/07/22/17/1038072217.db2.gz WHSYHDCPENRJCJ-KGLIPLIRSA-N 2 0 328.472 4.084 20 0 EIADRP Fc1ccc([C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2ccccc2Cl)cc1 ZINC000423248553 1038079406 /nfs/dbraw/zinc/07/94/06/1038079406.db2.gz NIDLYUCAVUZDIU-LIRRHRJNSA-N 2 0 332.850 4.158 20 0 EIADRP Fc1ccc([C@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2ccc(Cl)cc2)cc1 ZINC000423247922 1038080885 /nfs/dbraw/zinc/08/08/85/1038080885.db2.gz MFCPOLOIOWTMRF-AUUYWEPGSA-N 2 0 332.850 4.158 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]CC[C@H]2CC[NH2+]C2)CCC3)cc1 ZINC000423253826 1038083837 /nfs/dbraw/zinc/08/38/37/1038083837.db2.gz WLMCILFWXQIBMY-NVXWUHKLSA-N 2 0 341.524 4.085 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423257442 1038085873 /nfs/dbraw/zinc/08/58/73/1038085873.db2.gz JKCRYWZIPAHXKD-DZGCQCFKSA-N 2 0 347.503 4.298 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)cc1 ZINC000423288930 1038092895 /nfs/dbraw/zinc/09/28/95/1038092895.db2.gz AAUDJRCGKOJMEP-FZKQIMNGSA-N 2 0 330.859 4.363 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+]C(C)(C)c2cccc(Cl)c2)cc1 ZINC000606471026 1038094979 /nfs/dbraw/zinc/09/49/79/1038094979.db2.gz MZIUHRWNFOSSKD-UHFFFAOYSA-N 2 0 346.902 4.305 20 0 EIADRP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c1 ZINC000423293581 1038098373 /nfs/dbraw/zinc/09/83/73/1038098373.db2.gz RTAQIMVERCVJSK-ZIAGYGMSSA-N 2 0 334.410 4.467 20 0 EIADRP CC1(C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)CC[NH2+]CC1 ZINC000423317438 1038113475 /nfs/dbraw/zinc/11/34/75/1038113475.db2.gz BKDDWERTXCOQKY-MRXNPFEDSA-N 2 0 341.524 4.167 20 0 EIADRP [NH3+]C1(C[NH2+][C@H]2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)CCC1 ZINC000423322350 1038119185 /nfs/dbraw/zinc/11/91/85/1038119185.db2.gz IHMYGHNJFFLNRU-CVEARBPZSA-N 2 0 326.406 4.203 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(OC(F)(F)F)cc2)cc1 ZINC000423296591 1038121343 /nfs/dbraw/zinc/12/13/43/1038121343.db2.gz ZMBLLRLHJWGMQU-STQMWFEESA-N 2 0 338.373 4.456 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(OC(F)(F)F)cc2)cc1 ZINC000423296589 1038123435 /nfs/dbraw/zinc/12/34/35/1038123435.db2.gz ZMBLLRLHJWGMQU-OLZOCXBDSA-N 2 0 338.373 4.456 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]C[C@@]2(C)CCC[NH2+]C2)cc1 ZINC000423336459 1038150348 /nfs/dbraw/zinc/15/03/48/1038150348.db2.gz STVRZSRQUZCXEM-VGSWGCGISA-N 2 0 338.495 4.403 20 0 EIADRP COc1ccccc1[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)C1CCCC1 ZINC000423373552 1038156175 /nfs/dbraw/zinc/15/61/75/1038156175.db2.gz HRFYEBNQLPZAQV-JOCHJYFZSA-N 2 0 336.479 4.320 20 0 EIADRP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423370907 1038157502 /nfs/dbraw/zinc/15/75/02/1038157502.db2.gz GAKKDUHJNHQIKE-ZDUSSCGKSA-N 2 0 330.859 4.193 20 0 EIADRP Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+]CC[C@H]1CCC[NH2+]1)CCC2 ZINC000423358314 1038167363 /nfs/dbraw/zinc/16/73/63/1038167363.db2.gz JIUGKSGEZWARGV-CJNGLKHVSA-N 2 0 345.487 4.058 20 0 EIADRP Clc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CCS2 ZINC000423363658 1038178557 /nfs/dbraw/zinc/17/85/57/1038178557.db2.gz AEKWDMRWQRSHDF-QGZVFWFLSA-N 2 0 330.884 4.270 20 0 EIADRP C[C@H]1C[NH2+]CC[C@H]1[NH2+]C1CCC(c2cccc(C(F)(F)F)c2)CC1 ZINC000423406514 1038215163 /nfs/dbraw/zinc/21/51/63/1038215163.db2.gz UTIVOXCIPPJCER-VDEYCQILSA-N 2 0 340.433 4.319 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423445361 1038226367 /nfs/dbraw/zinc/22/63/67/1038226367.db2.gz RVJKJCBOISHZML-JEBQAFNWSA-N 2 0 341.524 4.157 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000423457771 1038240183 /nfs/dbraw/zinc/24/01/83/1038240183.db2.gz PNCYADIDMGDWJS-RXVVDRJESA-N 3 0 349.538 4.096 20 0 EIADRP CCC[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccccn1 ZINC000423461441 1038240273 /nfs/dbraw/zinc/24/02/73/1038240273.db2.gz CNCNLTSYOATUAM-DFQSSKMNSA-N 2 0 341.474 4.045 20 0 EIADRP CCC[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cccnc1 ZINC000423462319 1038242277 /nfs/dbraw/zinc/24/22/77/1038242277.db2.gz DNOPPJFXOHBZJU-TYPHKJRUSA-N 2 0 341.474 4.045 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]C(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000423464761 1038242349 /nfs/dbraw/zinc/24/23/49/1038242349.db2.gz HFQWHTSXVXCUEI-AUUYWEPGSA-N 2 0 330.422 4.161 20 0 EIADRP Cc1c([C@H](C)[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)cnn1-c1cccc(Cl)c1 ZINC000423462231 1038242518 /nfs/dbraw/zinc/24/25/18/1038242518.db2.gz DGKSLSKLYSFBCQ-QRTARXTBSA-N 2 0 346.906 4.002 20 0 EIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000423464702 1038242558 /nfs/dbraw/zinc/24/25/58/1038242558.db2.gz GYLSNCRNVYGWAP-CBQOVEMMSA-N 2 0 338.495 4.086 20 0 EIADRP Cc1c([C@H](C)[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)cnn1-c1cccc(Cl)c1 ZINC000423462230 1038243441 /nfs/dbraw/zinc/24/34/41/1038243441.db2.gz DGKSLSKLYSFBCQ-LXZKKBNFSA-N 2 0 346.906 4.002 20 0 EIADRP COc1ccc([C@H]([NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)c2ccc(F)cc2)cc1 ZINC000423465915 1038243585 /nfs/dbraw/zinc/24/35/85/1038243585.db2.gz ICDBOCSRTQANMA-NYSBEXSLSA-N 2 0 342.458 4.031 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423467215 1038245117 /nfs/dbraw/zinc/24/51/17/1038245117.db2.gz BIAHKUZYPOHTHJ-DZGCQCFKSA-N 2 0 347.503 4.440 20 0 EIADRP Cc1cc(N)cc(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)c1 ZINC000423475747 1038246858 /nfs/dbraw/zinc/24/68/58/1038246858.db2.gz JKSHISHSMBQSDM-UHFFFAOYSA-N 2 0 331.548 4.346 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1cc(Cl)ccc1OC(F)F ZINC000423472794 1038247694 /nfs/dbraw/zinc/24/76/94/1038247694.db2.gz NHHJCJCIKPHKPY-GVXVVHGQSA-N 2 0 332.822 4.110 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1 ZINC000423478669 1038249785 /nfs/dbraw/zinc/24/97/85/1038249785.db2.gz UISICEJBQGENPA-CFLQYTFWSA-N 2 0 330.422 4.009 20 0 EIADRP CCc1nc2c(s1)[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)CCC2 ZINC000423500567 1038253756 /nfs/dbraw/zinc/25/37/56/1038253756.db2.gz KMCWPMXQVREISF-HOTGVXAUSA-N 2 0 329.513 4.153 20 0 EIADRP COc1ccc([C@H]([NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c2ccccc2Cl)cc1 ZINC000423502046 1038257671 /nfs/dbraw/zinc/25/76/71/1038257671.db2.gz JMFRYYKHUKJWOY-KKVAFCGZSA-N 2 0 344.886 4.155 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423487724 1038258971 /nfs/dbraw/zinc/25/89/71/1038258971.db2.gz UPKJNFGWKKPDTA-RHSMWYFYSA-N 2 0 328.422 4.148 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423486447 1038259912 /nfs/dbraw/zinc/25/99/12/1038259912.db2.gz STQODKMARJOLHZ-PBHICJAKSA-N 2 0 329.513 4.301 20 0 EIADRP Cc1c([C@@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)cnn1-c1cccc(Cl)c1 ZINC000423487323 1038261322 /nfs/dbraw/zinc/26/13/22/1038261322.db2.gz UBRZHVKBOOIRPN-RHSMWYFYSA-N 2 0 346.906 4.017 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000423489310 1038261370 /nfs/dbraw/zinc/26/13/70/1038261370.db2.gz FXFZOMLJXFDSNT-JLJPHGGASA-N 2 0 329.513 4.205 20 0 EIADRP c1c2ccccc2oc1[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cccnc1 ZINC000423491001 1038263865 /nfs/dbraw/zinc/26/38/65/1038263865.db2.gz YLLOWEYSGOLUGW-NQIIRXRSSA-N 2 0 335.451 4.039 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423492250 1038264281 /nfs/dbraw/zinc/26/42/81/1038264281.db2.gz MIQVJLMHJZBEMH-ZMSDIMECSA-N 2 0 328.431 4.396 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423493609 1038264592 /nfs/dbraw/zinc/26/45/92/1038264592.db2.gz QHJUENNMIPZETK-SGMGOOAPSA-N 2 0 332.435 4.119 20 0 EIADRP COc1ccc(Cl)cc1[C@H](C)[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423514006 1038270941 /nfs/dbraw/zinc/27/09/41/1038270941.db2.gz WCUSJERTUIECRU-KSSFIOAISA-N 2 0 332.875 4.479 20 0 EIADRP CSC[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1 ZINC000423535025 1038284782 /nfs/dbraw/zinc/28/47/82/1038284782.db2.gz BPLRSANRMQUDKJ-INIZCTEOSA-N 2 0 344.446 4.009 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423538694 1038285487 /nfs/dbraw/zinc/28/54/87/1038285487.db2.gz GVTWYVLFRCABNR-XDKFSHSGSA-N 2 0 341.524 4.157 20 0 EIADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(SCC(F)F)cc1 ZINC000423538173 1038286648 /nfs/dbraw/zinc/28/66/48/1038286648.db2.gz MBXPPFKFQBUWNA-CYBMUJFWSA-N 2 0 326.456 4.004 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(OC(F)(F)F)cc1 ZINC000423540968 1038286930 /nfs/dbraw/zinc/28/69/30/1038286930.db2.gz KGJGTGLRJWZPAV-ANQUJSFKSA-N 2 0 342.405 4.014 20 0 EIADRP FC(F)(F)c1cccc([C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)C2CC2)c1 ZINC000423545915 1038288211 /nfs/dbraw/zinc/28/82/11/1038288211.db2.gz PONJKLXSFNWGSM-CYGHRXIMSA-N 2 0 338.417 4.134 20 0 EIADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1cc2cc(Br)ccc2o1 ZINC000423541315 1038289170 /nfs/dbraw/zinc/28/91/70/1038289170.db2.gz RWHRISXFLSWYDR-LBPRGKRZSA-N 2 0 349.272 4.156 20 0 EIADRP FC(F)(F)c1cccc([C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)C2CC2)c1 ZINC000423545914 1038289699 /nfs/dbraw/zinc/28/96/99/1038289699.db2.gz PONJKLXSFNWGSM-CWLKWCNXSA-N 2 0 338.417 4.134 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423544561 1038289892 /nfs/dbraw/zinc/28/98/92/1038289892.db2.gz OLPDIWZYMLHIRJ-BRSBDYLESA-N 2 0 339.527 4.202 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1)c1ccc(F)cn1 ZINC000490123229 1038352161 /nfs/dbraw/zinc/35/21/61/1038352161.db2.gz AGLZZUVUAXUEJD-IBGZPJMESA-N 2 0 329.463 4.302 20 0 EIADRP CC[N@@H+]1CC[C@H](CN[C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000490167134 1038365732 /nfs/dbraw/zinc/36/57/32/1038365732.db2.gz FYARYIKMISZVGT-UZLBHIALSA-N 2 0 328.887 4.361 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(C[NH+](CC)CC)c1)c1ccc(F)cn1 ZINC000490190912 1038380260 /nfs/dbraw/zinc/38/02/60/1038380260.db2.gz NQBHMLZYXVXZTL-IBGZPJMESA-N 2 0 329.463 4.303 20 0 EIADRP c1coc([C@@H]2CC[NH+](CCCCC[N@@H+]3CC[C@@H](c4ccco4)C3)C2)c1 ZINC000607152484 1038395678 /nfs/dbraw/zinc/39/56/78/1038395678.db2.gz YNOXRAYMXQLHBM-RTBURBONSA-N 2 0 342.483 4.322 20 0 EIADRP C[NH+](C)CC1(C[NH2+][C@@H](Cc2ccncc2)c2cccs2)CCCC1 ZINC000424282535 1038789177 /nfs/dbraw/zinc/78/91/77/1038789177.db2.gz QGTKWHWOJGGDNA-SFHVURJKSA-N 2 0 343.540 4.139 20 0 EIADRP C[C@H](CC[NH2+][C@@H](Cc1ccncc1)c1cccs1)[NH+]1CCCCC1 ZINC000424279990 1038789706 /nfs/dbraw/zinc/78/97/06/1038789706.db2.gz LDFMJCRJYHBWOY-MJGOQNOKSA-N 2 0 343.540 4.281 20 0 EIADRP CCCc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)cc1 ZINC000539064136 1038791729 /nfs/dbraw/zinc/79/17/29/1038791729.db2.gz FTRFMCDBQVNANY-MTNREXPMSA-N 2 0 344.543 4.058 20 0 EIADRP c1ccc(CC[C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000480763303 1038803419 /nfs/dbraw/zinc/80/34/19/1038803419.db2.gz MJCOBARYOHFAJA-REWPJTCUSA-N 2 0 334.507 4.434 20 0 EIADRP CCN1CC[NH+](CCCC[NH2+][C@H](CC(C)C)c2ccccc2C)CC1 ZINC000480783082 1038805685 /nfs/dbraw/zinc/80/56/85/1038805685.db2.gz YNEGKIYWZAIORA-JOCHJYFZSA-N 2 0 345.575 4.090 20 0 EIADRP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000480772781 1038809722 /nfs/dbraw/zinc/80/97/22/1038809722.db2.gz GOTWPMAUYRBWQB-ZBFHGGJFSA-N 2 0 338.948 4.285 20 0 EIADRP CCc1ccc(CC[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cc1 ZINC001168317877 1038828712 /nfs/dbraw/zinc/82/87/12/1038828712.db2.gz UTFYZXADVGXGGA-UHFFFAOYSA-N 2 0 328.544 4.380 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000504926311 1038857587 /nfs/dbraw/zinc/85/75/87/1038857587.db2.gz HWNZODOSUZOXCJ-QXSJWSMHSA-N 2 0 340.433 4.414 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000539201328 1038878782 /nfs/dbraw/zinc/87/87/82/1038878782.db2.gz WTWIIUSWZHCSHY-KSSFIOAISA-N 2 0 340.433 4.478 20 0 EIADRP CC(C)[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc2[nH]c(=O)oc2c1 ZINC000539214309 1038885432 /nfs/dbraw/zinc/88/54/32/1038885432.db2.gz HOMNIUOWRUXXNS-GOSISDBHSA-N 2 0 345.487 4.083 20 0 EIADRP Fc1ccc([C@@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C2CC2)cc1 ZINC000539216872 1038886689 /nfs/dbraw/zinc/88/66/89/1038886689.db2.gz KWJSADUTGYFIFB-NRFANRHFSA-N 2 0 339.458 4.178 20 0 EIADRP C[NH+](C)C1CCC(n2cc(C3CC[NH2+]CC3)c3c2cccc3F)CC1 ZINC001168329225 1038965478 /nfs/dbraw/zinc/96/54/78/1038965478.db2.gz QRSZPMMIZFUQQZ-UHFFFAOYSA-N 2 0 343.490 4.293 20 0 EIADRP C[C@@H](Cc1ccccc1F)[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000481044560 1038979038 /nfs/dbraw/zinc/97/90/38/1038979038.db2.gz WDKGSIHUBXYCAM-IRXDYDNUSA-N 2 0 344.474 4.048 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)C1 ZINC000481037758 1038988954 /nfs/dbraw/zinc/98/89/54/1038988954.db2.gz MXZOEKCCSCVWBB-BLLLJJGKSA-N 2 0 327.299 4.302 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2c(Cl)cccc2N2CCCC2)cc1 ZINC000414808096 1039030458 /nfs/dbraw/zinc/03/04/58/1039030458.db2.gz KABGJBQYBCIRJS-OAHLLOKOSA-N 2 0 343.902 4.250 20 0 EIADRP c1ccc(CC(Cc2ccccc2)[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000378931085 1039040255 /nfs/dbraw/zinc/04/02/55/1039040255.db2.gz YIYROVRNYOVJIR-JTHBVZDNSA-N 2 0 334.507 4.057 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)CCc2ccc(OC(F)F)cc2)cc1 ZINC000414808716 1039041911 /nfs/dbraw/zinc/04/19/11/1039041911.db2.gz FSPKSFNGAAMMPY-LSDHHAIUSA-N 2 0 348.437 4.419 20 0 EIADRP CC[C@@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)C1CCOCC1 ZINC000552045320 1039065818 /nfs/dbraw/zinc/06/58/18/1039065818.db2.gz CYNOXBPYIUZFFU-LZBANZJXSA-N 2 0 344.543 4.224 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H](C)c2cccc(CC(C)C)c2)CC1 ZINC000552045126 1039067698 /nfs/dbraw/zinc/06/76/98/1039067698.db2.gz YVBYIPJEXDEHAD-GOSISDBHSA-N 2 0 332.532 4.037 20 0 EIADRP Cc1ccc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1Br ZINC000414815874 1039094831 /nfs/dbraw/zinc/09/48/31/1039094831.db2.gz YQFZQYJVIJEGPA-CYBMUJFWSA-N 2 0 333.273 4.067 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2ccc(-c3ccc(F)cc3)o2)C[C@H]1C ZINC000552070779 1039095572 /nfs/dbraw/zinc/09/55/72/1039095572.db2.gz DJZFMJRANKPBFA-QAPCUYQASA-N 2 0 330.447 4.390 20 0 EIADRP CCOc1c(Cl)cc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1OC ZINC000414816036 1039099472 /nfs/dbraw/zinc/09/94/72/1039099472.db2.gz YXOTVILUBCFHBI-ZDUSSCGKSA-N 2 0 348.874 4.057 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CC2(c3cccc(Cl)c3F)CCCC2)CC[N@@H+]1C ZINC000477864122 1039143409 /nfs/dbraw/zinc/14/34/09/1039143409.db2.gz ZUZJOOCGZVMZSM-GJZGRUSLSA-N 2 0 338.898 4.363 20 0 EIADRP Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cc1C ZINC000481293885 1039226081 /nfs/dbraw/zinc/22/60/81/1039226081.db2.gz INRSPQKCWKOKSC-IBGZPJMESA-N 2 0 340.511 4.403 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCc3c2cccc3OC)c1 ZINC000481295306 1039229171 /nfs/dbraw/zinc/22/91/71/1039229171.db2.gz OHYHUWXAXNYELX-OAQYLSRUSA-N 2 0 338.495 4.314 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000481298673 1039232896 /nfs/dbraw/zinc/23/28/96/1039232896.db2.gz INBDZTSAJOQWME-UWJYYQICSA-N 2 0 344.449 4.180 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)ccc1F ZINC000120965611 1039249432 /nfs/dbraw/zinc/24/94/32/1039249432.db2.gz YDOZZZKAWVGLNS-LJQANCHMSA-N 2 0 332.850 4.318 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000481322924 1039291401 /nfs/dbraw/zinc/29/14/01/1039291401.db2.gz NYEMHFXCEYJGSL-HZSPNIEDSA-N 2 0 345.314 4.081 20 0 EIADRP CCC[N@H+](C)C[C@H]1CC[NH+]([C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000478000691 1039294186 /nfs/dbraw/zinc/29/41/86/1039294186.db2.gz IQXGHXSNVQBBMJ-HUUCEWRRSA-N 2 0 328.422 4.430 20 0 EIADRP C[C@@H]([NH2+][C@H](C)[C@@H]1COc2ccccc21)c1ccc(-n2ccnc2)cc1 ZINC000090845073 1039308055 /nfs/dbraw/zinc/30/80/55/1039308055.db2.gz KAPKFWBBRXXMSH-QINHECLXSA-N 2 0 333.435 4.088 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+][C@H](C)[C@@H]2COc3ccccc32)cc1 ZINC000090845040 1039309990 /nfs/dbraw/zinc/30/99/90/1039309990.db2.gz NZYHVNFHVORNQK-ZOCZFRKYSA-N 2 0 347.462 4.396 20 0 EIADRP CC[C@H]([NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1)c1c(C)noc1C ZINC000090886817 1039317542 /nfs/dbraw/zinc/31/75/42/1039317542.db2.gz WAYLEPBLWRAWKC-KUHUBIRLSA-N 2 0 345.487 4.034 20 0 EIADRP C[C@@H]1C[C@@H](N(C)Cc2ccc(Cl)o2)CC[N@@H+]1Cc1ccccc1 ZINC000552256658 1039319386 /nfs/dbraw/zinc/31/93/86/1039319386.db2.gz WJTLDRFBMCGRFR-WBVHZDCISA-N 2 0 332.875 4.418 20 0 EIADRP CC[N@H+](C)Cc1cccc(CNCc2conc2Cc2ccccc2)c1 ZINC000555537800 1039354585 /nfs/dbraw/zinc/35/45/85/1039354585.db2.gz XPZZLROWZPEVTE-UHFFFAOYSA-N 2 0 349.478 4.007 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](C[C@H](OC)c2ccc(Cl)cc2)CC1 ZINC000513960616 1039399315 /nfs/dbraw/zinc/39/93/15/1039399315.db2.gz LISDIAJOKGVZJU-IBGZPJMESA-N 2 0 338.923 4.081 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)c1ccc2n[nH]cc2c1 ZINC000552338649 1039404970 /nfs/dbraw/zinc/40/49/70/1039404970.db2.gz LCBYTTIECYXVNT-GUXCAODWSA-N 2 0 340.515 4.257 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2ccc(SC)c(OC)c2)CC1 ZINC000121779785 1039418408 /nfs/dbraw/zinc/41/84/08/1039418408.db2.gz HBHNBNVXTPRXLA-HNNXBMFYSA-N 2 0 336.545 4.190 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](CCOC)c2ccccc2)CC1 ZINC000534543247 1039536766 /nfs/dbraw/zinc/53/67/66/1039536766.db2.gz NZLCBUBJJYPDOB-NRFANRHFSA-N 2 0 332.532 4.208 20 0 EIADRP CCOCCCC[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000514103473 1039609218 /nfs/dbraw/zinc/60/92/18/1039609218.db2.gz CIONWXYZOWWFHF-YPAWHYETSA-N 2 0 344.543 4.084 20 0 EIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccc(Cl)c(Cl)c3)C2)CC1 ZINC000555801183 1039640737 /nfs/dbraw/zinc/64/07/37/1039640737.db2.gz LNHNTRLMLQUUQK-OAHLLOKOSA-N 2 0 327.299 4.157 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(CC)s2)[C@@H](C)C1 ZINC000122343852 1039656216 /nfs/dbraw/zinc/65/62/16/1039656216.db2.gz VJBVKJMUFCTYPB-JZXOWHBKSA-N 2 0 338.561 4.098 20 0 EIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000481669493 1039707252 /nfs/dbraw/zinc/70/72/52/1039707252.db2.gz KDMHJYXILWLHCI-VNQPRFMTSA-N 2 0 328.422 4.099 20 0 EIADRP COc1ccc2oc(C[NH2+]CCCC[NH+]3CCC(C)CC3)cc2c1 ZINC000478370474 1039716619 /nfs/dbraw/zinc/71/66/19/1039716619.db2.gz MCUFFMHRYOZTFK-UHFFFAOYSA-N 2 0 330.472 4.043 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cc(C)c1O ZINC000552635020 1039718866 /nfs/dbraw/zinc/71/88/66/1039718866.db2.gz VISIOLFNAYJYBM-UHFFFAOYSA-N 2 0 338.495 4.285 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2ccccc2OC(F)F)CC1 ZINC000122705347 1039781956 /nfs/dbraw/zinc/78/19/56/1039781956.db2.gz TUXFTWRFQQZCPI-AWEZNQCLSA-N 2 0 326.431 4.061 20 0 EIADRP COc1ccc(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c2ccccc12 ZINC000537646993 1039801124 /nfs/dbraw/zinc/80/11/24/1039801124.db2.gz GJHORJCAEXESPP-GOSISDBHSA-N 2 0 338.495 4.156 20 0 EIADRP COC[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1cccc(Cl)c1F ZINC000550881862 1039810318 /nfs/dbraw/zinc/81/03/18/1039810318.db2.gz DYJPDGUHWZODOV-QGZVFWFLSA-N 2 0 342.886 4.022 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1cn2ccccc2n1 ZINC000550886675 1039810991 /nfs/dbraw/zinc/81/09/91/1039810991.db2.gz PYVGPWOGZDNTKS-SFHVURJKSA-N 2 0 348.494 4.171 20 0 EIADRP COc1cc(C[NH+]2CCC(CCC[NH+](C)C)CC2)ccc1OC(C)C ZINC000537648873 1039826911 /nfs/dbraw/zinc/82/69/11/1039826911.db2.gz WTJRQQVXZLYPJF-UHFFFAOYSA-N 2 0 348.531 4.036 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccccc1OCc1ccccc1 ZINC000481951771 1039908252 /nfs/dbraw/zinc/90/82/52/1039908252.db2.gz HJUZBFNJBXVUPW-SFHVURJKSA-N 2 0 326.484 4.258 20 0 EIADRP CN(C)c1ccccc1C[NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000567851431 1039928088 /nfs/dbraw/zinc/92/80/88/1039928088.db2.gz HQAAAEPWXSJPKA-NRFANRHFSA-N 2 0 349.522 4.039 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1c(F)cccc1F ZINC000505585206 1039967949 /nfs/dbraw/zinc/96/79/49/1039967949.db2.gz DNEZGWHGDLHKGS-UHFFFAOYSA-N 2 0 345.437 4.098 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@H]2CCC(F)(F)C2)CC1 ZINC000551093862 1039976177 /nfs/dbraw/zinc/97/61/77/1039976177.db2.gz USDSVXNNNIXPEE-IBGZPJMESA-N 2 0 336.470 4.266 20 0 EIADRP C[NH+](C)CC1CC[NH+](CCCc2c(Cl)cccc2Cl)CC1 ZINC000482067491 1039995385 /nfs/dbraw/zinc/99/53/85/1039995385.db2.gz JERXOCZZOLXBKB-UHFFFAOYSA-N 2 0 329.315 4.200 20 0 EIADRP CNc1ccc(C[N@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000712114654 1040026416 /nfs/dbraw/zinc/02/64/16/1040026416.db2.gz IPIIAJYNWFCCJP-UHFFFAOYSA-N 2 0 337.511 4.072 20 0 EIADRP CC(C)=CCC[C@H](C)CC[NH+]1CCN(CC[N@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000482141708 1040049517 /nfs/dbraw/zinc/04/95/17/1040049517.db2.gz KXFSMXPDTQZBGV-FDFHNCONSA-N 2 0 349.607 4.249 20 0 EIADRP CC(C)=CCC[C@H](C)CC[NH+]1CCN(CC[NH+]2[C@H](C)CC[C@H]2C)CC1 ZINC000482141707 1040050262 /nfs/dbraw/zinc/05/02/62/1040050262.db2.gz KXFSMXPDTQZBGV-BHDDXSALSA-N 2 0 349.607 4.249 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)C1 ZINC000482355200 1040196079 /nfs/dbraw/zinc/19/60/79/1040196079.db2.gz FKRXCVUQOCIMEU-LSDHHAIUSA-N 2 0 344.421 4.356 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH3+])c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000315019117 1040237626 /nfs/dbraw/zinc/23/76/26/1040237626.db2.gz VKPAPNFUKZLLQS-SECBINFHSA-N 2 0 328.300 4.114 20 0 EIADRP Cc1cccc2c1CC[C@H]2[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000482455385 1040265047 /nfs/dbraw/zinc/26/50/47/1040265047.db2.gz YMTMZFLTWBKIGT-NFBKMPQASA-N 2 0 334.507 4.137 20 0 EIADRP Cc1cccc2c1CC[C@H]2[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000482455386 1040265863 /nfs/dbraw/zinc/26/58/63/1040265863.db2.gz YMTMZFLTWBKIGT-NZQKXSOJSA-N 2 0 334.507 4.137 20 0 EIADRP C[C@H](C[N@@H+]1CCC[C@H]2C[NH+](C)CC[C@H]21)c1ccc(C(F)(F)F)cc1 ZINC000514890644 1040328677 /nfs/dbraw/zinc/32/86/77/1040328677.db2.gz KVYNOJCNKJXPKN-UWWQBHOKSA-N 2 0 340.433 4.225 20 0 EIADRP CCCOc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C)CC2)c(OCCC)c1 ZINC000482545275 1040344205 /nfs/dbraw/zinc/34/42/05/1040344205.db2.gz XBFKZGLOEJRNAG-QGZVFWFLSA-N 2 0 348.531 4.257 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cccc(Br)c2C)C[C@@H]1C ZINC000535585295 1040387820 /nfs/dbraw/zinc/38/78/20/1040387820.db2.gz LMYGJAYGHLZJDU-XJKSGUPXSA-N 2 0 339.321 4.062 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000666995161 1040407657 /nfs/dbraw/zinc/40/76/57/1040407657.db2.gz FABOVAMCWQDFGN-JBACZVJFSA-N 2 0 342.527 4.374 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+]C/C(C)=C\c2ccccc2OC(F)F)C1 ZINC000515020059 1040419861 /nfs/dbraw/zinc/41/98/61/1040419861.db2.gz MSXKPCDSPVCMGH-UVQBRAAOSA-N 2 0 338.442 4.013 20 0 EIADRP c1ccc(COc2ccccc2CN[C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000666999577 1040439345 /nfs/dbraw/zinc/43/93/45/1040439345.db2.gz ZPLDODNPTQOHRN-FQEVSTJZSA-N 2 0 336.479 4.030 20 0 EIADRP CC(C)CC[NH+]1CCC([NH2+]C[C@H]2CCCO[C@H]2c2ccccc2)CC1 ZINC000924781862 1040542421 /nfs/dbraw/zinc/54/24/21/1040542421.db2.gz KKGQBNAUADSOPB-IRLDBZIGSA-N 2 0 344.543 4.254 20 0 EIADRP CC(C)CC[NH+]1CCC([NH2+]C[C@@H]2CCCO[C@@H]2c2ccccc2)CC1 ZINC000924781864 1040547862 /nfs/dbraw/zinc/54/78/62/1040547862.db2.gz KKGQBNAUADSOPB-RBBKRZOGSA-N 2 0 344.543 4.254 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000551788673 1040601558 /nfs/dbraw/zinc/60/15/58/1040601558.db2.gz DYZLQAPHTAIMRQ-DLBZAZTESA-N 2 0 328.422 4.273 20 0 EIADRP C[C@H](c1cccc2ccccc21)[NH+]1CCC([C@@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000515342938 1040677182 /nfs/dbraw/zinc/67/71/82/1040677182.db2.gz MWOKYXVAGWWNTI-WVBUVRCRSA-N 2 0 338.495 4.119 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(CC)cc2)[C@@H](C)C1 ZINC000479876917 1040738933 /nfs/dbraw/zinc/73/89/33/1040738933.db2.gz VJCIZYFQVPBEGG-WFXMLNOXSA-N 2 0 332.532 4.037 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC000479878153 1040739547 /nfs/dbraw/zinc/73/95/47/1040739547.db2.gz ZMESQPRHZXTOPX-CYBMUJFWSA-N 2 0 349.519 4.496 20 0 EIADRP COc1cc(C)c([C@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)cc1OC ZINC000483186474 1040762752 /nfs/dbraw/zinc/76/27/52/1040762752.db2.gz UWQQKGYNCZKONE-HNAYVOBHSA-N 2 0 336.520 4.029 20 0 EIADRP Cc1cc(NC2CC[NH+](Cc3ccc(F)cc3)CC2)c2ccccc2[nH+]1 ZINC000515501784 1040807535 /nfs/dbraw/zinc/80/75/35/1040807535.db2.gz JUJGGUGLSBVCRQ-UHFFFAOYSA-N 2 0 349.453 4.181 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cnc(-c3ccc(C)cc3)s2)[C@H](C)C1 ZINC000539835706 1040829618 /nfs/dbraw/zinc/82/96/18/1040829618.db2.gz PAMZFRRVIUKVTQ-VQIMIIECSA-N 2 0 343.540 4.281 20 0 EIADRP Cc1ncsc1CN(C[C@@H]1CC[NH2+]C1)[C@H](C)c1cccc(Cl)c1 ZINC000436045941 1040837527 /nfs/dbraw/zinc/83/75/27/1040837527.db2.gz AAZMLIUXAPEVHS-HUUCEWRRSA-N 2 0 349.931 4.278 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC(N[C@H]2CCCc3c(O)cccc32)CC1 ZINC000483432001 1040856132 /nfs/dbraw/zinc/85/61/32/1040856132.db2.gz FWASCXAQGRWKJI-TYCQWZJGSA-N 2 0 342.527 4.402 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC(N[C@@H]2CCCc3c(O)cccc32)CC1 ZINC000483431998 1040856394 /nfs/dbraw/zinc/85/63/94/1040856394.db2.gz FWASCXAQGRWKJI-HBGVWJBISA-N 2 0 342.527 4.402 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](CCCOc3cccc4ccccc43)CC[C@H]21 ZINC000483485345 1040875614 /nfs/dbraw/zinc/87/56/14/1040875614.db2.gz RQPXRQZARCKAHI-TZIWHRDSSA-N 2 0 338.495 4.025 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](CCCSc3ccccc3Cl)CC[C@H]21 ZINC000483504615 1040877097 /nfs/dbraw/zinc/87/70/97/1040877097.db2.gz RVVJURMMKKTPKA-DOTOQJQBSA-N 2 0 338.948 4.238 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C[C@@H](C)N2CCC[C@H](C)C2)C1 ZINC000467341015 1040902374 /nfs/dbraw/zinc/90/23/74/1040902374.db2.gz BJNMISQDZKNWBF-NBYUQASBSA-N 2 0 329.532 4.126 20 0 EIADRP COc1cc(C)cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000537952087 1040920811 /nfs/dbraw/zinc/92/08/11/1040920811.db2.gz PJKBCEQAMVFONV-XMSQKQJNSA-N 2 0 338.495 4.004 20 0 EIADRP C[C@H]([NH2+]CC1C[C@H]2CC[C@@H](C1)S2)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000903160614 1040929581 /nfs/dbraw/zinc/92/95/81/1040929581.db2.gz RZMHVBILXVLOSN-PVCSLBTHSA-N 2 0 344.568 4.161 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@H]3C)cc2)cc1 ZINC000537988485 1040964380 /nfs/dbraw/zinc/96/43/80/1040964380.db2.gz VGGQQABYWYUOLS-DRSNIGMVSA-N 2 0 338.495 4.181 20 0 EIADRP Fc1ccc(CC2(C[NH2+]C3CC[NH+](C4CCCC4)CC3)CC2)cc1 ZINC000539969691 1040969832 /nfs/dbraw/zinc/96/98/32/1040969832.db2.gz RLVDHHGHJKFLNV-UHFFFAOYSA-N 2 0 330.491 4.145 20 0 EIADRP CCOc1ccc([C@@H](C)[NH2+]CCC2CC[NH+](CC)CC2)cc1OCC ZINC000483713151 1040970593 /nfs/dbraw/zinc/97/05/93/1040970593.db2.gz NSNWZHKEEANLJF-QGZVFWFLSA-N 2 0 348.531 4.257 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@H]3CC[C@@H](c4ccccc4)C3)C2)cc1 ZINC000436241146 1040991771 /nfs/dbraw/zinc/99/17/71/1040991771.db2.gz QNCYICSGDBNDEB-JRFVFWCSSA-N 2 0 348.534 4.477 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2cc3c(cccc3F)[nH]2)C1 ZINC000436277035 1041023714 /nfs/dbraw/zinc/02/37/14/1041023714.db2.gz VXSUHGGWGIORDW-IYBDPMFKSA-N 2 0 331.479 4.155 20 0 EIADRP CCO[C@H]1C[C@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C12CCCC2 ZINC000483841132 1041040316 /nfs/dbraw/zinc/04/03/16/1041040316.db2.gz VWMCBVHQELTRHW-PMACEKPBSA-N 2 0 334.548 4.111 20 0 EIADRP C[C@@H](CCCC(F)(F)F)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000480179669 1041045011 /nfs/dbraw/zinc/04/50/11/1041045011.db2.gz KWTYVCAOSSDLTN-AWEZNQCLSA-N 2 0 329.410 4.009 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)CC(C)(C)c2c[nH]c3ccccc32)C1 ZINC000462889311 1041051186 /nfs/dbraw/zinc/05/11/86/1041051186.db2.gz SJINKFOZHFMYAK-SJORKVTESA-N 2 0 327.516 4.156 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC1 ZINC000436295689 1041061459 /nfs/dbraw/zinc/06/14/59/1041061459.db2.gz QCSMTWWGDJYMIW-RZDIXWSQSA-N 2 0 340.433 4.414 20 0 EIADRP c1ccc(C[C@@H]2CC[C@@H]([NH2+]C3CC[NH+](C4CCCC4)CC3)C2)cc1 ZINC000436299783 1041068291 /nfs/dbraw/zinc/06/82/91/1041068291.db2.gz HKHPKHDORIPZHP-PZJWPPBQSA-N 2 0 326.528 4.394 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000436306044 1041077200 /nfs/dbraw/zinc/07/72/00/1041077200.db2.gz NTILICQRBKONJP-VVMVDLBUSA-N 2 0 340.433 4.270 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1ccc(OCC(F)(F)F)cc1 ZINC000538163079 1041107302 /nfs/dbraw/zinc/10/73/02/1041107302.db2.gz PVHRFOXCJHKESP-HOCLYGCPSA-N 2 0 344.421 4.153 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CCc2ccc(Oc3ccc(F)cc3)cc2)CC[N@@H+]1C ZINC000540140581 1041162136 /nfs/dbraw/zinc/16/21/36/1041162136.db2.gz PCYQAEVBTZYWLR-QFBILLFUSA-N 2 0 342.458 4.233 20 0 EIADRP C[C@H](CCc1ccco1)[NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000540141004 1041162227 /nfs/dbraw/zinc/16/22/27/1041162227.db2.gz VIKRDUYHGRUDGB-SBHAEUEKSA-N 2 0 340.511 4.491 20 0 EIADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000540143050 1041164164 /nfs/dbraw/zinc/16/41/64/1041164164.db2.gz BZAPHNCSVUFNDJ-VGSWGCGISA-N 2 0 338.495 4.274 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCOC3(CCCC3)C2)CC1 ZINC000540159929 1041189322 /nfs/dbraw/zinc/18/93/22/1041189322.db2.gz CNGIIIIRNUJOFB-HOJAQTOUSA-N 2 0 334.548 4.111 20 0 EIADRP C[C@H](CCCC(F)(F)F)[NH2+]CCCN1CCc2ccccc2C1 ZINC000480333959 1041219808 /nfs/dbraw/zinc/21/98/08/1041219808.db2.gz MIVRAKADUOYMCP-OAHLLOKOSA-N 2 0 328.422 4.146 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)cc1OCC ZINC000484469888 1041249658 /nfs/dbraw/zinc/24/96/58/1041249658.db2.gz FPPONKIHJMIQTJ-SZMVWBNQSA-N 2 0 334.504 4.007 20 0 EIADRP COc1cccc2c1CC[C@@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000484486598 1041257498 /nfs/dbraw/zinc/25/74/98/1041257498.db2.gz CATBJLQJFNHLKW-FQEVSTJZSA-N 2 0 328.500 4.069 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1cccc(OC(F)(F)F)c1 ZINC000484475481 1041269289 /nfs/dbraw/zinc/26/92/89/1041269289.db2.gz RRWSQYWEZSECIN-NWANDNLSSA-N 2 0 330.394 4.109 20 0 EIADRP CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc[nH+]c2ccccc21 ZINC000463063518 1041300119 /nfs/dbraw/zinc/30/01/19/1041300119.db2.gz HKFFKWKMAXEEHE-LJQANCHMSA-N 2 0 331.463 4.193 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccc(Oc2ccc(F)cc2)cc1 ZINC000480445708 1041305119 /nfs/dbraw/zinc/30/51/19/1041305119.db2.gz OMUYKTOXCRVFEZ-FOIQADDNSA-N 2 0 328.431 4.048 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000463141466 1041374287 /nfs/dbraw/zinc/37/42/87/1041374287.db2.gz ZDONDTLABANVOK-TUNNFDKTSA-N 2 0 345.575 4.140 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)c(OC)c1 ZINC000480608405 1041419956 /nfs/dbraw/zinc/41/99/56/1041419956.db2.gz KUTNPWBQVZABKY-IRXDYDNUSA-N 2 0 334.504 4.009 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cc(F)c(F)c(F)c1 ZINC000480606329 1041431210 /nfs/dbraw/zinc/43/12/10/1041431210.db2.gz DDHUWCMPJAZXFO-KBPBESRZSA-N 2 0 328.422 4.267 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccccc1OC(F)F ZINC000480617296 1041433753 /nfs/dbraw/zinc/43/37/53/1041433753.db2.gz VKKPXXWLJXRPND-INIZCTEOSA-N 2 0 340.458 4.451 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CC[C@H](c2ccccc2)C[C@@H]1C ZINC000467554508 1041434017 /nfs/dbraw/zinc/43/40/17/1041434017.db2.gz OHSINPYAQIJJAL-PXNSSMCTSA-N 2 0 346.478 4.344 20 0 EIADRP Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000924668093 1041439579 /nfs/dbraw/zinc/43/95/79/1041439579.db2.gz OIPCMYGZFPIQCS-JKSUJKDBSA-N 2 0 341.499 4.374 20 0 EIADRP C[C@@H]([NH2+]CC1(C[NH2+][C@H](C)C2CCCCC2)COC1)C1CCCCC1 ZINC000554842243 1041442290 /nfs/dbraw/zinc/44/22/90/1041442290.db2.gz KFOZMRBJVRSQOC-QZTJIDSGSA-N 2 0 336.564 4.120 20 0 EIADRP CCc1nc2c(s1)[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)CCC2 ZINC000480635084 1041448267 /nfs/dbraw/zinc/44/82/67/1041448267.db2.gz VNQCFUSMPGBVKH-JKSUJKDBSA-N 2 0 335.561 4.327 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(C(C)C)c2)[C@@H](C)C1 ZINC000480674041 1041465522 /nfs/dbraw/zinc/46/55/22/1041465522.db2.gz WPLMDACGDOAROX-GHTZIAJQSA-N 2 0 332.532 4.037 20 0 EIADRP C[C@@H]1CCC[C@H]([NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)[C@H]1C ZINC000540467220 1041472943 /nfs/dbraw/zinc/47/29/43/1041472943.db2.gz DTIWEAGNBNALIW-LCLWPZTBSA-N 2 0 342.527 4.389 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2)cc1 ZINC000480738063 1041499239 /nfs/dbraw/zinc/49/92/39/1041499239.db2.gz PUASIIQRUKAHSA-KRWDZBQOSA-N 2 0 344.474 4.397 20 0 EIADRP C[C@H]1C[NH+](CCCCC[N@@H+]2CCC(F)(F)[C@@H](C)C2)CCC1(F)F ZINC000554946421 1041506696 /nfs/dbraw/zinc/50/66/96/1041506696.db2.gz SPUVNLAKEKBEGA-GJZGRUSLSA-N 2 0 338.433 4.111 20 0 EIADRP COc1ccc2cc(C[N@@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)ccc2c1 ZINC000538749722 1041523946 /nfs/dbraw/zinc/52/39/46/1041523946.db2.gz CEHOXUUDVVJLNO-IBGZPJMESA-N 2 0 338.495 4.156 20 0 EIADRP COc1ccc2cc(C[N@@H+]3CC[C@H](C[NH+]4CCCCC4)C3)ccc2c1 ZINC000538749723 1041525362 /nfs/dbraw/zinc/52/53/62/1041525362.db2.gz CEHOXUUDVVJLNO-LJQANCHMSA-N 2 0 338.495 4.156 20 0 EIADRP CCC[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000540605223 1041558782 /nfs/dbraw/zinc/55/87/82/1041558782.db2.gz FTTIYBUNGYFKOT-QGZVFWFLSA-N 2 0 326.406 4.398 20 0 EIADRP CC[N@@H+]1CC[C@H](Nc2ccc(C[NH+]3CCCC[C@H]3C)cc2)[C@H](C)C1 ZINC000540699433 1041614168 /nfs/dbraw/zinc/61/41/68/1041614168.db2.gz FDEHMQRWLSYIBQ-OPYAIIAOSA-N 2 0 329.532 4.203 20 0 EIADRP CSCc1cccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000437091464 1041639177 /nfs/dbraw/zinc/63/91/77/1041639177.db2.gz YLNHWONMCKNGBO-UHFFFAOYSA-N 2 0 332.557 4.436 20 0 EIADRP C[C@H]([NH2+]CCc1ccc(F)cc1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000516802129 1041763303 /nfs/dbraw/zinc/76/33/03/1041763303.db2.gz LSPNPISOOLLEDR-LPHOPBHVSA-N 2 0 344.449 4.008 20 0 EIADRP CSC1(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CCC1 ZINC000516822415 1041774284 /nfs/dbraw/zinc/77/42/84/1041774284.db2.gz RHMOIXYPNLBTRD-HKUYNNGSSA-N 2 0 332.557 4.162 20 0 EIADRP CC(C)(C)[C@H]1CCC[NH+]1CC1(C[N@H+]2CCC[C@@H]2C(C)(C)C)COC1 ZINC000541071929 1041798129 /nfs/dbraw/zinc/79/81/29/1041798129.db2.gz RDLDVISRDQIQPI-QZTJIDSGSA-N 2 0 336.564 4.024 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc3nc(C)ccc3c2)CC1 ZINC000437584077 1041851757 /nfs/dbraw/zinc/85/17/57/1041851757.db2.gz QSUZGROLVLAKLX-UHFFFAOYSA-N 2 0 325.500 4.097 20 0 EIADRP Cn1ccnc1C[C@@H]1CCC[N@@H+]([C@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000437791854 1041912358 /nfs/dbraw/zinc/91/23/58/1041912358.db2.gz HTYPVOCBVOQNKU-VCOUNFBDSA-N 2 0 337.511 4.185 20 0 EIADRP Clc1cccc([C@H](Cc2cccnc2)[NH2+]CCC[NH+]2CCCC2)c1 ZINC000425911727 1041928743 /nfs/dbraw/zinc/92/87/43/1041928743.db2.gz BQSXLJFRWQLNNZ-FQEVSTJZSA-N 2 0 343.902 4.094 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@H](c2ccco2)c2ccccc2)C1 ZINC000541549257 1042007224 /nfs/dbraw/zinc/00/72/24/1042007224.db2.gz PWOUUFIZYRXYQX-RXVVDRJESA-N 2 0 326.484 4.471 20 0 EIADRP C[C@]1(c2ccccc2)CC[C@H]([N@@H+]2CC[C@H]3[C@@H](CCCN3C3CC3)C2)C1 ZINC000438119944 1042061874 /nfs/dbraw/zinc/06/18/74/1042061874.db2.gz LAFTUKSKZIACIF-QGQQZZQASA-N 2 0 338.539 4.446 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccsc1 ZINC000509443741 1042065845 /nfs/dbraw/zinc/06/58/45/1042065845.db2.gz GEWSBRKFGSIKHK-INIZCTEOSA-N 2 0 330.497 4.074 20 0 EIADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CCCSc2ccccc2Cl)C1 ZINC000464774792 1042157092 /nfs/dbraw/zinc/15/70/92/1042157092.db2.gz IVXWGEAQVWFTLR-INIZCTEOSA-N 2 0 340.964 4.486 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC000303232995 1042374137 /nfs/dbraw/zinc/37/41/37/1042374137.db2.gz ZEUKJVFRXAUCMD-UHFFFAOYSA-N 2 0 344.449 4.309 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+]Cc2ccc3c(c2)CCCC3)ccc1F ZINC000491359215 1042432520 /nfs/dbraw/zinc/43/25/20/1042432520.db2.gz JUHOJOFFLRJBAP-UHFFFAOYSA-N 2 0 326.459 4.056 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCCOc2ccc(F)cc2)C1 ZINC000303603347 1042483615 /nfs/dbraw/zinc/48/36/15/1042483615.db2.gz NYEWPCQBRHPXPM-MOPGFXCFSA-N 2 0 348.506 4.181 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCc3ccc(C)cc32)[C@H](C)C1 ZINC000426289005 1042514053 /nfs/dbraw/zinc/51/40/53/1042514053.db2.gz FJHMJMMQTCHPLV-BVYCBKJFSA-N 2 0 344.543 4.099 20 0 EIADRP CSc1ccc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1 ZINC000173329643 1042565575 /nfs/dbraw/zinc/56/55/75/1042565575.db2.gz FKUICXMXWLSOQH-MRXNPFEDSA-N 2 0 344.524 4.200 20 0 EIADRP [NH3+]CCCc1cn(C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c2ccccc12 ZINC001167964637 1042658302 /nfs/dbraw/zinc/65/83/02/1042658302.db2.gz VFKGOSRUGKVZHF-YOFSQIOKSA-N 2 0 337.511 4.111 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C[C@@H](C)C[NH+]2CCCCC2)C1 ZINC000467388695 1042716208 /nfs/dbraw/zinc/71/62/08/1042716208.db2.gz IFNWEZXRBMULOV-RLLQIKCJSA-N 2 0 329.532 4.128 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](c1ccccc1)c1ccc(C)cc1 ZINC000493075093 1042811271 /nfs/dbraw/zinc/81/12/71/1042811271.db2.gz BIOFOMOEGYKOMV-FCHUYYIVSA-N 2 0 340.511 4.031 20 0 EIADRP CCCOc1ccc([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1 ZINC000177733997 1042847264 /nfs/dbraw/zinc/84/72/64/1042847264.db2.gz BMVFKWDFUQMXDR-QGZVFWFLSA-N 2 0 326.484 4.388 20 0 EIADRP COc1ccc(C)cc1[C@@H](C)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310970374 1042849654 /nfs/dbraw/zinc/84/96/54/1042849654.db2.gz DDQQVYWGAWSCGW-UYAOXDASSA-N 2 0 338.495 4.176 20 0 EIADRP FC1(F)CCC[C@H](C[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]23)C1 ZINC000311007384 1042850341 /nfs/dbraw/zinc/85/03/41/1042850341.db2.gz WOYAWOMPCPZDHJ-MTQWCTHYSA-N 2 0 348.481 4.312 20 0 EIADRP C[C@H]([NH2+]Cc1cccc2cc[nH]c21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311064199 1042851453 /nfs/dbraw/zinc/85/14/53/1042851453.db2.gz JCQRFOBBWYZVPE-LAUBAEHRSA-N 2 0 333.479 4.168 20 0 EIADRP COc1ccccc1C[N@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001203438046 1042944860 /nfs/dbraw/zinc/94/48/60/1042944860.db2.gz PNCKMWZSVSNMBB-UHFFFAOYSA-N 2 0 338.495 4.039 20 0 EIADRP COC[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000493882619 1042971500 /nfs/dbraw/zinc/97/15/00/1042971500.db2.gz JOXROKYMEUDERV-APWZRJJASA-N 2 0 338.923 4.129 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2cc(Br)cs2)CC1 ZINC000493967184 1042993656 /nfs/dbraw/zinc/99/36/56/1042993656.db2.gz FMAIERUABYBGRG-GFCCVEGCSA-N 2 0 345.350 4.283 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)ccc1F ZINC000183191785 1043039157 /nfs/dbraw/zinc/03/91/57/1043039157.db2.gz YGYSTDJZWHMUBS-YQQAZPJKSA-N 2 0 334.479 4.138 20 0 EIADRP CCc1nc(C)c([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)s1 ZINC000183196280 1043039615 /nfs/dbraw/zinc/03/96/15/1043039615.db2.gz PUNVBVCRHVONDB-IJEWVQPXSA-N 2 0 335.561 4.318 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2cscc2Br)C1 ZINC000512147702 1043086723 /nfs/dbraw/zinc/08/67/23/1043086723.db2.gz UZVIILDFZOJLNQ-ZDUSSCGKSA-N 2 0 345.350 4.112 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000310336180 1043126283 /nfs/dbraw/zinc/12/62/83/1043126283.db2.gz BJYGGLMQZQMTDZ-HKUYNNGSSA-N 2 0 326.459 4.389 20 0 EIADRP CCSc1cccc(C[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c1 ZINC000185471071 1043187853 /nfs/dbraw/zinc/18/78/53/1043187853.db2.gz HIIROJSOLXROJC-UHFFFAOYSA-N 2 0 344.524 4.029 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657965810 1043222600 /nfs/dbraw/zinc/22/26/00/1043222600.db2.gz BOBQZHSXLJZENT-JENIJYKNSA-N 2 0 349.478 4.389 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1cnc2ccccc2c1 ZINC000727466077 1043227365 /nfs/dbraw/zinc/22/73/65/1043227365.db2.gz SSTRSSOXSPGDGG-UHFFFAOYSA-N 2 0 333.479 4.365 20 0 EIADRP c1cc2cccc(C[NH2+]C3CC[NH+](CC4CCCCC4)CC3)c2[nH]1 ZINC000727469482 1043228210 /nfs/dbraw/zinc/22/82/10/1043228210.db2.gz XKRKBNXGDVVBLW-UHFFFAOYSA-N 2 0 325.500 4.302 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2sccc2OC)c1 ZINC000186114455 1043245800 /nfs/dbraw/zinc/24/58/00/1043245800.db2.gz BGKNTSXVYSBXAI-OAHLLOKOSA-N 2 0 332.513 4.449 20 0 EIADRP COc1cccc2cc(C[NH2+]CCCC[NH+]3C[C@@H](C)C[C@H](C)C3)oc21 ZINC000727643567 1043254592 /nfs/dbraw/zinc/25/45/92/1043254592.db2.gz BNHXCXDIECWQRZ-IRXDYDNUSA-N 2 0 344.499 4.289 20 0 EIADRP FC(F)(F)c1ccc(CCC[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)cc1 ZINC000674005749 1043271343 /nfs/dbraw/zinc/27/13/43/1043271343.db2.gz NJLABTQLIJHLML-QGZVFWFLSA-N 2 0 340.433 4.056 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccnn2-c2ccccc2)c1 ZINC000281344586 1043276532 /nfs/dbraw/zinc/27/65/32/1043276532.db2.gz UXWNVOMZYGNKGA-GOSISDBHSA-N 2 0 348.494 4.175 20 0 EIADRP COc1ccc(C[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC001168010946 1043298853 /nfs/dbraw/zinc/29/88/53/1043298853.db2.gz LOTJLHBZHXKZEK-QZTJIDSGSA-N 2 0 338.495 4.226 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)s2)cc1 ZINC000166764918 1043311021 /nfs/dbraw/zinc/31/10/21/1043311021.db2.gz WPTKUWCJBCUTSK-DLBZAZTESA-N 2 0 342.508 4.140 20 0 EIADRP Clc1ccc(CCC[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c(Cl)c1 ZINC000166760936 1043312103 /nfs/dbraw/zinc/31/21/03/1043312103.db2.gz OKKRLZUSIDPCHE-JKSUJKDBSA-N 2 0 327.299 4.142 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccc(Oc2cccnc2)cc1 ZINC000672806879 1043407565 /nfs/dbraw/zinc/40/75/65/1043407565.db2.gz YYTCGYYMFVTPKK-SJORKVTESA-N 2 0 339.483 4.255 20 0 EIADRP CCC[NH+](CCC)CCN[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168012232 1043428870 /nfs/dbraw/zinc/42/88/70/1043428870.db2.gz YKOURBMASGIMTP-VTYHHJSWSA-N 2 0 345.575 4.140 20 0 EIADRP CC[C@H]1C[N@H+](CCCCn2ccnc2C)CC[C@@H]1c1ccccc1 ZINC000442394522 1043669730 /nfs/dbraw/zinc/66/97/30/1043669730.db2.gz SHOSLCGPXOTZGE-FPOVZHCZSA-N 2 0 325.500 4.487 20 0 EIADRP C[C@H](CC[NH2+][C@@H]1CCCC[C@H]1[C@@H]1CCOC1)[N@H+](C)Cc1ccccc1 ZINC000474035178 1043698329 /nfs/dbraw/zinc/69/83/29/1043698329.db2.gz OWLPQOXPLDYQJO-PSWRPDDJSA-N 2 0 344.543 4.082 20 0 EIADRP Cc1c([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cnn1C(C)(C)C ZINC000191178231 1043789797 /nfs/dbraw/zinc/78/97/97/1043789797.db2.gz QVAHCMPZCNMFOT-DLBZAZTESA-N 2 0 334.552 4.252 20 0 EIADRP c1ccc2c(c1)[nH]c1c2C[C@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)C1 ZINC000442708576 1043814150 /nfs/dbraw/zinc/81/41/50/1043814150.db2.gz JPXIKLSCAWVXHH-IBGZPJMESA-N 2 0 345.490 4.021 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)CCS2 ZINC000191489082 1043820457 /nfs/dbraw/zinc/82/04/57/1043820457.db2.gz KZYACZMUTPCHEK-LJQANCHMSA-N 2 0 342.508 4.084 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](CCCOC)c2ccc(F)cc2)CC1 ZINC000442769341 1043837751 /nfs/dbraw/zinc/83/77/51/1043837751.db2.gz PWYIWOYSBRVDMQ-FQEVSTJZSA-N 2 0 336.495 4.005 20 0 EIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3ccc4[nH]ccc4c3)CC2)C1 ZINC000442796130 1043842636 /nfs/dbraw/zinc/84/26/36/1043842636.db2.gz FSNUNKJFDWQNQO-UWJYYQICSA-N 2 0 339.527 4.343 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2ccc3[nH]ccc3c2)CC1 ZINC000442811727 1043851808 /nfs/dbraw/zinc/85/18/08/1043851808.db2.gz PHIGMUBRCVUVIN-VGOFRKELSA-N 2 0 339.527 4.343 20 0 EIADRP CS[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)C(C)(C)C ZINC000542499934 1044227769 /nfs/dbraw/zinc/22/77/69/1044227769.db2.gz RTNWSLRFRBTEIY-NZSAHSFTSA-N 2 0 334.573 4.264 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)CC1 ZINC000193991493 1044233645 /nfs/dbraw/zinc/23/36/45/1044233645.db2.gz KBBLWJURQYUCNX-OAHLLOKOSA-N 2 0 342.449 4.489 20 0 EIADRP CCC[NH+]1CCC([N@H+](C)Cc2ccc(C(F)(F)F)cc2C)CC1 ZINC000443416717 1044265889 /nfs/dbraw/zinc/26/58/89/1044265889.db2.gz OADAYWIJKSCESM-UHFFFAOYSA-N 2 0 328.422 4.320 20 0 EIADRP CCC[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccsc1 ZINC000191207895 1044278561 /nfs/dbraw/zinc/27/85/61/1044278561.db2.gz MFOAXVQKAOGAOT-LJQANCHMSA-N 2 0 332.513 4.320 20 0 EIADRP CCCCOCCC[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168016925 1044285337 /nfs/dbraw/zinc/28/53/37/1044285337.db2.gz WJBFZLJRFFXOEE-OALUTQOASA-N 2 0 332.532 4.224 20 0 EIADRP Brc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](C3CCC3)CC1)CC2 ZINC000282612102 1044347233 /nfs/dbraw/zinc/34/72/33/1044347233.db2.gz LAWQJWYYSNKTSH-GOSISDBHSA-N 2 0 349.316 4.043 20 0 EIADRP CCn1c2ccccc2c2cc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H](C)C3)ccc21 ZINC000327016911 1044404474 /nfs/dbraw/zinc/40/44/74/1044404474.db2.gz HMJOJOWVVUOPHZ-FUHWJXTLSA-N 2 0 335.495 4.387 20 0 EIADRP C[C@H]([NH2+][C@@H](c1cccs1)c1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC000675732680 1044450556 /nfs/dbraw/zinc/45/05/56/1044450556.db2.gz DJANSWWUFZUNJK-IFXJQAMLSA-N 2 0 332.488 4.297 20 0 EIADRP C[C@@H]([NH2+]CCOc1ccccc1-c1ccccc1)C1CC[NH+](C)CC1 ZINC000675777346 1044490711 /nfs/dbraw/zinc/49/07/11/1044490711.db2.gz CLSBHOHFRAJJDE-GOSISDBHSA-N 2 0 338.495 4.052 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000675784417 1044495929 /nfs/dbraw/zinc/49/59/29/1044495929.db2.gz GGEQGGKWPMOTML-AWEZNQCLSA-N 2 0 328.422 4.100 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+]CCc2c[nH]c3cc(Cl)ccc23)CC1 ZINC000675787964 1044499480 /nfs/dbraw/zinc/49/94/80/1044499480.db2.gz RSPFDOCEMUOSQG-UHFFFAOYSA-N 2 0 333.907 4.216 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H]2CCCC[C@@H]2c2ccc(OC)c(F)c2)CC1 ZINC000675818722 1044515476 /nfs/dbraw/zinc/51/54/76/1044515476.db2.gz IPAUVTJYKUKGNT-QUCCMNQESA-N 2 0 348.506 4.182 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]CC2CC[NH+](CC)CC2)cc1OC ZINC000675819126 1044517224 /nfs/dbraw/zinc/51/72/24/1044517224.db2.gz SVAFIPYDSUDTPZ-KRWDZBQOSA-N 2 0 348.531 4.257 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2cccc(Oc3ccccn3)c2)CC1 ZINC000922317492 1044522115 /nfs/dbraw/zinc/52/21/15/1044522115.db2.gz FXCSZHQYLLTRMJ-UHFFFAOYSA-N 2 0 339.483 4.226 20 0 EIADRP COc1ccc(C2CCC([NH2+]CC3(C)CC[NH+](C)CC3)CC2)cc1 ZINC000543415042 1044551178 /nfs/dbraw/zinc/55/11/78/1044551178.db2.gz GPABDHYNVCEGBA-UHFFFAOYSA-N 2 0 330.516 4.043 20 0 EIADRP C[C@H](CC[NH2+][C@H](C)c1ccc(OC(F)F)cc1)[NH+]1CCCCC1 ZINC000543417863 1044559941 /nfs/dbraw/zinc/55/99/41/1044559941.db2.gz FZHYGVRDAUYLEX-HUUCEWRRSA-N 2 0 326.431 4.203 20 0 EIADRP C[C@H]([NH2+]CCCc1ccc(Cl)cc1Cl)C1CC[NH+](C)CC1 ZINC000675926645 1044568722 /nfs/dbraw/zinc/56/87/22/1044568722.db2.gz VGRJZSDCIDBKRK-ZDUSSCGKSA-N 2 0 329.315 4.246 20 0 EIADRP CCC[NH+]1CCC([NH2+]CCCc2ccc(Cl)cc2Cl)CC1 ZINC000675926067 1044570253 /nfs/dbraw/zinc/57/02/53/1044570253.db2.gz IPPWJDFWKBITPC-UHFFFAOYSA-N 2 0 329.315 4.390 20 0 EIADRP COc1cccc(-c2ccc(C[NH2+][C@@H](C)C3CC[NH+](C)CC3)cc2)c1 ZINC000675904088 1044573342 /nfs/dbraw/zinc/57/33/42/1044573342.db2.gz OMPRTQAFXAHQGH-KRWDZBQOSA-N 2 0 338.495 4.182 20 0 EIADRP C[C@@H]([NH2+]C[C@H](Cc1ccccc1)c1ccccc1)C1CC[NH+](C)CC1 ZINC000675928068 1044583631 /nfs/dbraw/zinc/58/36/31/1044583631.db2.gz QUTIDUFFNRMXEG-XXBNENTESA-N 2 0 336.523 4.333 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[NH2+]C1CC[NH+](C[C@@H]2CC=CCC2)CC1 ZINC001168476305 1044627933 /nfs/dbraw/zinc/62/79/33/1044627933.db2.gz SUHQPJAXWBOSHS-QZTJIDSGSA-N 2 0 330.491 4.167 20 0 EIADRP Cc1ccccc1OCCC[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000543461462 1044652025 /nfs/dbraw/zinc/65/20/25/1044652025.db2.gz GYLWTVOGIWUTRG-MOPGFXCFSA-N 2 0 330.516 4.007 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CCc2ccc(C(C)C)cc21 ZINC000495145246 1044719683 /nfs/dbraw/zinc/71/96/83/1044719683.db2.gz FHMFFUPJDIMIMF-JOCHJYFZSA-N 2 0 346.478 4.476 20 0 EIADRP CC1([NH+]2CCCC2)CCC([NH2+]Cc2cnc(C3CCC3)s2)CC1 ZINC000922503188 1044787430 /nfs/dbraw/zinc/78/74/30/1044787430.db2.gz HSXFOFRNSXZCSK-UHFFFAOYSA-N 2 0 333.545 4.297 20 0 EIADRP C[NH+](C)CC(C)(C)C[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000495255853 1044831860 /nfs/dbraw/zinc/83/18/60/1044831860.db2.gz QTQRKUDYEHQKSJ-IBGZPJMESA-N 2 0 345.918 4.196 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CC2CCSCC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168031865 1044840958 /nfs/dbraw/zinc/84/09/58/1044840958.db2.gz CUFIIVQLSNCDLW-XEMDLRDOSA-N 2 0 332.557 4.161 20 0 EIADRP CCc1cccc(Cl)c1C[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000474350164 1044878001 /nfs/dbraw/zinc/87/80/01/1044878001.db2.gz KQKBRHKJCOWTCA-UHFFFAOYSA-N 2 0 346.902 4.133 20 0 EIADRP c1ccc(CN2CCC([NH2+]CCc3cnc4ccccc4c3)CC2)cc1 ZINC000922703568 1044893127 /nfs/dbraw/zinc/89/31/27/1044893127.db2.gz KCIVWLVLRNBPCF-UHFFFAOYSA-N 2 0 345.490 4.032 20 0 EIADRP CC(C)Oc1ccc2ccccc2c1C[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC000429005194 1044991796 /nfs/dbraw/zinc/99/17/96/1044991796.db2.gz RLYVDGAKMISMQS-QFIPXVFZSA-N 2 0 338.495 4.155 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2sccc2Br)CC1 ZINC000922846130 1044992748 /nfs/dbraw/zinc/99/27/48/1044992748.db2.gz VGQMVXWIPBWRSJ-UHFFFAOYSA-N 2 0 343.334 4.007 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2cnc(C3CCCC3)s2)CC1 ZINC000922847423 1044995967 /nfs/dbraw/zinc/99/59/67/1044995967.db2.gz PGWQNQMAKJLPRM-UHFFFAOYSA-N 2 0 333.545 4.297 20 0 EIADRP Cc1csc(CC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)n1 ZINC000671740899 1045160409 /nfs/dbraw/zinc/16/04/09/1045160409.db2.gz VHPSVVMCXBTDMC-UHFFFAOYSA-N 2 0 343.540 4.027 20 0 EIADRP C/C(=C/c1ccccc1)C[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000236702665 1045363666 /nfs/dbraw/zinc/36/36/66/1045363666.db2.gz NCNAKZCMSKCHLL-VUHHOQONSA-N 2 0 334.507 4.244 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@H](C)CCc2ccc(OC(F)F)cc2)CC1 ZINC000236821606 1045367498 /nfs/dbraw/zinc/36/74/98/1045367498.db2.gz JHQXECXZIGDGLS-OAHLLOKOSA-N 2 0 340.458 4.072 20 0 EIADRP CCn1c2ccccc2c2cc(C[NH2+]C[C@H]3CCC[N@H+](C)C3)ccc21 ZINC000237006944 1045372942 /nfs/dbraw/zinc/37/29/42/1045372942.db2.gz FLTCUGOJJNBEKR-GOSISDBHSA-N 2 0 335.495 4.246 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1F ZINC000397546597 1045631758 /nfs/dbraw/zinc/63/17/58/1045631758.db2.gz OQIKQWUOLPBJGT-KRWDZBQOSA-N 2 0 326.459 4.389 20 0 EIADRP COc1ccccc1[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000397620184 1045697624 /nfs/dbraw/zinc/69/76/24/1045697624.db2.gz VSNSIXVYSNPANC-GOSISDBHSA-N 2 0 338.495 4.258 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccc2c(c1)CCCO2 ZINC000768101097 1045712976 /nfs/dbraw/zinc/71/29/76/1045712976.db2.gz HISCZRPDWNOOSY-PXNSSMCTSA-N 2 0 330.516 4.173 20 0 EIADRP Cc1cccc2c1CC[C@@H]2[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000105496500 1045739772 /nfs/dbraw/zinc/73/97/72/1045739772.db2.gz GVVDNKDIVRQJSP-QFIPXVFZSA-N 2 0 338.495 4.103 20 0 EIADRP c1ccc2c(c1)cncc2C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000768304179 1045783095 /nfs/dbraw/zinc/78/30/95/1045783095.db2.gz UILPKZPBWAYPCA-UHFFFAOYSA-N 2 0 337.511 4.323 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC000397993099 1045820534 /nfs/dbraw/zinc/82/05/34/1045820534.db2.gz RANXRNJAFJXBEF-NEWSRXKRSA-N 2 0 336.470 4.312 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccsc1 ZINC000247039022 1045838115 /nfs/dbraw/zinc/83/81/15/1045838115.db2.gz MPQDCVGCZALEEQ-BRWVUGGUSA-N 2 0 344.524 4.208 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1cnn(C)c1 ZINC000247164416 1045843356 /nfs/dbraw/zinc/84/33/56/1045843356.db2.gz UJLZUMHKENOZQR-UTKZUKDTSA-N 2 0 340.515 4.035 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1OC ZINC000248407631 1045873129 /nfs/dbraw/zinc/87/31/29/1045873129.db2.gz UNTAPTLJWLZMII-ZWOKBUDYSA-N 2 0 330.516 4.389 20 0 EIADRP CSCCCCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000248882154 1045887041 /nfs/dbraw/zinc/88/70/41/1045887041.db2.gz LBHNXXXENYLRCJ-ACDBMABISA-N 2 0 332.557 4.305 20 0 EIADRP CC[C@H]1C[C@@H]([N@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)CCO1 ZINC001170176611 1045912172 /nfs/dbraw/zinc/91/21/72/1045912172.db2.gz AAEJAJVUHWWWJQ-KWVZWOLDSA-N 2 0 342.527 4.072 20 0 EIADRP CC[C@@H]1C[C@H]([N@H+]2C[C@H]3c4ccccc4[C@H]([NH+](C)C(C)C)[C@H]3C2)CCO1 ZINC001170222647 1045949775 /nfs/dbraw/zinc/94/97/75/1045949775.db2.gz OMOUBGBLPIMZCG-MLMGXCOMSA-N 2 0 342.527 4.055 20 0 EIADRP Cc1c[nH+]ccc1N([C@H](C)Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001170293855 1045976645 /nfs/dbraw/zinc/97/66/45/1045976645.db2.gz NADYRWNABTZPQB-MRXNPFEDSA-N 2 0 343.902 4.233 20 0 EIADRP [NH3+]C1(c2ccc(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)cc2)CC1 ZINC001170333627 1046006386 /nfs/dbraw/zinc/00/63/86/1046006386.db2.gz PNRWECIUJLFULV-DKUWSORSSA-N 2 0 347.506 4.242 20 0 EIADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000261658757 1046131153 /nfs/dbraw/zinc/13/11/53/1046131153.db2.gz BLLDDEIDVFBFJL-CRAIPNDOSA-N 2 0 344.449 4.156 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[N@H+](C)C[C@H]2CCC[NH2+]C2)cc1 ZINC000261745941 1046144153 /nfs/dbraw/zinc/14/41/53/1046144153.db2.gz BWMYVDZTRPWFBR-ROUUACIJSA-N 2 0 338.495 4.355 20 0 EIADRP Cc1ccc(-c2cnc(C[NH+]3CCC(CCC[NH+](C)C)CC3)o2)cc1 ZINC000123635939 1046188830 /nfs/dbraw/zinc/18/88/30/1046188830.db2.gz MUCXHZSBTWGUFZ-UHFFFAOYSA-N 2 0 341.499 4.204 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc2c(s1)CCC2 ZINC000162510582 1046319309 /nfs/dbraw/zinc/31/93/09/1046319309.db2.gz HUYQEVZHPXOCID-OAHLLOKOSA-N 2 0 344.524 4.028 20 0 EIADRP Cc1cccc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c1C ZINC000162543999 1046328873 /nfs/dbraw/zinc/32/88/73/1046328873.db2.gz AKRGKCXQXINDAB-SFHVURJKSA-N 2 0 326.484 4.095 20 0 EIADRP c1ccc(C(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c2ccccc2)cc1 ZINC000508708704 1046352302 /nfs/dbraw/zinc/35/23/02/1046352302.db2.gz DSXVBAMNPLDKQP-FQEVSTJZSA-N 2 0 334.507 4.236 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3ccc(O)cc3)cc2)C1 ZINC000237709843 1046354255 /nfs/dbraw/zinc/35/42/55/1046354255.db2.gz UEEOZPLUKWFLFZ-ROUUACIJSA-N 2 0 338.495 4.160 20 0 EIADRP CCc1ccc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)s1 ZINC000162597456 1046380227 /nfs/dbraw/zinc/38/02/27/1046380227.db2.gz NJVUFJIWFYOUNN-OAHLLOKOSA-N 2 0 332.513 4.102 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCN(Cc3cccs3)C2)cc1 ZINC000126875724 1046576534 /nfs/dbraw/zinc/57/65/34/1046576534.db2.gz BGHQYWRUORUJCS-SJORKVTESA-N 2 0 344.524 4.320 20 0 EIADRP CCN(Cc1ccccc1OC)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536708739 1046717604 /nfs/dbraw/zinc/71/76/04/1046717604.db2.gz QCKXTNJWAOWEHU-HXUWFJFHSA-N 2 0 338.495 4.039 20 0 EIADRP C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1cc2cccc(F)c2o1 ZINC000459497306 1046725555 /nfs/dbraw/zinc/72/55/55/1046725555.db2.gz RTGQUSIEWHYDQN-CQSZACIVSA-N 2 0 339.414 4.287 20 0 EIADRP CN(Cc1ccccn1)[C@@H]1CCC[N@H+](Cc2ccc(C3CC3)cc2)CC1 ZINC000459501870 1046728197 /nfs/dbraw/zinc/72/81/97/1046728197.db2.gz FGQYJHDKVOHITG-HSZRJFAPSA-N 2 0 349.522 4.446 20 0 EIADRP CC(C)CCO[C@@H]1CCCC[C@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459523012 1046752496 /nfs/dbraw/zinc/75/24/96/1046752496.db2.gz FOWNLILBRQLKMI-NHCUHLMSSA-N 2 0 345.531 4.014 20 0 EIADRP Cc1ccccc1[C@H](CC(F)(F)F)NC1CC[NH+](C2CC2)CC1 ZINC000459525734 1046753849 /nfs/dbraw/zinc/75/38/49/1046753849.db2.gz VRPXGWJXXPXNEN-KRWDZBQOSA-N 2 0 326.406 4.205 20 0 EIADRP CC(C)C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cccs1 ZINC000536858766 1046826580 /nfs/dbraw/zinc/82/65/80/1046826580.db2.gz RROCLULKLLAEJZ-KURKYZTESA-N 2 0 338.561 4.314 20 0 EIADRP CC(C)C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccs1 ZINC000536858764 1046827393 /nfs/dbraw/zinc/82/73/93/1046827393.db2.gz RROCLULKLLAEJZ-FGTMMUONSA-N 2 0 338.561 4.314 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)c2c(F)cccc2Cl)[C@@H](C)C1 ZINC000536875833 1046837783 /nfs/dbraw/zinc/83/77/83/1046837783.db2.gz JFKJRTMHLMEYDP-BBRMVZONSA-N 2 0 326.887 4.077 20 0 EIADRP Cc1cc(C[NH2+]CC[C@H]2CCC[N@@H+](C)C2)ccc1Oc1cccnc1 ZINC000459726991 1046865321 /nfs/dbraw/zinc/86/53/21/1046865321.db2.gz GWQAAWQSONFIQZ-GOSISDBHSA-N 2 0 339.483 4.004 20 0 EIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000459796847 1046893263 /nfs/dbraw/zinc/89/32/63/1046893263.db2.gz WLKVQCLGSLPSTE-STTHAQSSSA-N 2 0 338.442 4.013 20 0 EIADRP Cc1cccc(O[C@@H]2CCCC[C@H]2[NH2+]C2CC[NH+](CC3CC3)CC2)c1 ZINC000537095018 1046945123 /nfs/dbraw/zinc/94/51/23/1046945123.db2.gz GRGOZWXPHOGJSD-FGZHOGPDSA-N 2 0 342.527 4.149 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCc3nc(Cl)ccc32)C1 ZINC000806131614 1047123722 /nfs/dbraw/zinc/12/37/22/1047123722.db2.gz LFQHFACZTQITPY-HLLBOEOZSA-N 2 0 335.923 4.070 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCc3ccc(Cl)nc32)C1 ZINC000788538615 1047215418 /nfs/dbraw/zinc/21/54/18/1047215418.db2.gz HZVLETKVVVJAOJ-HLLBOEOZSA-N 2 0 335.923 4.070 20 0 EIADRP COc1ccc(C[NH2+]CCC[NH+]2CCC(C)CC2)c2ccccc12 ZINC000325508131 1047252547 /nfs/dbraw/zinc/25/25/47/1047252547.db2.gz HZNQXIRATJTSPB-UHFFFAOYSA-N 2 0 326.484 4.060 20 0 EIADRP CC1(C)CC([NH2+][C@@H]2CCCc3c4ccccc4[nH]c32)CC(C)(C)[NH2+]1 ZINC000325637226 1047288743 /nfs/dbraw/zinc/28/87/43/1047288743.db2.gz VTCHJTRPYQMMGT-GOSISDBHSA-N 2 0 325.500 4.444 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCCc3c4ccccc4[nH]c32)CC1 ZINC000325748554 1047319992 /nfs/dbraw/zinc/31/99/92/1047319992.db2.gz YDHGQQJKTGOJBR-LJQANCHMSA-N 2 0 325.500 4.398 20 0 EIADRP FC(F)(F)[C@H]1CCC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000129195233 1047331625 /nfs/dbraw/zinc/33/16/25/1047331625.db2.gz RGRLXTBPPGWPAH-ZWKOTPCHSA-N 2 0 340.433 4.493 20 0 EIADRP COc1ccc(CCC[NH2+][C@@H]2CCN(C)[C@H](c3ccccc3)C2)cc1 ZINC000556058598 1047422688 /nfs/dbraw/zinc/42/26/88/1047422688.db2.gz ABNDWSSEBUJJAJ-IRLDBZIGSA-N 2 0 338.495 4.053 20 0 EIADRP COC(=O)[C@@H]1CC[C@H]([NH2+]CCC[PH+](C(C)(C)C)C(C)(C)C)C1 ZINC001170528881 1047477119 /nfs/dbraw/zinc/47/71/19/1047477119.db2.gz DICYNCMRBDQPQK-CABCVRRESA-N 2 0 329.465 4.387 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)C[C@H](C)O1 ZINC000556155046 1047498897 /nfs/dbraw/zinc/49/88/97/1047498897.db2.gz QLBQZJBMKKFWHH-WIRSXHRWSA-N 2 0 330.516 4.107 20 0 EIADRP FC1(F)CCC[C@H]1CC[NH+]1CCN(c2cc[nH+]c3ccccc32)CC1 ZINC001170127300 1047512277 /nfs/dbraw/zinc/51/22/77/1047512277.db2.gz HUEYAVSSGUBMGM-INIZCTEOSA-N 2 0 345.437 4.182 20 0 EIADRP c1cn(Cc2cccc(C[NH2+][C@@H]3CC[C@@H](c4ccccc4)C3)c2)cn1 ZINC000130454128 1047710727 /nfs/dbraw/zinc/71/07/27/1047710727.db2.gz ZDNLAJMFMULPFZ-FGZHOGPDSA-N 2 0 331.463 4.357 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC(N[C@@H]2CCc3c2cccc3O)CC1 ZINC000130623212 1047755376 /nfs/dbraw/zinc/75/53/76/1047755376.db2.gz SFNKYRYMTNQBSO-YSGRDPCXSA-N 2 0 328.500 4.012 20 0 EIADRP CN1CC[C@H]([NH2+]CCCOc2ccc(F)cc2)C[C@@H]1c1ccccc1 ZINC000550644327 1047800001 /nfs/dbraw/zinc/80/00/01/1047800001.db2.gz QXWFJWPGUVQKII-PZJWPPBQSA-N 2 0 342.458 4.020 20 0 EIADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001171064632 1047921515 /nfs/dbraw/zinc/92/15/15/1047921515.db2.gz SFSZBVLJPHMJNX-CJNGLKHVSA-N 2 0 341.326 4.172 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@]3(C)CC3(Cl)Cl)CC2)C1 ZINC000824773954 1047928105 /nfs/dbraw/zinc/92/81/05/1047928105.db2.gz PJOOTBHUOGUAEB-KBMXLJTQSA-N 2 0 333.347 4.203 20 0 EIADRP c1ccc(C[C@@H](C[NH+]2CCCC2)Nc2ccc([C@@H]3CCC[NH2+]3)cc2)cc1 ZINC001170751424 1048058876 /nfs/dbraw/zinc/05/88/76/1048058876.db2.gz GGNGLCZORKHCHN-GOTSBHOMSA-N 2 0 349.522 4.230 20 0 EIADRP C[NH+]1CCC(CC(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C)CC1 ZINC001143366763 1048117783 /nfs/dbraw/zinc/11/77/83/1048117783.db2.gz IYTCPAZVPZIUED-UHFFFAOYSA-N 2 0 342.508 4.304 20 0 EIADRP C[N@H+](CC1CC[NH+](Cc2ccccc2)CC1)[C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170759204 1048135486 /nfs/dbraw/zinc/13/54/86/1048135486.db2.gz AFOLIYWRKALMJP-WKCHPHFGSA-N 2 0 326.528 4.265 20 0 EIADRP Cc1ccc(C(F)(F)F)c(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)c1 ZINC001143680437 1048150352 /nfs/dbraw/zinc/15/03/52/1048150352.db2.gz BPRSHXQPZNSGCC-UHFFFAOYSA-N 2 0 340.433 4.322 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@H]2CCc3cc(Cl)ccc3C2)C[C@@](C)(C[NH3+])C1 ZINC001171100197 1048179736 /nfs/dbraw/zinc/17/97/36/1048179736.db2.gz PFAITRAOMLASLR-CMKODMSKSA-N 2 0 334.935 4.331 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CC2)[C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171112196 1048236451 /nfs/dbraw/zinc/23/64/51/1048236451.db2.gz TYGUIMSJPQVZNQ-UFYCRDLUSA-N 2 0 332.919 4.179 20 0 EIADRP FC1(F)C[C@@]12CCC[N@H+](Cc1ccc(C[NH+]3CCCCC3)cc1)C2 ZINC000844443377 1048343490 /nfs/dbraw/zinc/34/34/90/1048343490.db2.gz KCCRDXJGAXUWJU-LJQANCHMSA-N 2 0 334.454 4.294 20 0 EIADRP FC1(F)C[C@]12CCC[N@H+](Cc1cccc(C[NH+]3CCCCC3)c1)C2 ZINC000844443969 1048343796 /nfs/dbraw/zinc/34/37/96/1048343796.db2.gz NHGWWBBKMQMKFS-IBGZPJMESA-N 2 0 334.454 4.294 20 0 EIADRP FC1(F)C[C@]12CCC[N@H+](Cc1ccc(C[NH+]3CCCCC3)cc1)C2 ZINC000844443368 1048344656 /nfs/dbraw/zinc/34/46/56/1048344656.db2.gz KCCRDXJGAXUWJU-IBGZPJMESA-N 2 0 334.454 4.294 20 0 EIADRP C[NH+]1CCC(C2CC[NH+]([C@H]3CCc4cc(Cl)ccc4C3)CC2)CC1 ZINC001171128240 1048360698 /nfs/dbraw/zinc/36/06/98/1048360698.db2.gz FXHUOHWAZRTLEP-NRFANRHFSA-N 2 0 346.946 4.251 20 0 EIADRP Cc1ccsc1CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499166237 1048362139 /nfs/dbraw/zinc/36/21/39/1048362139.db2.gz DRHTZUUWQKVBLA-OWZKRDHZSA-N 2 0 340.536 4.384 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)[C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171130196 1048381576 /nfs/dbraw/zinc/38/15/76/1048381576.db2.gz QPLHITKPJGOVEJ-HXUWFJFHSA-N 2 0 334.935 4.250 20 0 EIADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@@H]2CCc3cc(Cl)c(Cl)cc3C2)C1 ZINC001171139220 1048416724 /nfs/dbraw/zinc/41/67/24/1048416724.db2.gz JWYUFSRSEDCNHS-XJKSGUPXSA-N 2 0 341.326 4.172 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccccc2OCC2CC2)cc1 ZINC000809737647 1048508529 /nfs/dbraw/zinc/50/85/29/1048508529.db2.gz ILRAYPYZOHYQQF-UHFFFAOYSA-N 2 0 338.495 4.169 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cc3cc(F)ccc3o2)cc1 ZINC000809739048 1048510262 /nfs/dbraw/zinc/51/02/62/1048510262.db2.gz VKFHVAXARBKEID-UHFFFAOYSA-N 2 0 326.415 4.266 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)C/C=C/c2ccc(F)cc2F)cc1 ZINC000809738706 1048510633 /nfs/dbraw/zinc/51/06/33/1048510633.db2.gz GBFYCXWNTZAZAV-SNAWJCMRSA-N 2 0 330.422 4.172 20 0 EIADRP COc1c(C)cc([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)cc1Cl ZINC000844923123 1048549165 /nfs/dbraw/zinc/54/91/65/1048549165.db2.gz HAXJSGJBUMYTDN-LBPRGKRZSA-N 2 0 336.838 4.106 20 0 EIADRP CC[NH+](CC)C[C@H]1CCN(Cc2cc(Cl)cc3cccnc32)C1 ZINC000076000872 1048834457 /nfs/dbraw/zinc/83/44/57/1048834457.db2.gz XPPIQCCUVHFTCX-OAHLLOKOSA-N 2 0 331.891 4.052 20 0 EIADRP CC[NH+](CC)C[C@H]1CCN(Cc2cc(-c3ccc(Cl)cc3)no2)C1 ZINC000076003077 1048834979 /nfs/dbraw/zinc/83/49/79/1048834979.db2.gz DFENAYZJWVUGIN-OAHLLOKOSA-N 2 0 347.890 4.159 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC[C@]1(C)C[C@]1(F)Cl ZINC000846188817 1048838111 /nfs/dbraw/zinc/83/81/11/1048838111.db2.gz JTERVABTEPDIAM-QXCFHYIPSA-N 2 0 338.898 4.191 20 0 EIADRP CCC[N@H+](Cc1cccc(Br)c1)[C@H]1CC[NH2+]C(C)(C)C1 ZINC001246846788 1049020958 /nfs/dbraw/zinc/02/09/58/1049020958.db2.gz QBOGFYHJWBYZPK-INIZCTEOSA-N 2 0 339.321 4.192 20 0 EIADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC(C)(C)Sc1ccc(Br)cc1 ZINC000817897290 1049056926 /nfs/dbraw/zinc/05/69/26/1049056926.db2.gz JQXQYJHLSUXHMS-NWDGAFQWSA-N 2 0 345.350 4.035 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[NH2+]C2)ccc1SC(F)F ZINC000817948344 1049065035 /nfs/dbraw/zinc/06/50/35/1049065035.db2.gz YISQGMPNGJVTSY-OBJOEFQTSA-N 2 0 344.471 4.049 20 0 EIADRP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000817949956 1049065872 /nfs/dbraw/zinc/06/58/72/1049065872.db2.gz UWNABXLBWLPZRY-CQSZACIVSA-N 2 0 332.875 4.091 20 0 EIADRP COc1cc([C@H](C)[NH2+]C[C@@]2(C)CCC[NH2+]C2)ccc1SC(F)F ZINC000817965860 1049068951 /nfs/dbraw/zinc/06/89/51/1049068951.db2.gz DNZHSFSSORFSCE-SJCJKPOMSA-N 2 0 344.471 4.050 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)CC[NH2+]1 ZINC000817972078 1049071392 /nfs/dbraw/zinc/07/13/92/1049071392.db2.gz SWLOVHIQHSDQIQ-AXAPSJFSSA-N 2 0 326.456 4.109 20 0 EIADRP COc1ccc([C@H]([NH2+][C@H](C)CCC[NH3+])c2ccc(Cl)cc2)cc1C ZINC000817977453 1049074616 /nfs/dbraw/zinc/07/46/16/1049074616.db2.gz KOJVJOCRWUKVMA-FOIQADDNSA-N 2 0 346.902 4.463 20 0 EIADRP Cc1nccn1-c1ncccc1CNc1cc(C)c2ccc(C)cc2n1 ZINC000811825712 1049299674 /nfs/dbraw/zinc/29/96/74/1049299674.db2.gz MSAOFYUFCDANEZ-UHFFFAOYSA-N 2 0 343.434 4.353 20 0 EIADRP Fc1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC001170662268 1049367013 /nfs/dbraw/zinc/36/70/13/1049367013.db2.gz YVZMUGIBFOOXOK-UHFFFAOYSA-N 2 0 338.470 4.314 20 0 EIADRP Clc1ccccc1C[C@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccoc1 ZINC000820807866 1049554361 /nfs/dbraw/zinc/55/43/61/1049554361.db2.gz SLJHQHGLYBTXAI-QRWLVFNGSA-N 2 0 344.886 4.291 20 0 EIADRP CO[C@H](C[NH2+][C@@H](C)c1cccc(C[NH+](C)C)c1)c1ccccc1Cl ZINC000820820747 1049556609 /nfs/dbraw/zinc/55/66/09/1049556609.db2.gz AZRUDBDXTMPIPS-MGPUTAFESA-N 2 0 346.902 4.440 20 0 EIADRP C[C@@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1cccc(C[NH+](C)C)c1 ZINC000820823172 1049560207 /nfs/dbraw/zinc/56/02/07/1049560207.db2.gz LZRMGYLOEKIMBY-XLIONFOSSA-N 2 0 330.516 4.281 20 0 EIADRP Cc1cccc(C)c1C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000773067029 1049561184 /nfs/dbraw/zinc/56/11/84/1049561184.db2.gz HJOJUTDIHDWJTO-SFHVURJKSA-N 2 0 326.484 4.095 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1CCc2c(F)cc(F)cc2C1 ZINC001171389390 1049601065 /nfs/dbraw/zinc/60/10/65/1049601065.db2.gz STKBZOJBHIFBSU-GBESFXJTSA-N 2 0 348.481 4.161 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCc3ccccc3OC2)CC1 ZINC000511007819 1049620069 /nfs/dbraw/zinc/62/00/69/1049620069.db2.gz CMXYHWUMGOULEM-UIFIKXQLSA-N 2 0 342.527 4.013 20 0 EIADRP Fc1cccc2c1CC[C@@H]([NH2+]C1CC[NH+](CC3CCCCC3)CC1)C2 ZINC001171411835 1049644315 /nfs/dbraw/zinc/64/43/15/1049644315.db2.gz OTKFVFSYICOKRE-HXUWFJFHSA-N 2 0 344.518 4.317 20 0 EIADRP CC(C)(C)C[NH+]1CCC(C[NH2+][C@H]2CCc3c(F)cccc3C2)CC1 ZINC001171412039 1049646419 /nfs/dbraw/zinc/64/64/19/1049646419.db2.gz RHRPLFPMZYBGQQ-SFHVURJKSA-N 2 0 332.507 4.031 20 0 EIADRP C[C@@]12CC3([NH3+])CC([NH2+][C@@H]4CCc5cccc(F)c5C4)(C1)C[C@](C)(C3)C2 ZINC001170969445 1049671889 /nfs/dbraw/zinc/67/18/89/1049671889.db2.gz IHCKMZYVQTVJRR-JUXAHZPYSA-N 2 0 342.502 4.103 20 0 EIADRP C[NH+](C)CCC1CC[NH+](CCCOc2cccc3ccccc32)CC1 ZINC000615463991 1049698034 /nfs/dbraw/zinc/69/80/34/1049698034.db2.gz PMWDZMMULUYCBA-UHFFFAOYSA-N 2 0 340.511 4.272 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1CCc2cc(F)c(F)cc2C1 ZINC001171495138 1049720179 /nfs/dbraw/zinc/72/01/79/1049720179.db2.gz XTNDEBFJWRHBDH-FHWLQOOXSA-N 2 0 348.481 4.161 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171472722 1049727518 /nfs/dbraw/zinc/72/75/18/1049727518.db2.gz QHJWBIUZTVOHLM-BHIYHBOVSA-N 2 0 348.481 4.337 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCC2(C1)CC[NH2+]CC2)c1ccc(Br)s1 ZINC001246175152 1049750151 /nfs/dbraw/zinc/75/01/51/1049750151.db2.gz HEEZEHVLTQOUQU-VXGBXAGGSA-N 2 0 343.334 4.084 20 0 EIADRP Cc1cccc2c1CC[C@@H]([NH+]1CCC([N@H+](C)Cc3ccccc3)CC1)C2 ZINC001171571132 1049757702 /nfs/dbraw/zinc/75/77/02/1049757702.db2.gz SFHWRLHZTUYAIL-HSZRJFAPSA-N 2 0 348.534 4.449 20 0 EIADRP Cc1cccc2c1CC[C@@H]([NH+]1CCC3(CCC[N@@H+]3CC3CC3)CC1)C2 ZINC001171567393 1049758320 /nfs/dbraw/zinc/75/83/20/1049758320.db2.gz PRBKHBYUEUAVKZ-OAQYLSRUSA-N 2 0 338.539 4.193 20 0 EIADRP C[NH+]1C(C)(C)CC([N@H+](CC2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1(C)C ZINC001171631048 1049761970 /nfs/dbraw/zinc/76/19/70/1049761970.db2.gz VHJHKTMZUOJZLK-WGSAOQKQSA-N 3 0 349.607 4.400 20 0 EIADRP C[NH+]1C(C)(C)CC(n2cc(CC[NH3+])c3ccc(F)cc32)CC1(C)C ZINC001171621881 1049766202 /nfs/dbraw/zinc/76/62/02/1049766202.db2.gz RKHQGYXUPCHLNV-UHFFFAOYSA-N 2 0 331.479 4.106 20 0 EIADRP CC(C)c1noc([C@H]2CCC[N@@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)C2)n1 ZINC001171639727 1049778358 /nfs/dbraw/zinc/77/83/58/1049778358.db2.gz QWVHYFXUQGELIU-HNNXBMFYSA-N 2 0 348.535 4.024 20 0 EIADRP Cc1ccccc1O[C@H]1CC[N@@H+](C2CC(C)(C)[NH+](C)C(C)(C)C2)C1 ZINC001171637381 1049778984 /nfs/dbraw/zinc/77/89/84/1049778984.db2.gz LSWMYUVGMZRBJE-SFHVURJKSA-N 2 0 330.516 4.100 20 0 EIADRP Cc1cc2cc(C[NH3+])ccc2n1[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171727135 1049784706 /nfs/dbraw/zinc/78/47/06/1049784706.db2.gz QCDLNLPDTIOJRR-IIBYNOLFSA-N 2 0 333.479 4.244 20 0 EIADRP C[C@H]1C[C@H](n2cc(CCC[NH3+])c3ccccc32)C[N@@H+]1Cc1ccccc1 ZINC001171724899 1049785086 /nfs/dbraw/zinc/78/50/86/1049785086.db2.gz DWJZEQKCPYGLPQ-RXVVDRJESA-N 2 0 347.506 4.368 20 0 EIADRP C[C@@H]([NH3+])Cc1cn([C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171733307 1049786495 /nfs/dbraw/zinc/78/64/95/1049786495.db2.gz QEARQCZLYKTWFO-LVCYWYKZSA-N 2 0 347.506 4.367 20 0 EIADRP C[C@H]1C[C@H](n2c(C[NH3+])cc3cccc(F)c32)C[N@@H+]1Cc1ccccc1 ZINC001171741667 1049801634 /nfs/dbraw/zinc/80/16/34/1049801634.db2.gz QSJMHHDTQCOPDE-KXBFYZLASA-N 2 0 337.442 4.075 20 0 EIADRP CC1(C)C[C@H](n2c3ccccc3nc2C[NH3+])CC[N@@H+]1Cc1ccccc1 ZINC001171966557 1049826543 /nfs/dbraw/zinc/82/65/43/1049826543.db2.gz VNDORPAFLQXIRT-GOSISDBHSA-N 2 0 348.494 4.111 20 0 EIADRP C[C@@H](NC1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccnc1 ZINC000813881833 1049830639 /nfs/dbraw/zinc/83/06/39/1049830639.db2.gz VTHZOJRCJNEBRA-AMZGXZFVSA-N 2 0 335.495 4.318 20 0 EIADRP CN(Cc1cccc(O)c1)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171977933 1049837257 /nfs/dbraw/zinc/83/72/57/1049837257.db2.gz VDCQOBDGOOEIFR-FQEVSTJZSA-N 2 0 338.495 4.267 20 0 EIADRP CC1(C)C[C@@H]([NH+]2CC[C@H](c3ccncc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171983730 1049838217 /nfs/dbraw/zinc/83/82/17/1049838217.db2.gz GNPYKHHGKJIARF-VXKWHMMOSA-N 2 0 349.522 4.314 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CC2CCSCC2)CC[N@@H+]1Cc1ccccc1 ZINC001171981219 1049838326 /nfs/dbraw/zinc/83/83/26/1049838326.db2.gz ZSNBOCLLDLQNOK-IBGZPJMESA-N 2 0 332.557 4.162 20 0 EIADRP CC1(C)C[C@@H]([NH2+][C@H]2CCCc3ccncc32)CC[N@@H+]1Cc1ccccc1 ZINC001171978819 1049839131 /nfs/dbraw/zinc/83/91/31/1049839131.db2.gz LXYKHVYJZMYIQL-UNMCSNQZSA-N 2 0 349.522 4.492 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1ccc(N)cc1 ZINC001171984847 1049839981 /nfs/dbraw/zinc/83/99/81/1049839981.db2.gz YCKPOFSKWIREJF-UWJYYQICSA-N 2 0 337.511 4.363 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@@H]2CCc4ncccc42)C3)cc1 ZINC001172077023 1049843947 /nfs/dbraw/zinc/84/39/47/1049843947.db2.gz OGECTQHXZGKJCB-VLVHOKLOSA-N 2 0 347.506 4.244 20 0 EIADRP COC1(C)CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172080418 1049846505 /nfs/dbraw/zinc/84/65/05/1049846505.db2.gz VRSPCTSQFLTMJW-WKCHPHFGSA-N 2 0 342.527 4.073 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CC[C@H](OCc3ccccc3)CC1)C2 ZINC001172099619 1049849529 /nfs/dbraw/zinc/84/95/29/1049849529.db2.gz LRLYPNARXJVHFH-HRMJIJJXSA-N 2 0 342.527 4.119 20 0 EIADRP Cc1ccc(CN[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)nc1 ZINC001172061906 1049850289 /nfs/dbraw/zinc/85/02/89/1049850289.db2.gz JQEWVUBPLRKFMO-KOUNCHBCSA-N 2 0 335.495 4.065 20 0 EIADRP COC1CCC([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172070030 1049853174 /nfs/dbraw/zinc/85/31/74/1049853174.db2.gz IXJKXAMNDOMHJC-YFZZKHBCSA-N 2 0 342.527 4.119 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](n1c3ccccc3nc1[C@@H]1CCCC[NH2+]1)C2 ZINC001172127735 1049853388 /nfs/dbraw/zinc/85/33/88/1049853388.db2.gz LFFHMQPUOPSZTD-ZMMAXQRCSA-N 2 0 338.499 4.039 20 0 EIADRP c1csc(CC[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172069545 1049853853 /nfs/dbraw/zinc/85/38/53/1049853853.db2.gz UYNVJCYPUOYOKZ-ACDBMABISA-N 2 0 340.536 4.466 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCc1ccc(Cl)cc1Cl)C2 ZINC001172102440 1049855899 /nfs/dbraw/zinc/85/58/99/1049855899.db2.gz NCGATRVRSVEUJH-PHZGNYQRSA-N 2 0 327.299 4.141 20 0 EIADRP CCC(CC)[NH+]1CCC([NH2+][C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171021618 1049864397 /nfs/dbraw/zinc/86/43/97/1049864397.db2.gz HDVXSWLBBHOISZ-KRWDZBQOSA-N 2 0 334.935 4.440 20 0 EIADRP C[N@H+](C1CC[NH+](C2CCCCC2)CC1)[C@H]1CSc2ccccc2C1 ZINC001172208080 1049864772 /nfs/dbraw/zinc/86/47/72/1049864772.db2.gz NBHDFDYZGBVUKH-HXUWFJFHSA-N 2 0 344.568 4.432 20 0 EIADRP C[NH+](C)Cc1ccc(CC[NH2+][C@@H]2CCc3c(Cl)cccc3C2)cc1 ZINC001171023632 1049865391 /nfs/dbraw/zinc/86/53/91/1049865391.db2.gz DAXRCZKSUYTKSY-LJQANCHMSA-N 2 0 342.914 4.091 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+]C3C[C@H]4CC[C@@H](C3)O4)[C@H](C)C2)CC[C@H]1[NH3+] ZINC001172224579 1049867744 /nfs/dbraw/zinc/86/77/44/1049867744.db2.gz UJKCPLPHUNDJIV-IRAMRTJLSA-N 2 0 348.575 4.244 20 0 EIADRP CC[C@@H](C)OCC[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172317325 1049876442 /nfs/dbraw/zinc/87/64/42/1049876442.db2.gz BLJRQWGABSLJAU-LTLOCAGFSA-N 2 0 344.543 4.365 20 0 EIADRP CC[C@@H](C)OCC[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172315736 1049876666 /nfs/dbraw/zinc/87/66/66/1049876666.db2.gz DCVBEVZVAASJQQ-RTBURBONSA-N 2 0 332.532 4.082 20 0 EIADRP Clc1cccc2c1CC[C@H]([NH2+]CC1CC[NH+](CC3CCC3)CC1)C2 ZINC001171031887 1049878655 /nfs/dbraw/zinc/87/86/55/1049878655.db2.gz YWKJJJUSRYGZHW-IBGZPJMESA-N 2 0 346.946 4.299 20 0 EIADRP CC[C@@H](C)OCC[C@H](C)[N@H+](C)C1CCN(Cc2ccccc2)CC1 ZINC001172327956 1049886250 /nfs/dbraw/zinc/88/62/50/1049886250.db2.gz AENGEPFONOVMPI-RBUKOAKNSA-N 2 0 332.532 4.177 20 0 EIADRP CC[C@@H](C)OCC[C@H](C)[NH+]1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC001172340462 1049888538 /nfs/dbraw/zinc/88/85/38/1049888538.db2.gz KBARCGNPTXHPAJ-RBUKOAKNSA-N 2 0 332.532 4.177 20 0 EIADRP CC[C@@H](C)OCC[C@@H](C)[NH+]1CCC2(CC[N@H+](Cc3ccoc3)C2)CC1 ZINC001172339796 1049889410 /nfs/dbraw/zinc/88/94/10/1049889410.db2.gz QQODUWZMEHHNIH-RTBURBONSA-N 2 0 348.531 4.161 20 0 EIADRP CC(C)OCC[C@@H](C)[NH+]1CCC2(CC[C@@H]2[N@H+](C)Cc2ccco2)CC1 ZINC001172446146 1049915116 /nfs/dbraw/zinc/91/51/16/1049915116.db2.gz ISHMXWZCLOJJIJ-QUCCMNQESA-N 2 0 348.531 4.160 20 0 EIADRP COc1cccc2cc(CNC3CC[NH+](CC4CCCC4)CC3)oc21 ZINC000068840364 1049921281 /nfs/dbraw/zinc/92/12/81/1049921281.db2.gz DQBRXTMDSQNATI-UHFFFAOYSA-N 2 0 342.483 4.186 20 0 EIADRP [NH3+]C1(c2ccc(F)cc2)CC[NH+]([C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172558227 1049932305 /nfs/dbraw/zinc/93/23/05/1049932305.db2.gz UJPXKLNUXKGLRE-WIYYLYMNSA-N 2 0 338.470 4.412 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC001172575647 1049941880 /nfs/dbraw/zinc/94/18/80/1049941880.db2.gz JOBGNSNWNYYBAT-KBPBESRZSA-N 2 0 344.877 4.261 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]Cc1ccccc1C[NH3+] ZINC001172579501 1049951803 /nfs/dbraw/zinc/95/18/03/1049951803.db2.gz WYNXTPWXGXOBOF-GFCCVEGCSA-N 2 0 338.829 4.188 20 0 EIADRP CC1(C)CC([N@H+](Cc2ccccc2)[C@H]2CC[C@H]([NH3+])CC2)CC(C)(C)O1 ZINC001172653304 1049957323 /nfs/dbraw/zinc/95/73/23/1049957323.db2.gz HUUJPHGTYLJANZ-WGSAOQKQSA-N 2 0 344.543 4.495 20 0 EIADRP COc1ccc(C2([NH3+])CC[NH+](C3CCC4(CCCC4)CC3)CC2)cc1 ZINC001172728456 1049968069 /nfs/dbraw/zinc/96/80/69/1049968069.db2.gz JXWZDDOGMPCGAH-UHFFFAOYSA-N 2 0 342.527 4.448 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1cccnc1 ZINC000246643172 1049993385 /nfs/dbraw/zinc/99/33/85/1049993385.db2.gz XLAUUHRRRAYEAO-CEXWTWQISA-N 2 0 337.511 4.410 20 0 EIADRP Cc1ccccc1[C@@H](C)[NH2+]Cc1cccc(CN2CCO[C@@H](C)C2)c1 ZINC000246871845 1050004389 /nfs/dbraw/zinc/00/43/89/1050004389.db2.gz DMNJQWANWBTTDJ-RBUKOAKNSA-N 2 0 338.495 4.067 20 0 EIADRP CC(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCN(Cc3ccccn3)C[C@H]2C)C1 ZINC000246940919 1050006411 /nfs/dbraw/zinc/00/64/11/1050006411.db2.gz HQWWCOATECSGQT-BNDYYXHWSA-N 2 0 329.532 4.096 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H]1CCN(C)[C@@H](C)C1 ZINC000247105358 1050013790 /nfs/dbraw/zinc/01/37/90/1050013790.db2.gz SQZFCIIOPIMXMQ-GRDNDAEWSA-N 2 0 329.513 4.252 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCCc3ccc(Br)cc32)cc1 ZINC000520584320 1050046430 /nfs/dbraw/zinc/04/64/30/1050046430.db2.gz SDYNRPKXVBULEM-GOSISDBHSA-N 2 0 345.284 4.075 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCCc3ccc(Br)cc32)cc1 ZINC000520584321 1050046776 /nfs/dbraw/zinc/04/67/76/1050046776.db2.gz SDYNRPKXVBULEM-SFHVURJKSA-N 2 0 345.284 4.075 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccccc1N(C)C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248408758 1050055598 /nfs/dbraw/zinc/05/55/98/1050055598.db2.gz VVPWURMSYYSBGE-SQNIBIBYSA-N 2 0 329.532 4.056 20 0 EIADRP COC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCCC1 ZINC000248876176 1050082339 /nfs/dbraw/zinc/08/23/39/1050082339.db2.gz JNVFOCBAGAZFCR-WKCHPHFGSA-N 2 0 342.527 4.121 20 0 EIADRP CCC(CC)[C@@H](C[NH2+]C[C@@H]1CCOc2ccccc21)[NH+]1CCCC1 ZINC001177198913 1050159562 /nfs/dbraw/zinc/15/95/62/1050159562.db2.gz ANHYAAVMBPREMG-AZUAARDMSA-N 2 0 330.516 4.043 20 0 EIADRP CCO[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)C1 ZINC001177180992 1050164115 /nfs/dbraw/zinc/16/41/15/1050164115.db2.gz SEPCJBOWFMRBKK-FGZHOGPDSA-N 2 0 344.543 4.356 20 0 EIADRP C[N@H+](C1CC1)C1CC[NH+](C2CCC(Cc3ccccc3)CC2)CC1 ZINC001172825564 1050165644 /nfs/dbraw/zinc/16/56/44/1050165644.db2.gz XYQWQBLIZKSRLP-UHFFFAOYSA-N 2 0 326.528 4.347 20 0 EIADRP CC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC001177191136 1050166784 /nfs/dbraw/zinc/16/67/84/1050166784.db2.gz LMWYGZZUIBWSQQ-TZIWHRDSSA-N 2 0 330.516 4.220 20 0 EIADRP CCO[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)C1 ZINC001177256390 1050174639 /nfs/dbraw/zinc/17/46/39/1050174639.db2.gz DYPAKMVNKXKTPW-VLCRHTCISA-N 2 0 344.543 4.356 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H]([NH2+][C@H](C)Cc2ccc(F)cc2Cl)[C@@H](C)C1 ZINC001172864996 1050175743 /nfs/dbraw/zinc/17/57/43/1050175743.db2.gz JFLZOMWEYHLLBZ-PMUMKWKESA-N 2 0 326.887 4.119 20 0 EIADRP COc1cc(C[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc2ccccc21 ZINC001177298400 1050179628 /nfs/dbraw/zinc/17/96/28/1050179628.db2.gz BDYKUTIKMTYHOY-SFHVURJKSA-N 2 0 340.511 4.450 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)[NH2+]CCc1ccc(C[NH+](C)C)cc1 ZINC001172843350 1050182619 /nfs/dbraw/zinc/18/26/19/1050182619.db2.gz WBJOGSOOEJAEEX-HNNXBMFYSA-N 2 0 348.893 4.304 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[NH2+]CCCC1CC[NH+](C)CC1 ZINC001172860176 1050198745 /nfs/dbraw/zinc/19/87/45/1050198745.db2.gz YHGMKSUBKIVTGF-CQSZACIVSA-N 2 0 326.887 4.122 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)Cc1ccc(F)cc1Cl)CC(C)(C)CC[NH3+] ZINC001172861382 1050198998 /nfs/dbraw/zinc/19/89/98/1050198998.db2.gz QSKGALJWIZZNAB-KGLIPLIRSA-N 2 0 328.903 4.401 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC001172862944 1050201183 /nfs/dbraw/zinc/20/11/83/1050201183.db2.gz KEHVINAEZRQSLH-CQSZACIVSA-N 2 0 334.866 4.262 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC001172862998 1050201316 /nfs/dbraw/zinc/20/13/16/1050201316.db2.gz KQZIERFTYVIPSJ-OAHLLOKOSA-N 2 0 326.887 4.122 20 0 EIADRP C[C@@H](CSc1ccc(Cl)cc1)[NH+]1CCC([NH3+])(CC2CC2)CC1 ZINC001172878838 1050219961 /nfs/dbraw/zinc/21/99/61/1050219961.db2.gz KSXFQZYCVFPUSR-AWEZNQCLSA-N 2 0 338.948 4.414 20 0 EIADRP CCC[NH+]1C[C@@H]2C[NH+]([C@@H](C)CSc3ccc(Cl)cc3)C[C@H]2C1 ZINC001172884349 1050225248 /nfs/dbraw/zinc/22/52/48/1050225248.db2.gz BOXRKWBGMOARQJ-ARFHVFGLSA-N 2 0 338.948 4.094 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH2+]C1CCC([NH+](C)C)CC1 ZINC001172882313 1050226972 /nfs/dbraw/zinc/22/69/72/1050226972.db2.gz NOFHXXCMFZSXDX-IUDNXUCKSA-N 2 0 326.937 4.283 20 0 EIADRP CO[C@H]1CCC[C@H]([N@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001172922262 1050235153 /nfs/dbraw/zinc/23/51/53/1050235153.db2.gz GMXLSBDRIXULET-KWVZWOLDSA-N 2 0 342.527 4.072 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+]C1CCC(C(C)(C)C)CC1 ZINC001177525651 1050241488 /nfs/dbraw/zinc/24/14/88/1050241488.db2.gz ZTSNFAYVGVGKGV-UHFFFAOYSA-N 2 0 332.532 4.322 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccc(F)c(Cl)c2F)CC1 ZINC001173103571 1050304305 /nfs/dbraw/zinc/30/43/05/1050304305.db2.gz MJQDEEDZIIVSLK-UHFFFAOYSA-N 2 0 330.850 4.361 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2cccc3ccc(C)nc32)CC1 ZINC001173108616 1050308268 /nfs/dbraw/zinc/30/82/68/1050308268.db2.gz PIPAHXVTYBEXNW-UHFFFAOYSA-N 2 0 325.500 4.286 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCOc2cccc3ccoc32)CC1 ZINC001173108200 1050308509 /nfs/dbraw/zinc/30/85/09/1050308509.db2.gz FXGZLVVYNVOJQA-UHFFFAOYSA-N 2 0 330.472 4.054 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC(Oc3cccc(F)c3)CC2)CC1 ZINC001173112002 1050309003 /nfs/dbraw/zinc/30/90/03/1050309003.db2.gz OTBIPDQSRMJSOD-UHFFFAOYSA-N 2 0 348.506 4.322 20 0 EIADRP CC[NH+](CC)C1CCC([N@H+]2C[C@H]3[C@@H](C2)CCC[C@@H]3OCC2CC2)CC1 ZINC001173111105 1050309409 /nfs/dbraw/zinc/30/94/09/1050309409.db2.gz RWAPSHAYTFIOMK-XGQIVCTBSA-N 2 0 348.575 4.167 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H]2CCOc3c(F)cc(F)cc32)CC1 ZINC001173110570 1050309517 /nfs/dbraw/zinc/30/95/17/1050309517.db2.gz ORHWVHNXJBIOCP-JTTJXQCZSA-N 2 0 338.442 4.031 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@H](c3nc(C(C)C)no3)C2)CC1 ZINC001173113031 1050310456 /nfs/dbraw/zinc/31/04/56/1050310456.db2.gz GZTWXZPDJDGMIH-AOCRQIFASA-N 2 0 348.535 4.025 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC(c3cccc(O)c3)CC2)CC1 ZINC001173113867 1050310984 /nfs/dbraw/zinc/31/09/84/1050310984.db2.gz NHWDKGSAUMBICQ-UHFFFAOYSA-N 2 0 330.516 4.225 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+]C2CCC(Oc3ccccc3)CC2)CC1 ZINC001173200456 1050345554 /nfs/dbraw/zinc/34/55/54/1050345554.db2.gz NPFYDVQITZBNRU-UHFFFAOYSA-N 2 0 330.516 4.087 20 0 EIADRP COCc1c(C)cc(C)c(C[NH2+]CCC[NH+](C(C)C)C(C)C)c1C ZINC001177949018 1050345900 /nfs/dbraw/zinc/34/59/00/1050345900.db2.gz NJURSJIVRJNTTD-UHFFFAOYSA-N 2 0 334.548 4.357 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H]([NH2+]C2CCC(Oc3ccccc3)CC2)[C@@H](C)C1 ZINC001173202546 1050346138 /nfs/dbraw/zinc/34/61/38/1050346138.db2.gz UJNSJROBNXYYKF-QUWFBVPJSA-N 2 0 330.516 4.085 20 0 EIADRP C[C@H](CC(c1ccccc1)c1ccccc1)[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001173210541 1050370192 /nfs/dbraw/zinc/37/01/92/1050370192.db2.gz MWZFGTFYRQVIFF-QIJUGHKUSA-N 2 0 334.507 4.091 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2ccc(F)cc2F)C[N@@H+]1Cc1ccccc1 ZINC001178207950 1050403603 /nfs/dbraw/zinc/40/36/03/1050403603.db2.gz JKLCUJDGELSWEZ-AEFFLSMTSA-N 2 0 344.449 4.355 20 0 EIADRP CC[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CCC[C@@H](N(C)Cc4ccccn4)[C@@H]3C2)C1 ZINC001173276631 1050406503 /nfs/dbraw/zinc/40/65/03/1050406503.db2.gz CLORNAMJBCZDRP-OCFWJZSCSA-N 2 0 341.543 4.193 20 0 EIADRP CC[C@@H]1CC[C@H]([NH+]2CCC3(CC([N@H+](C)Cc4ccncc4)C3)CC2)C1 ZINC001173278996 1050408118 /nfs/dbraw/zinc/40/81/18/1050408118.db2.gz NVMAZKALAOKVRT-QUCCMNQESA-N 2 0 341.543 4.337 20 0 EIADRP CCOc1ccc(C[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cc1F ZINC001178280709 1050426838 /nfs/dbraw/zinc/42/68/38/1050426838.db2.gz PUPCWWMIUXOROM-UHFFFAOYSA-N 2 0 348.506 4.357 20 0 EIADRP CC(C)(C)c1ccc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC001178304598 1050435075 /nfs/dbraw/zinc/43/50/75/1050435075.db2.gz MMMUOVHCGYXXRP-UHFFFAOYSA-N 2 0 337.511 4.385 20 0 EIADRP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001173549006 1050485559 /nfs/dbraw/zinc/48/55/59/1050485559.db2.gz FWSLXUUPOJZDRL-AWEZNQCLSA-N 2 0 341.326 4.342 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@H]2CCCN(C)[C@@H]2C1 ZINC001173551663 1050487588 /nfs/dbraw/zinc/48/75/88/1050487588.db2.gz UQGOASXYAXMGKB-DDUZABMNSA-N 2 0 341.326 4.341 20 0 EIADRP COc1cc(C[NH2+]C(C)(C)CC[NH+]2CCCCCC2)ccc1Cl ZINC001178529118 1050492924 /nfs/dbraw/zinc/49/29/24/1050492924.db2.gz UQXVXIUDRCRKES-UHFFFAOYSA-N 2 0 338.923 4.483 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc3nc(Cl)ccc3s2)C[C@H]1C ZINC001204236521 1050615415 /nfs/dbraw/zinc/61/54/15/1050615415.db2.gz HVJZJFPMJRXJAF-CHWSQXEVSA-N 2 0 337.920 4.254 20 0 EIADRP COc1cccc2c(C[NH2+]CCC3CC[NH+](C(C)C)CC3)cccc12 ZINC001179278649 1050668589 /nfs/dbraw/zinc/66/85/89/1050668589.db2.gz WBJUPOKDEURYFC-UHFFFAOYSA-N 2 0 340.511 4.449 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CC2(c3ccccc3)CC[NH+](C)CC2)CC(C)(C)C1 ZINC001179369586 1050684743 /nfs/dbraw/zinc/68/47/43/1050684743.db2.gz JTWAWCDWAVAKPH-ICSRJNTNSA-N 2 0 328.544 4.454 20 0 EIADRP CN(C)Cc1csc(C[NH2+][C@@H]2CCCC[C@@H](c3ccccc3)C2)n1 ZINC001179607786 1050730655 /nfs/dbraw/zinc/73/06/55/1050730655.db2.gz JXZVVJYMOHPRSB-QZTJIDSGSA-N 2 0 343.540 4.411 20 0 EIADRP Cc1cc(C[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)cc(C)n1 ZINC001179771694 1050767365 /nfs/dbraw/zinc/76/73/65/1050767365.db2.gz LAWFQMQHBCCFBL-XPWALMASSA-N 2 0 349.522 4.089 20 0 EIADRP CC[NH+](CC)CC[C@H]([NH2+][C@@H]1CC[C@@H]2COCC[C@H]2C1)c1ccccc1 ZINC001179805560 1050782481 /nfs/dbraw/zinc/78/24/81/1050782481.db2.gz KBJKKAICFGUQIW-CBPXPLCBSA-N 2 0 344.543 4.254 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](C[C@H]2CCc3ccccc32)C1 ZINC001180030506 1050860543 /nfs/dbraw/zinc/86/05/43/1050860543.db2.gz NRWHHXKGZPBBNS-SVFBPWRDSA-N 2 0 326.528 4.303 20 0 EIADRP CCNc1ccccc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC001180076515 1050875255 /nfs/dbraw/zinc/87/52/55/1050875255.db2.gz HNGBZLQDQCVQTQ-UHFFFAOYSA-N 2 0 329.532 4.206 20 0 EIADRP C[C@H](C[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC001180267122 1050942258 /nfs/dbraw/zinc/94/22/58/1050942258.db2.gz OSNQAAMBLHLISM-UYAOXDASSA-N 2 0 340.486 4.383 20 0 EIADRP C[C@]1(c2ccccc2)CC[C@@H]([NH+]2CCC([NH+]3CCCCC3)CC2)C1 ZINC001180540035 1051029841 /nfs/dbraw/zinc/02/98/41/1051029841.db2.gz FVJWQLOCJVAOIS-YADHBBJMSA-N 2 0 326.528 4.447 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000775378986 1051170712 /nfs/dbraw/zinc/17/07/12/1051170712.db2.gz OTMRNVPXJFQJPN-DYVFJYSZSA-N 2 0 340.483 4.310 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC1 ZINC001181267317 1051194018 /nfs/dbraw/zinc/19/40/18/1051194018.db2.gz QGJWFXSFPMGHPV-SAABIXHNSA-N 2 0 340.433 4.273 20 0 EIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCCSC(C)(C)C)C2)CC1 ZINC001190652297 1051245154 /nfs/dbraw/zinc/24/51/54/1051245154.db2.gz YZIBBRWVEKEZMH-GOSISDBHSA-N 2 0 326.594 4.352 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(SCC(F)(F)F)cc2)C1 ZINC000163221692 1051252954 /nfs/dbraw/zinc/25/29/54/1051252954.db2.gz QVDKKCRJVVTASO-KBPBESRZSA-N 2 0 346.462 4.333 20 0 EIADRP COc1ccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c(Cl)c1 ZINC000620755217 1051273695 /nfs/dbraw/zinc/27/36/95/1051273695.db2.gz CQPUIFQBIRFRGI-UHFFFAOYSA-N 2 0 346.902 4.479 20 0 EIADRP C[C@H](C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)c1ccccc1 ZINC000716654493 1051277505 /nfs/dbraw/zinc/27/75/05/1051277505.db2.gz HYVSFXPFRWMOLX-VLSUOOLDSA-N 2 0 334.507 4.433 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@H]2CCC[C@@H]2OC)ccc1OC ZINC000775416048 1051290649 /nfs/dbraw/zinc/29/06/49/1051290649.db2.gz CWDTYNUTRUWUJF-HQRMLTQVSA-N 2 0 348.531 4.003 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)c1ccc(OC)c(C[NH+](CC)CC)c1)[C@H]1CCCO1 ZINC000775417833 1051292950 /nfs/dbraw/zinc/29/29/50/1051292950.db2.gz XNBJVSHTZQJSQQ-NBHGPNQESA-N 2 0 348.531 4.145 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000154841590 1051342661 /nfs/dbraw/zinc/34/26/61/1051342661.db2.gz URXFISCUADPVFD-NRFANRHFSA-N 2 0 326.459 4.443 20 0 EIADRP CS[C@@H]1CC[N@H+](C[C@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)C1 ZINC001182063341 1051389203 /nfs/dbraw/zinc/38/92/03/1051389203.db2.gz TXTZABLRTDWYBG-TZIWHRDSSA-N 2 0 346.584 4.362 20 0 EIADRP Cc1nc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cs1 ZINC000269429541 1051434439 /nfs/dbraw/zinc/43/44/39/1051434439.db2.gz OZVHGUGCSKTGTQ-HNNXBMFYSA-N 2 0 329.513 4.014 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](C[C@H]2CCCC(C)(C)O2)CC1 ZINC001191549316 1051485263 /nfs/dbraw/zinc/48/52/63/1051485263.db2.gz AVAYVDYVVYEWAD-UYAOXDASSA-N 2 0 336.564 4.311 20 0 EIADRP CSc1ccccc1C[N@@H+]1CCC[C@H]1CC[NH+]1CCC(C)CC1 ZINC001175352141 1051545115 /nfs/dbraw/zinc/54/51/15/1051545115.db2.gz OJXBCBWIKMYDJA-IBGZPJMESA-N 2 0 332.557 4.495 20 0 EIADRP CCOc1c(Cl)cc(C[N@@H+]2CCC[C@](F)(C[NH3+])CC2)cc1Cl ZINC001205581404 1051641749 /nfs/dbraw/zinc/64/17/49/1051641749.db2.gz TTZJGVQSVACNGS-MRXNPFEDSA-N 2 0 349.277 4.045 20 0 EIADRP CC[NH+](CC)CCC[N@H+](Cc1ccc2c(c1)OCO2)C1(C)CCCC1 ZINC001192149135 1051642021 /nfs/dbraw/zinc/64/20/21/1051642021.db2.gz LKFDPFLEPCOFEZ-UHFFFAOYSA-N 2 0 346.515 4.282 20 0 EIADRP COc1ccc([C@H](C)NC2CC[NH+](C3CCCCC3)CC2)c(F)c1 ZINC000157516477 1051646118 /nfs/dbraw/zinc/64/61/18/1051646118.db2.gz OWSVJNIFXMPEDL-HNNXBMFYSA-N 2 0 334.479 4.282 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc2cc(OC)ccc2c1 ZINC000158162050 1051721304 /nfs/dbraw/zinc/72/13/04/1051721304.db2.gz HJHWZLDLJJYTKR-HRAATJIYSA-N 2 0 326.484 4.231 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2cncc(Cl)c2)CC1 ZINC000621254274 1051786045 /nfs/dbraw/zinc/78/60/45/1051786045.db2.gz OLMIKHMHUTXCKZ-UHFFFAOYSA-N 2 0 343.902 4.079 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](CCCCCn2cccn2)CC1 ZINC000158973624 1051800747 /nfs/dbraw/zinc/80/07/47/1051800747.db2.gz XWGGIASGZRPANT-FQEVSTJZSA-N 2 0 346.563 4.030 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](CCCCCn2cccn2)CC1 ZINC000158973482 1051801252 /nfs/dbraw/zinc/80/12/52/1051801252.db2.gz XWGGIASGZRPANT-HXUWFJFHSA-N 2 0 346.563 4.030 20 0 EIADRP Cc1ccc(C[C@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC001183281072 1051812335 /nfs/dbraw/zinc/81/23/35/1051812335.db2.gz LQUNGGYLYYEMQN-JTAQYXEDSA-N 2 0 336.523 4.284 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccc(OC)cc2)c1 ZINC000163568524 1051996054 /nfs/dbraw/zinc/99/60/54/1051996054.db2.gz KSTIPEHDQDJCIS-KRWDZBQOSA-N 2 0 326.484 4.388 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)cc1 ZINC000165898028 1052079674 /nfs/dbraw/zinc/07/96/74/1052079674.db2.gz YNTVLNYTPFCHOU-ZWKOTPCHSA-N 2 0 326.484 4.347 20 0 EIADRP CCC[NH+]1CCC(N(C)Cc2cc(C)cc(Br)c2)CC1 ZINC000774846755 1052208113 /nfs/dbraw/zinc/20/81/13/1052208113.db2.gz SSKJYRSXRGAIED-UHFFFAOYSA-N 2 0 339.321 4.064 20 0 EIADRP COc1cccc2c(C[NH2+]CCC[NH+]3CCC(C)CC3)cccc12 ZINC001177122694 1052227353 /nfs/dbraw/zinc/22/73/53/1052227353.db2.gz RTXGPVPNDCMXTI-UHFFFAOYSA-N 2 0 326.484 4.060 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]C[C@H]1CCOc2ccccc21 ZINC001177127468 1052227827 /nfs/dbraw/zinc/22/78/27/1052227827.db2.gz ASUSROIHEXJTGU-LJQANCHMSA-N 2 0 338.495 4.184 20 0 EIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccccc1F ZINC000174450470 1052568117 /nfs/dbraw/zinc/56/81/17/1052568117.db2.gz MKPITSZOOSNLLD-UHFFFAOYSA-N 2 0 338.426 4.341 20 0 EIADRP CCOc1cccc2cc([C@H](C)N[C@H]3CC[N@H+](C)C(C)(C)C3)oc21 ZINC000623342621 1052626185 /nfs/dbraw/zinc/62/61/85/1052626185.db2.gz GQXUTNKLQDJWIX-HOCLYGCPSA-N 2 0 330.472 4.355 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CN[C@@H]2CC[NH+](C)C(C)(C)C2)cc1 ZINC000623357193 1052634305 /nfs/dbraw/zinc/63/43/05/1052634305.db2.gz BZJDZANHKHMQGR-GHTZIAJQSA-N 3 0 343.559 4.023 20 0 EIADRP c1ccc2c(c1)NCCC[C@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000192926040 1052649174 /nfs/dbraw/zinc/64/91/74/1052649174.db2.gz RPIQRXIZLIHIFQ-OAQYLSRUSA-N 2 0 327.516 4.320 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000178087735 1052697738 /nfs/dbraw/zinc/69/77/38/1052697738.db2.gz FSEGMWQZFVOECQ-YCRPNKLZSA-N 2 0 342.458 4.104 20 0 EIADRP C/C(=C/c1ccccc1OC(F)F)C[NH2+]C[C@H]1CCCC[N@@H+](C)C1 ZINC000623656916 1052698669 /nfs/dbraw/zinc/69/86/69/1052698669.db2.gz FMWKFQBMRXWOLV-UVQBRAAOSA-N 2 0 338.442 4.013 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ncc(Br)s1 ZINC000179188273 1052726457 /nfs/dbraw/zinc/72/64/57/1052726457.db2.gz ZFPKRJWWROMTIG-RYUDHWBXSA-N 2 0 348.354 4.067 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)c2ccccc12 ZINC000180403528 1052798788 /nfs/dbraw/zinc/79/87/88/1052798788.db2.gz YCHLALRYFCYHHG-INIZCTEOSA-N 2 0 326.484 4.372 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)c2ccccc12 ZINC000180403545 1052799168 /nfs/dbraw/zinc/79/91/68/1052799168.db2.gz YCHLALRYFCYHHG-MRXNPFEDSA-N 2 0 326.484 4.372 20 0 EIADRP Fc1ccc(S[C@@H]2CCCC[C@@H]2[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000623866516 1052825126 /nfs/dbraw/zinc/82/51/26/1052825126.db2.gz YQOTVWTZTDGIBY-QGZVKYPTSA-N 2 0 348.531 4.445 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(CN[C@H]2CCCc3scnc32)c1 ZINC000623877286 1052828494 /nfs/dbraw/zinc/82/84/94/1052828494.db2.gz XVTMKIPQHBEHFW-KRWDZBQOSA-N 2 0 329.513 4.151 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H]3CCCc4scnc43)CC2)c1 ZINC000623880525 1052829105 /nfs/dbraw/zinc/82/91/05/1052829105.db2.gz LCAQAUCOZDFZPO-MRXNPFEDSA-N 2 0 347.553 4.084 20 0 EIADRP Cc1csc([C@H](C)NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)n1 ZINC000623898806 1052831681 /nfs/dbraw/zinc/83/16/81/1052831681.db2.gz RKQNOGNWMVQUOP-LZWOXQAQSA-N 2 0 335.542 4.247 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3c4cc(Cl)ccc4[nH]c32)CC[N@@H+]1C ZINC000623898298 1052832637 /nfs/dbraw/zinc/83/26/37/1052832637.db2.gz FAOWKUYTOFTHMU-IAISJRAMSA-N 2 0 331.891 4.271 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCCc4scnc43)CC2)CC1 ZINC000623923901 1052839001 /nfs/dbraw/zinc/83/90/01/1052839001.db2.gz NWSAHIUWGKARPC-JCYILVPMSA-N 2 0 333.545 4.153 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(F)cc1C(F)(F)F ZINC000623972178 1052846119 /nfs/dbraw/zinc/84/61/19/1052846119.db2.gz UINDQOICBIGTAK-LBPRGKRZSA-N 2 0 344.396 4.370 20 0 EIADRP COc1ccc(C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000381343446 1053070373 /nfs/dbraw/zinc/07/03/73/1053070373.db2.gz LATOABLAJNQDGQ-NRFANRHFSA-N 2 0 338.495 4.087 20 0 EIADRP c1ccc(C[C@H]2CCC[C@@H]2[NH2+]C2CC[NH+](C3CCCCC3)CC2)nc1 ZINC000850387300 1053160187 /nfs/dbraw/zinc/16/01/87/1053160187.db2.gz QQGGLMOQBNZEKR-GCJKJVERSA-N 2 0 341.543 4.180 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc2c(c1)CCCO2 ZINC000850440022 1053215779 /nfs/dbraw/zinc/21/57/79/1053215779.db2.gz RNSHLZCYVKEMBB-INIZCTEOSA-N 2 0 328.500 4.069 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@]2(C)CC2(F)F)ccc1OC ZINC000850536864 1053302105 /nfs/dbraw/zinc/30/21/05/1053302105.db2.gz OIFQRZBCIHYKGG-KSSFIOAISA-N 2 0 340.458 4.233 20 0 EIADRP CC(C)O[C@H]1CCC[N@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC001195809574 1053495520 /nfs/dbraw/zinc/49/55/20/1053495520.db2.gz OCABUJYUOPJIID-NRFANRHFSA-N 2 0 330.516 4.062 20 0 EIADRP CSCC1CCC([NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000385424949 1053522243 /nfs/dbraw/zinc/52/22/43/1053522243.db2.gz LCMVAGVBCYGMHR-PPXMBRMGSA-N 2 0 346.584 4.408 20 0 EIADRP FC(F)(F)c1ccccc1C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000385614823 1053535619 /nfs/dbraw/zinc/53/56/19/1053535619.db2.gz OOKWEDXLBCRIRO-KRWDZBQOSA-N 2 0 348.412 4.317 20 0 EIADRP C[C@@H](CSC(C)(C)C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000765502623 1053581180 /nfs/dbraw/zinc/58/11/80/1053581180.db2.gz MUZXOAOHJKQQKQ-HNNXBMFYSA-N 2 0 340.602 4.470 20 0 EIADRP COc1ccc2c(NC3CC[NH+](C4CCCC4)CC3)cc[nH+]c2c1 ZINC000765517632 1053609448 /nfs/dbraw/zinc/60/94/48/1053609448.db2.gz RJNYRSWGOLUNNQ-UHFFFAOYSA-N 2 0 325.456 4.062 20 0 EIADRP CCCC[N@H+](Cc1cccc(OC)n1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196545939 1053696670 /nfs/dbraw/zinc/69/66/70/1053696670.db2.gz VBCSVCHIUBYGNY-UHFFFAOYSA-N 2 0 333.520 4.002 20 0 EIADRP CC1(C)C[N@H+](CCCCF)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001196545103 1053697458 /nfs/dbraw/zinc/69/74/58/1053697458.db2.gz KUSFFNITZGBRTG-HXUWFJFHSA-N 2 0 332.507 4.359 20 0 EIADRP C[C@@H](CCc1cncc2ccccc21)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000866350506 1053699920 /nfs/dbraw/zinc/69/99/20/1053699920.db2.gz DAFOIOHFLBQDRM-RPCJCACASA-N 2 0 337.511 4.162 20 0 EIADRP CCOc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000386416522 1053713892 /nfs/dbraw/zinc/71/38/92/1053713892.db2.gz YTOLFOWGZUAATJ-RXVVDRJESA-N 2 0 338.495 4.086 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CC[C@@H]2CCCS2)C3)cc1 ZINC000866482263 1053745546 /nfs/dbraw/zinc/74/55/46/1053745546.db2.gz ZJEXLENRIZOXDD-YRPNKDGESA-N 2 0 330.541 4.057 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)cc1 ZINC000866516575 1053763499 /nfs/dbraw/zinc/76/34/99/1053763499.db2.gz CSFNXNIYFYROCC-HKGREODRSA-N 2 0 330.516 4.040 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@@H](c2ccccc2)c2ccc(F)cn2)CC1 ZINC000866516848 1053764645 /nfs/dbraw/zinc/76/46/45/1053764645.db2.gz DDWJUJRUCKELBR-CKHPTIKVSA-N 2 0 341.474 4.163 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@H](c2ccccc2)C2CCOCC2)CC1 ZINC000866516774 1053765465 /nfs/dbraw/zinc/76/54/65/1053765465.db2.gz UHIBSZRPSIEVDE-NYLDSWQDSA-N 2 0 330.516 4.007 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000866516660 1053765545 /nfs/dbraw/zinc/76/55/45/1053765545.db2.gz RWRZWJWUYPESLZ-MAKTXDPSSA-N 2 0 330.516 4.007 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H]2CCCO[C@H]2c2ccc(Cl)cc2)CC1 ZINC000866611924 1053803820 /nfs/dbraw/zinc/80/38/20/1053803820.db2.gz ZNZXVJRMFYSVBT-MOPGFXCFSA-N 2 0 336.907 4.024 20 0 EIADRP CC1CC[NH+](CC[C@@H]2CCC[N@@H+]2C[C@H]2CCCCC2(F)F)CC1 ZINC001196934744 1053804193 /nfs/dbraw/zinc/80/41/93/1053804193.db2.gz CGTGAMPUFTWTLY-MSOLQXFVSA-N 2 0 328.491 4.398 20 0 EIADRP C[C@]1(C2CCCCC2)CC[N@@H+]1Cc1ccc(CN2CCOCC2)cc1 ZINC001197239247 1053859319 /nfs/dbraw/zinc/85/93/19/1053859319.db2.gz MZYBMVQPGADPEY-JOCHJYFZSA-N 2 0 342.527 4.064 20 0 EIADRP COC1CCC(CC[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)CC1 ZINC000542665988 1054032186 /nfs/dbraw/zinc/03/21/86/1054032186.db2.gz TXPRUQQTVLPDKM-AXIYNFMDSA-N 2 0 336.564 4.214 20 0 EIADRP c1ccc([C@H](CN2CCCC2)[NH2+][C@@H]2CCCc3ccccc3C2)cc1 ZINC001198901021 1054292544 /nfs/dbraw/zinc/29/25/44/1054292544.db2.gz OGUMCLBCHZDMQR-PKTZIBPZSA-N 2 0 334.507 4.361 20 0 EIADRP CCC[NH+](CCC)CCC[NH2+]Cc1ccc(Cl)c2cccnc12 ZINC001198891130 1054300969 /nfs/dbraw/zinc/30/09/69/1054300969.db2.gz NZIDEHDYCMCPRU-UHFFFAOYSA-N 2 0 333.907 4.490 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000872022897 1054338374 /nfs/dbraw/zinc/33/83/74/1054338374.db2.gz MUKXMIWSGNLERX-FQEVSTJZSA-N 2 0 330.516 4.108 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCOC3(CCCC3)C2)c1 ZINC000872025964 1054339794 /nfs/dbraw/zinc/33/97/94/1054339794.db2.gz WQOLGIFZMPLIHP-HXUWFJFHSA-N 2 0 330.516 4.110 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H]2CCc3ccc(Cl)nc32)CC1 ZINC000857908110 1054382597 /nfs/dbraw/zinc/38/25/97/1054382597.db2.gz XAGDGHGDABJNSM-KRWDZBQOSA-N 2 0 335.923 4.070 20 0 EIADRP CC[C@H](CCC(F)(F)F)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000872085463 1054383288 /nfs/dbraw/zinc/38/32/88/1054383288.db2.gz NNOYLBXPOPEVMN-QGZVFWFLSA-N 2 0 343.437 4.004 20 0 EIADRP C[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(COc3ccccc3)cc2)CC1(C)C ZINC001199309424 1054387150 /nfs/dbraw/zinc/38/71/50/1054387150.db2.gz IJLOAXQYGIJPOP-HXUWFJFHSA-N 2 0 338.495 4.228 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccccc2-n2ccnc2)cc2cccnc12 ZINC001199752192 1054461422 /nfs/dbraw/zinc/46/14/22/1054461422.db2.gz ZTNTWFMHWREEBP-UHFFFAOYSA-N 2 0 328.419 4.019 20 0 EIADRP COc1ccc(CC[C@H](C)[NH2+]CC(C)(C)[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC001199760312 1054463203 /nfs/dbraw/zinc/46/32/03/1054463203.db2.gz PSZOPWJJRUCZSB-QRVBRYPASA-N 2 0 346.559 4.362 20 0 EIADRP CC1CC[NH+](Cc2cccc(C[NH2+]Cc3cccc4c[nH]nc43)c2)CC1 ZINC000084021913 1054475185 /nfs/dbraw/zinc/47/51/85/1054475185.db2.gz RXZYPSWFMLDRKM-UHFFFAOYSA-N 2 0 348.494 4.085 20 0 EIADRP CC[C@H]1C[C@@H](C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)CCO1 ZINC001199896512 1054483774 /nfs/dbraw/zinc/48/37/74/1054483774.db2.gz MXEGSAHROKSQOJ-UNMCSNQZSA-N 2 0 344.543 4.357 20 0 EIADRP CS[C@@H]1CCC[C@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)C1 ZINC001199883242 1054491374 /nfs/dbraw/zinc/49/13/74/1054491374.db2.gz HSTZIYCBNTXBLS-DLBZAZTESA-N 2 0 338.586 4.224 20 0 EIADRP C[C@H]1CCCC[C@H]1C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC001199926912 1054498028 /nfs/dbraw/zinc/49/80/28/1054498028.db2.gz ZOVYVFJPLNGBSK-OALUTQOASA-N 2 0 343.559 4.133 20 0 EIADRP CC(C)([NH2+]Cc1cc2c(s1)CC[NH2+]C2)c1nc2ccccc2s1 ZINC000873213180 1054510741 /nfs/dbraw/zinc/51/07/41/1054510741.db2.gz YTHQIMOMMPUFBZ-UHFFFAOYSA-N 2 0 343.521 4.028 20 0 EIADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000873254817 1054513782 /nfs/dbraw/zinc/51/37/82/1054513782.db2.gz BFYDZOASPCSQLG-OSMBCOQSSA-N 2 0 326.406 4.059 20 0 EIADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000873249602 1054515052 /nfs/dbraw/zinc/51/50/52/1054515052.db2.gz BFYDZOASPCSQLG-NKKGCODLSA-N 2 0 326.406 4.059 20 0 EIADRP C[NH+](C)[C@H]1CCC[N@H+](CCCOc2ccc3ccccc3c2)CC1 ZINC000429546258 1054724238 /nfs/dbraw/zinc/72/42/38/1054724238.db2.gz BRLIKWSJCHJCAW-FQEVSTJZSA-N 2 0 326.484 4.025 20 0 EIADRP CC(C)=CCC[C@H](C)C[N@@H+]1CC[C@@]2(C[NH+](C)C[C@@H]2COCC2CC2)C1 ZINC001201486161 1054814534 /nfs/dbraw/zinc/81/45/34/1054814534.db2.gz GJEJKEQVHSZANB-KSEOMHKRSA-N 2 0 348.575 4.049 20 0 EIADRP C[N@H+](Cc1ccncc1)C1CC2(C1)CC[NH+](CCc1ccccc1)CC2 ZINC001201597970 1054846689 /nfs/dbraw/zinc/84/66/89/1054846689.db2.gz DYDFFMCZBXGQGB-UHFFFAOYSA-N 2 0 349.522 4.001 20 0 EIADRP Cc1ccc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(Cl)c1 ZINC001201663946 1054880030 /nfs/dbraw/zinc/88/00/30/1054880030.db2.gz KUCJBGXQMBOOTN-UHFFFAOYSA-N 2 0 329.875 4.050 20 0 EIADRP CC1(C)CCC([NH2+]CCc2ccc(OCC[NH+]3CCCC3)cc2)CC1 ZINC001201725005 1054887392 /nfs/dbraw/zinc/88/73/92/1054887392.db2.gz BQRSLPITIDMQFN-UHFFFAOYSA-N 2 0 344.543 4.262 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](CCCOc2ccccc2C)CC1 ZINC000065223097 1054909951 /nfs/dbraw/zinc/90/99/51/1054909951.db2.gz JEFYLZGTXQAPHE-UHFFFAOYSA-N 2 0 332.532 4.208 20 0 EIADRP c1cc2c(cc1C[NH2+]C1CC[NH+](CC3CCCC3)CC1)CCCC2 ZINC001201857977 1054923763 /nfs/dbraw/zinc/92/37/63/1054923763.db2.gz WFLUPPFLOYZTFP-UHFFFAOYSA-N 2 0 326.528 4.310 20 0 EIADRP COc1ccc2cc(C[NH2+]CC[C@@H](C)[NH+]3CCCCC3)ccc2c1 ZINC001201963523 1054970534 /nfs/dbraw/zinc/97/05/34/1054970534.db2.gz SWCHPIZFWICYRN-QGZVFWFLSA-N 2 0 326.484 4.203 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cccc(Cl)c1N ZINC000876902010 1054981412 /nfs/dbraw/zinc/98/14/12/1054981412.db2.gz KBPNRIKLKRFADO-UHFFFAOYSA-N 2 0 331.891 4.054 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cc3c(ccnc3Cl)o2)c1 ZINC000877020402 1055003374 /nfs/dbraw/zinc/00/33/74/1055003374.db2.gz SBISCKZYDHTFJE-UHFFFAOYSA-N 2 0 343.858 4.223 20 0 EIADRP Cc1c(C[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)ccnc1F ZINC000862265600 1055041619 /nfs/dbraw/zinc/04/16/19/1055041619.db2.gz MJIINGDJZAVIQU-UHFFFAOYSA-N 2 0 341.474 4.051 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CS1 ZINC000877546912 1055075796 /nfs/dbraw/zinc/07/57/96/1055075796.db2.gz NPUPSUNBSGIMEB-IFNDBITQSA-N 2 0 330.541 4.056 20 0 EIADRP COCC(C)(C)CC[NH2+][C@@H]1CCN(C2CC2)[C@@H](c2ccccc2)C1 ZINC000877803742 1055121540 /nfs/dbraw/zinc/12/15/40/1055121540.db2.gz JDMAKYZATZYEAT-UYAOXDASSA-N 2 0 330.516 4.007 20 0 EIADRP FC(F)(F)CCC[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001202444048 1055176757 /nfs/dbraw/zinc/17/67/57/1055176757.db2.gz COAPXRUNKSPPMH-MSOLQXFVSA-N 2 0 340.433 4.173 20 0 EIADRP CC(C)[NH2+]C1CCN(CCCOc2ccc(C(C)(C)C)cc2)CC1 ZINC000111054308 1055214241 /nfs/dbraw/zinc/21/42/41/1055214241.db2.gz DHKQOEXOKSARAR-UHFFFAOYSA-N 2 0 332.532 4.215 20 0 EIADRP CC(C)(C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(Cl)c(Cl)c1 ZINC000166407486 1055548040 /nfs/dbraw/zinc/54/80/40/1055548040.db2.gz QYNKIXXWONPCBS-LSDHHAIUSA-N 2 0 341.326 4.487 20 0 EIADRP C[C@@H]([NH2+]C1CCC(C(F)F)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000282300148 1055791654 /nfs/dbraw/zinc/79/16/54/1055791654.db2.gz MGAHYHHSXLHRKX-IZIZEDOESA-N 2 0 336.470 4.311 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)C1CCC(C(F)(F)F)CC1 ZINC000475197067 1056239099 /nfs/dbraw/zinc/23/90/99/1056239099.db2.gz XARTYZPWWOZGJO-IUDNXUCKSA-N 2 0 332.454 4.208 20 0 EIADRP Clc1cccc2c1C[C@@H]([NH2+]CC1CC[NH+](C3CCCCC3)CC1)C2 ZINC001168689602 1056773949 /nfs/dbraw/zinc/77/39/49/1056773949.db2.gz HBBVAYPIUABRSN-SFHVURJKSA-N 2 0 346.946 4.442 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2ncc(C)c(OC)c2C)CC1 ZINC000542945481 1056829431 /nfs/dbraw/zinc/82/94/31/1056829431.db2.gz RLWXECBUCKERGF-UHFFFAOYSA-N 2 0 347.547 4.041 20 0 EIADRP Brc1cccc(C2([NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)CCC2)c1 ZINC000180429465 1058600342 /nfs/dbraw/zinc/60/03/42/1058600342.db2.gz GLCNSMUQVVOPGN-DLBZAZTESA-N 2 0 349.316 4.045 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH2+][C@@H](C)c1cccc(O)c1)c1cccc(O)c1 ZINC000181548016 1059534672 /nfs/dbraw/zinc/53/46/72/1059534672.db2.gz JXVKKGMJRJJCIJ-IRXDYDNUSA-N 2 0 342.483 4.270 20 0 EIADRP CC(=O)Nc1ccc([C@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)cc1 ZINC000182111083 1059750034 /nfs/dbraw/zinc/75/00/34/1059750034.db2.gz FONPMZYCCWEDQW-KRWDZBQOSA-N 2 0 345.531 4.054 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000386483109 1060266179 /nfs/dbraw/zinc/26/61/79/1060266179.db2.gz WLRQDPIDGSNHHW-ICSRJNTNSA-N 2 0 338.495 4.258 20 0 EIADRP CC[C@@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1ccc2c(c1)CCO2 ZINC000766512441 1060454926 /nfs/dbraw/zinc/45/49/26/1060454926.db2.gz KOEWDNMQSNKCBX-XVAXZDLZSA-N 2 0 342.527 4.459 20 0 EIADRP CC(C)C[C@@H](Cc1ccccc1)[NH2+]C(C)(C)CCNCCC(C)(C)[NH3+] ZINC001169062318 1060619315 /nfs/dbraw/zinc/61/93/15/1060619315.db2.gz SMSSXYMLCSGZJE-FQEVSTJZSA-N 2 0 347.591 4.119 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1(CC3CCC3)CCC(F)(F)CC1)C2 ZINC001169109322 1060657436 /nfs/dbraw/zinc/65/74/36/1060657436.db2.gz ASXZUBOCIGBJRG-OSYLJGHBSA-N 2 0 326.475 4.340 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+](CCc1ccccc1)Cc1ccccc1)C2 ZINC001169148095 1060665234 /nfs/dbraw/zinc/66/52/34/1060665234.db2.gz YPZWHUWNCUQCLC-NUNAXRQHSA-N 2 0 334.507 4.357 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CC[C@H](c3ccc(Cl)c(Cl)c3)C1)C2 ZINC001169147032 1060665654 /nfs/dbraw/zinc/66/56/54/1060665654.db2.gz RMUHRKPLVPREKM-CAOSSQGBSA-N 2 0 339.310 4.408 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CC[C@@H](c3ccc(C(F)(F)F)cc3)C1)C2 ZINC001169147648 1060666397 /nfs/dbraw/zinc/66/63/97/1060666397.db2.gz VSUPYEFXNMBVGX-BGTYHANMSA-N 2 0 338.417 4.120 20 0 EIADRP CC1(C)C[C@@H](Nc2cc[nH+]c(N3CCCCC3)c2)C[C@](C)(C[NH3+])C1 ZINC001169149344 1060667445 /nfs/dbraw/zinc/66/74/45/1060667445.db2.gz YXECWMXRBBJDKQ-XLIONFOSSA-N 2 0 330.520 4.028 20 0 EIADRP CC[N@H+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169154969 1060670310 /nfs/dbraw/zinc/67/03/10/1060670310.db2.gz VGTCDVTZZDTYDA-BJWYYQGGSA-N 2 0 326.406 4.153 20 0 EIADRP C[C@@H]1C[N@H+](Cc2sccc2Oc2ccccc2)CCC[C@H]1C[NH3+] ZINC001206003734 1060687787 /nfs/dbraw/zinc/68/77/87/1060687787.db2.gz LYSYUHUFUGITRA-CVEARBPZSA-N 2 0 330.497 4.347 20 0 EIADRP CC[NH+]1CCC([NH2+]CCSCc2c(Cl)cccc2Cl)CC1 ZINC001169221785 1060700083 /nfs/dbraw/zinc/70/00/83/1060700083.db2.gz LYLVHINVGAUUHD-UHFFFAOYSA-N 2 0 347.355 4.301 20 0 EIADRP C[N@@H+]1CCC[C@@H](CCNc2[nH+]ccc3c2ccn3Cc2ccccc2)C1 ZINC001156390076 1061008231 /nfs/dbraw/zinc/00/82/31/1061008231.db2.gz UUDOHFSMSWAMHB-IBGZPJMESA-N 2 0 348.494 4.228 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2ccccc2n1)c1ccc(OCC[NH+](C)C)cc1 ZINC000532212091 1032090966 /nfs/dbraw/zinc/09/09/66/1032090966.db2.gz USBUXQUDPTUYGM-QGZVFWFLSA-N 2 0 349.478 4.026 20 0 EIADRP Cc1ccc(-c2nc(C[NH2+]C(C)(C)CCC[NH+](C)C)cs2)cc1 ZINC000449525597 1031822418 /nfs/dbraw/zinc/82/24/18/1031822418.db2.gz BWAIRPMWYGNXLO-UHFFFAOYSA-N 2 0 331.529 4.329 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000532218064 1032098113 /nfs/dbraw/zinc/09/81/13/1032098113.db2.gz VDJSGOYOTZDSFG-QGZVFWFLSA-N 2 0 344.474 4.397 20 0 EIADRP C[C@H]([NH2+]C1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)[C@H]1CCCC[NH2+]1 ZINC000643458719 1032267529 /nfs/dbraw/zinc/26/75/29/1032267529.db2.gz UBOYWIVSKMTJHF-SBFPOUOMSA-N 2 0 346.359 4.016 20 0 EIADRP C[C@@H](c1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)cc1)C(F)(F)F ZINC000450265886 1032387995 /nfs/dbraw/zinc/38/79/95/1032387995.db2.gz LTZCAIYRIKIZFZ-AWEZNQCLSA-N 2 0 328.422 4.126 20 0 EIADRP Cc1csc([C@@H](C)N[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC000245707369 1032405114 /nfs/dbraw/zinc/40/51/14/1032405114.db2.gz MQXXGXRFTKJVJF-OQIJWPOYSA-N 2 0 341.524 4.298 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1cccc(OC)c1 ZINC000120852537 1032449608 /nfs/dbraw/zinc/44/96/08/1032449608.db2.gz BGHVTDYMLFGGQQ-HXUWFJFHSA-N 2 0 330.447 4.137 20 0 EIADRP COc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000120962583 1032481664 /nfs/dbraw/zinc/48/16/64/1032481664.db2.gz GALUBXHGKVBCNC-OAQYLSRUSA-N 2 0 342.458 4.063 20 0 EIADRP C[C@@H](c1ccc(CN2CC[C@H](C[NH+]3CCCC3)C2)cc1)C(F)(F)F ZINC000450427244 1032487113 /nfs/dbraw/zinc/48/71/13/1032487113.db2.gz FFOPRUKBJWKTEV-DOTOQJQBSA-N 2 0 340.433 4.270 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2cc(Cl)c(N)c(Cl)c2)CC1 ZINC000760159093 1032487741 /nfs/dbraw/zinc/48/77/41/1032487741.db2.gz OKWGRFRZPYASIZ-LBPRGKRZSA-N 2 0 344.330 4.348 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc(Cl)nc1 ZINC000760174784 1032572117 /nfs/dbraw/zinc/57/21/17/1032572117.db2.gz ZCJCNBODKRODBJ-SJLPKXTDSA-N 2 0 343.902 4.298 20 0 EIADRP C[C@@H]1CCN(Cc2ccc(C(F)(F)F)s2)C[C@H]1n1ccnc1 ZINC000432732334 1032617377 /nfs/dbraw/zinc/61/73/77/1032617377.db2.gz ULUNTBFRAKJAHD-DGCLKSJQSA-N 2 0 329.391 4.047 20 0 EIADRP CC[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cccc(Br)c1 ZINC000643545819 1018893287 /nfs/dbraw/zinc/89/32/87/1018893287.db2.gz CNNWBUDXOUVDDX-JKSUJKDBSA-N 2 0 337.305 4.165 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@H]2[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1F ZINC000643546708 1018895831 /nfs/dbraw/zinc/89/58/31/1018895831.db2.gz TUEZKMLWPLHCBB-ZIFCJYIRSA-N 2 0 346.490 4.125 20 0 EIADRP C[C@@H](N[C@@H]1CC[NH2+]C2(CCC2)C1)c1csc(-c2ccccc2)n1 ZINC000643547847 1018928889 /nfs/dbraw/zinc/92/88/89/1018928889.db2.gz JSAAPKLZXCZZAU-GDBMZVCRSA-N 2 0 327.497 4.135 20 0 EIADRP C[NH+](C)[C@@H]1CCCN(Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000432796644 1032818583 /nfs/dbraw/zinc/81/85/83/1032818583.db2.gz BCWQPGKTSHRLIP-MRXNPFEDSA-N 2 0 332.488 4.470 20 0 EIADRP C[NH+](C)[C@H]1CCCN(Cc2ccccc2OCc2ccccc2)CC1 ZINC000432799005 1032821061 /nfs/dbraw/zinc/82/10/61/1032821061.db2.gz VCIVJOWBMMXLPY-NRFANRHFSA-N 2 0 338.495 4.182 20 0 EIADRP C[NH+](C)[C@@H]1CCC[N@H+](CCCc2ccc(C(F)(F)F)cc2)CC1 ZINC000683227151 1019542939 /nfs/dbraw/zinc/54/29/39/1019542939.db2.gz CCPLVWMVXCFVGI-QGZVFWFLSA-N 2 0 328.422 4.054 20 0 EIADRP CC(C)(CC[NH+]1CCC([NH+]2CCC(F)CC2)CC1)c1ccccc1 ZINC001208668100 1019557119 /nfs/dbraw/zinc/55/71/19/1019557119.db2.gz RCUQTENFAKDORG-UHFFFAOYSA-N 2 0 332.507 4.253 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cn2)cc1 ZINC000274904654 1019849103 /nfs/dbraw/zinc/84/91/03/1019849103.db2.gz LXBUWPIWSXXDSR-HNNXBMFYSA-N 2 0 331.891 4.428 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(CSC(F)F)o2)C1 ZINC000120621082 1019898129 /nfs/dbraw/zinc/89/81/29/1019898129.db2.gz FSBIYEHQFUWLFA-CQSZACIVSA-N 2 0 346.487 4.337 20 0 EIADRP CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547830237 1020775199 /nfs/dbraw/zinc/77/51/99/1020775199.db2.gz KLSCIUISJUWKSL-BHYGNILZSA-N 2 0 328.422 4.218 20 0 EIADRP Cc1ncc(C[NH+]2CCC3(CCC[N@@H+](C4CCCC4)C3)CC2)s1 ZINC001279420027 1020928229 /nfs/dbraw/zinc/92/82/29/1020928229.db2.gz YYLVSECGXIMOIE-UHFFFAOYSA-N 2 0 333.545 4.072 20 0 EIADRP Cc1ccc(-c2ncc(C[NH2+]C3CCC([NH+](C)C)CC3)s2)cc1C ZINC000655783338 1020959752 /nfs/dbraw/zinc/95/97/52/1020959752.db2.gz CPEUIRFQFNSCAM-UHFFFAOYSA-N 2 0 343.540 4.389 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655803778 1020974519 /nfs/dbraw/zinc/97/45/19/1020974519.db2.gz DNODXFHEDBLZGE-YESZJQIVSA-N 2 0 327.516 4.154 20 0 EIADRP CC(C)[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cccc(C(F)(F)F)c1 ZINC000655806095 1020976376 /nfs/dbraw/zinc/97/63/76/1020976376.db2.gz ZAESQOMBJDVRCN-XOKHGSTOSA-N 2 0 328.422 4.332 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2cc(Cl)ccc2OC2CCCC2)C1 ZINC000655827019 1020991664 /nfs/dbraw/zinc/99/16/64/1020991664.db2.gz NCMWZNMOIBFPAU-KDYLLFBJSA-N 2 0 336.907 4.091 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCSC(C)(C)C)CC1 ZINC001167305970 1020997276 /nfs/dbraw/zinc/99/72/76/1020997276.db2.gz AOZHFBHKCAEFKO-UHFFFAOYSA-N 2 0 334.573 4.362 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCCc3cc(Br)ccc32)cc1 ZINC000579960528 1021020162 /nfs/dbraw/zinc/02/01/62/1021020162.db2.gz YSXMGJDTUXKUMB-GOSISDBHSA-N 2 0 345.284 4.075 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cccc3cccnc32)c1 ZINC000340438432 1021027309 /nfs/dbraw/zinc/02/73/09/1021027309.db2.gz ZRVFSJYHXFHUHX-UHFFFAOYSA-N 2 0 333.479 4.365 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCCc3ccc(O)cc32)c1 ZINC000340473699 1021085997 /nfs/dbraw/zinc/08/59/97/1021085997.db2.gz KVYPJGNOQOXHLW-JOCHJYFZSA-N 2 0 338.495 4.401 20 0 EIADRP Cc1ccncc1[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000683691511 1021100269 /nfs/dbraw/zinc/10/02/69/1021100269.db2.gz YNVFDSFOHIZERQ-WLRLJWMZSA-N 2 0 335.495 4.236 20 0 EIADRP Clc1cccc(C2CC[NH+](Cc3cc4c(s3)CC[NH2+]C4)CC2)c1 ZINC001210518240 1021160536 /nfs/dbraw/zinc/16/05/36/1021160536.db2.gz DQYRUBXFNAWHPE-UHFFFAOYSA-N 2 0 346.927 4.427 20 0 EIADRP CC1CC[NH+](Cc2cccc(CNC(=[NH2+])Nc3ccccc3)c2)CC1 ZINC000066245850 1021562742 /nfs/dbraw/zinc/56/27/42/1021562742.db2.gz XUQLJQSEWROQSO-UHFFFAOYSA-N 2 0 336.483 4.055 20 0 EIADRP Cc1nc(C)c([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000272354298 1021643020 /nfs/dbraw/zinc/64/30/20/1021643020.db2.gz RCBQXHMQMONGAC-DOXZYTNZSA-N 2 0 343.540 4.321 20 0 EIADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000683816556 1021686595 /nfs/dbraw/zinc/68/65/95/1021686595.db2.gz SWOSAZKHECXURN-DYESRHJHSA-N 2 0 330.516 4.007 20 0 EIADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000683816559 1021688940 /nfs/dbraw/zinc/68/89/40/1021688940.db2.gz SWOSAZKHECXURN-LAUBAEHRSA-N 2 0 330.516 4.007 20 0 EIADRP CSC1(C[NH2+]Cc2ccc(-c3ccccc3F)o2)CC[NH+](C)CC1 ZINC000580134864 1021699148 /nfs/dbraw/zinc/69/91/48/1021699148.db2.gz YFUDEDBABAHZRK-UHFFFAOYSA-N 2 0 348.487 4.003 20 0 EIADRP c1c2ccccc2[nH]c1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000683926800 1021980290 /nfs/dbraw/zinc/98/02/90/1021980290.db2.gz OFQTXRWXPXBPHQ-UHFFFAOYSA-N 2 0 333.479 4.170 20 0 EIADRP COc1ccc2cc([C@@H](C)[NH2+]CC[C@H]3CCC[N@H+](C)C3)ccc2c1 ZINC000414171311 1022023465 /nfs/dbraw/zinc/02/34/65/1022023465.db2.gz DFFQWXZJZKMYHY-IAGOWNOFSA-N 2 0 326.484 4.231 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@H+](C)C2)c2ccccc12 ZINC000414173963 1022031530 /nfs/dbraw/zinc/03/15/30/1022031530.db2.gz HEMSHFWOHXDMIF-SJORKVTESA-N 2 0 326.484 4.231 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(Cl)ccc2OC)CC1 ZINC000613491916 1022165089 /nfs/dbraw/zinc/16/50/89/1022165089.db2.gz DQQZTCYNOPDMDA-UHFFFAOYSA-N 2 0 338.923 4.293 20 0 EIADRP CC(C)Oc1ccc(CC[C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000892630873 1022700392 /nfs/dbraw/zinc/70/03/92/1022700392.db2.gz KGYXLYSEOYINIC-VOBGVNJCSA-N 2 0 330.516 4.010 20 0 EIADRP c1nc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)sc1-c1ccccc1 ZINC000647542747 1022779124 /nfs/dbraw/zinc/77/91/24/1022779124.db2.gz BJFDCXQURDSEQC-ROUUACIJSA-N 2 0 341.524 4.022 20 0 EIADRP C[C@H]([NH2+]CCc1c(F)cccc1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000402101122 1022800987 /nfs/dbraw/zinc/80/09/87/1022800987.db2.gz VGCRZWLMUXDAJU-WMZOPIPTSA-N 2 0 344.449 4.008 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)cc1 ZINC000647553362 1022815648 /nfs/dbraw/zinc/81/56/48/1022815648.db2.gz WIDFMCQVUKEJOK-UHFFFAOYSA-N 2 0 328.765 4.107 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1c(Cl)cccc1Cl ZINC000647550811 1022816147 /nfs/dbraw/zinc/81/61/47/1022816147.db2.gz IUCWIMQEJMDGJG-AAVRWANBSA-N 2 0 327.299 4.075 20 0 EIADRP CC[C@@H](C)c1ccc([C@@H](C)[NH2+]CCCC[NH+]2CCN(CC)CC2)cc1 ZINC000623861782 1022877517 /nfs/dbraw/zinc/87/75/17/1022877517.db2.gz CHJIOPAQVVMQSB-WOJBJXKFSA-N 2 0 345.575 4.268 20 0 EIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CCC(C)(C)C1CC1)c1ccccc1O2 ZINC000582068795 1022922995 /nfs/dbraw/zinc/92/29/95/1022922995.db2.gz FLESHDBSMFQNKN-LJQANCHMSA-N 2 0 342.527 4.391 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+][C@@H]1CCSc2c(F)cccc21)c1ccccc1 ZINC000423495664 1022923972 /nfs/dbraw/zinc/92/39/72/1022923972.db2.gz CKEUZKPUJXUXIN-QZTJIDSGSA-N 2 0 330.472 4.432 20 0 EIADRP c1ccc(C[C@H]([NH2+]Cc2ccc3c(c2)C[NH2+]CC3)c2ccccc2)cc1 ZINC000581315842 1023008771 /nfs/dbraw/zinc/00/87/71/1023008771.db2.gz VLQJWYSKYQZIAV-DEOSSOPVSA-N 2 0 342.486 4.406 20 0 EIADRP CSC1(C[NH2+][C@H](C)c2cc3ccccc3s2)CC[NH+](C)CC1 ZINC000581340251 1023035606 /nfs/dbraw/zinc/03/56/06/1023035606.db2.gz MLQXJFDACGUHKW-CQSZACIVSA-N 2 0 334.554 4.379 20 0 EIADRP Cn1ccnc1C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1ccccc1 ZINC000656503614 1023074616 /nfs/dbraw/zinc/07/46/16/1023074616.db2.gz QMERIHDIAKUKIA-PCCBWWKXSA-N 2 0 331.463 4.097 20 0 EIADRP CSC1(C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)CC[NH+](C)CC1 ZINC000589349421 1023131000 /nfs/dbraw/zinc/13/10/00/1023131000.db2.gz REJIRRMSFFTAGY-GFCCVEGCSA-N 2 0 347.355 4.471 20 0 EIADRP C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2Cc2ccc(-c3ccccc3F)o2)C1 ZINC000584687838 1023189582 /nfs/dbraw/zinc/18/95/82/1023189582.db2.gz PXEIDOKANLTINQ-BEFAXECRSA-N 2 0 328.431 4.002 20 0 EIADRP Cc1nc(C)c(C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)s1 ZINC000310276138 1023233014 /nfs/dbraw/zinc/23/30/14/1023233014.db2.gz OLYHGDDVJKXFMU-IBGZPJMESA-N 2 0 343.540 4.152 20 0 EIADRP Cc1nc(C)c(C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)s1 ZINC000310276140 1023233476 /nfs/dbraw/zinc/23/34/76/1023233476.db2.gz OLYHGDDVJKXFMU-LJQANCHMSA-N 2 0 343.540 4.152 20 0 EIADRP C[C@H]([NH2+]CCc1nc(C2CCCCC2)cs1)C1CC[NH+](C)CC1 ZINC000090046555 1023289999 /nfs/dbraw/zinc/28/99/99/1023289999.db2.gz QSPJTERGTPJRHR-HNNXBMFYSA-N 2 0 335.561 4.053 20 0 EIADRP C[C@H](Cc1ccsc1)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000584760783 1023289907 /nfs/dbraw/zinc/28/99/07/1023289907.db2.gz GBWNMDLBEAGIFK-MSOLQXFVSA-N 2 0 342.552 4.364 20 0 EIADRP CCC[NH+]1CCC([NH2+]C[C@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000188147475 1023294346 /nfs/dbraw/zinc/29/43/46/1023294346.db2.gz MZDPTOFGFSROQP-AWEZNQCLSA-N 2 0 328.422 4.273 20 0 EIADRP CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](C)c2cccc(C[NH+](C)C)c2)c1 ZINC000924600426 1023332273 /nfs/dbraw/zinc/33/22/73/1023332273.db2.gz STNHVQYKPADABV-HOTGVXAUSA-N 2 0 339.483 4.118 20 0 EIADRP CCSc1ccc([C@H](C)[NH2+]CC2(SC)CC[NH+](C)CC2)cc1 ZINC000584811030 1023337889 /nfs/dbraw/zinc/33/78/89/1023337889.db2.gz YDESUNKNAJFDMC-HNNXBMFYSA-N 2 0 338.586 4.277 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000415040646 1023405109 /nfs/dbraw/zinc/40/51/09/1023405109.db2.gz PAUSTLLBVYWYPS-ZFVVBOAOSA-N 2 0 326.406 4.059 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1nc(-c2ccccc2)cs1)c1ccccc1 ZINC000415044006 1023406126 /nfs/dbraw/zinc/40/61/26/1023406126.db2.gz AATHSVDBKLBDKI-SFHVURJKSA-N 2 0 337.492 4.380 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1nc2ccc(F)cc2s1)c1ccccc1 ZINC000415055810 1023411799 /nfs/dbraw/zinc/41/17/99/1023411799.db2.gz OVHSENMYCYZVPL-OAHLLOKOSA-N 2 0 329.444 4.005 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cc(F)cc(C(F)(F)F)c1)c1ccccc1 ZINC000415061547 1023413061 /nfs/dbraw/zinc/41/30/61/1023413061.db2.gz YKHWGXQFXDTEPB-QGZVFWFLSA-N 2 0 340.364 4.414 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cnc(-c2ccccc2)s1)c1ccccc1 ZINC000415061469 1023414030 /nfs/dbraw/zinc/41/40/30/1023414030.db2.gz YEGKSRCIXNTWOF-LJQANCHMSA-N 2 0 337.492 4.380 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1cnc(-c2ccccc2)s1)c1ccccc1 ZINC000415061191 1023414095 /nfs/dbraw/zinc/41/40/95/1023414095.db2.gz YEGKSRCIXNTWOF-IBGZPJMESA-N 2 0 337.492 4.380 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000415075439 1023420700 /nfs/dbraw/zinc/42/07/00/1023420700.db2.gz FKNRKXONWKKBJQ-YQQAZPJKSA-N 2 0 343.540 4.466 20 0 EIADRP C[C@H](CC[NH2+]C[C@@H]1CC[NH2+][C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000415085928 1023435222 /nfs/dbraw/zinc/43/52/22/1023435222.db2.gz IZHGWLHZDSOXBZ-RBSFLKMASA-N 2 0 328.422 4.177 20 0 EIADRP CN1CC[C@H]([NH2+]CC(C)(C)Oc2ccccc2)C[C@@H]1c1ccccc1 ZINC000581621800 1023441379 /nfs/dbraw/zinc/44/13/79/1023441379.db2.gz HGAOZWZIEBGCFV-PZJWPPBQSA-N 2 0 338.495 4.269 20 0 EIADRP c1ccc(OC2CCCC2)c(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)c1 ZINC000415095478 1023441507 /nfs/dbraw/zinc/44/15/07/1023441507.db2.gz ZXIBBDKWFLAVJV-HSALFYBXSA-N 2 0 328.500 4.018 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Br)c(C)c2)C[C@H]1C ZINC000500088701 1023494860 /nfs/dbraw/zinc/49/48/60/1023494860.db2.gz FQDAPNMFPWXYDZ-ZBFHGGJFSA-N 2 0 339.321 4.062 20 0 EIADRP C[C@H](C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500118177 1023515546 /nfs/dbraw/zinc/51/55/46/1023515546.db2.gz SNSVTIFQPIFYKD-HFTRVMKXSA-N 2 0 340.433 4.225 20 0 EIADRP CCCC[N@H+](CCCN1CC[NH+](C(C)C)CC1)[C@@H](C)c1ccccc1 ZINC000500126503 1023519878 /nfs/dbraw/zinc/51/98/78/1023519878.db2.gz ARRAKNZKPFDWMK-NRFANRHFSA-N 2 0 345.575 4.266 20 0 EIADRP c1sc(-c2ccccc2)nc1C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656786257 1023527950 /nfs/dbraw/zinc/52/79/50/1023527950.db2.gz QYYUKPQVPIYOAI-SFHVURJKSA-N 2 0 341.524 4.022 20 0 EIADRP CO[C@H]1CCC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)C1 ZINC000684370754 1023541530 /nfs/dbraw/zinc/54/15/30/1023541530.db2.gz BBCMQYGSETWIEE-RTWAWAEBSA-N 2 0 330.516 4.110 20 0 EIADRP CCCCOc1cc(C[NH+]2CCC(CC[NH+](C)C)CC2)ccc1OC ZINC000511525932 1023608820 /nfs/dbraw/zinc/60/88/20/1023608820.db2.gz XFSUBKZDFDXFFS-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2c(c1)CCC2 ZINC000398017874 1023642830 /nfs/dbraw/zinc/64/28/30/1023642830.db2.gz IIXQUYISKOXQAP-MBSDFSHPSA-N 2 0 334.507 4.176 20 0 EIADRP Cc1ccc([C@@H](C2CC2)[N@@H+](C)C2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000377650846 1023652938 /nfs/dbraw/zinc/65/29/38/1023652938.db2.gz NZLVYDRVOSWXDI-QFIPXVFZSA-N 2 0 342.527 4.021 20 0 EIADRP Clc1ccc(CNC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)o1 ZINC000390554774 1023671354 /nfs/dbraw/zinc/67/13/54/1023671354.db2.gz LBBOPCHPVSTCGI-ALOPSCKCSA-N 2 0 330.859 4.218 20 0 EIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)[C@H]3C=CCCCCC3)CC2)CC1 ZINC000559107719 1023734114 /nfs/dbraw/zinc/73/41/14/1023734114.db2.gz SKOQEVTVQAAMII-NRFANRHFSA-N 3 0 347.591 4.003 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](CC)c2ccc(Br)cc2)CC1 ZINC000020189828 1023746322 /nfs/dbraw/zinc/74/63/22/1023746322.db2.gz BKHOJJCLNJZXLR-KRWDZBQOSA-N 2 0 339.321 4.364 20 0 EIADRP c1cc2c(cccc2C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)[nH]1 ZINC000236659610 1023750407 /nfs/dbraw/zinc/75/04/07/1023750407.db2.gz PVLWZYBVOKAOBK-UHFFFAOYSA-N 2 0 333.479 4.444 20 0 EIADRP CCC[NH+]1CCC([N@H+](C)Cc2ccc3cc(OC)ccc3c2)CC1 ZINC000510467911 1023760766 /nfs/dbraw/zinc/76/07/66/1023760766.db2.gz UKKKWTBWEGJJNN-UHFFFAOYSA-N 2 0 326.484 4.155 20 0 EIADRP CSc1ccc([C@@H](C)[NH2+]Cc2cn(-c3cc[nH+]cc3)nc2C)cc1 ZINC000341479670 1023810689 /nfs/dbraw/zinc/81/06/89/1023810689.db2.gz GMSWNJCDZVSSNU-CQSZACIVSA-N 2 0 338.480 4.148 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cccc(Br)c1 ZINC000130225279 1023932721 /nfs/dbraw/zinc/93/27/21/1023932721.db2.gz YTXFOVKGNLZJLO-ZACQAIPSSA-N 2 0 337.305 4.117 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CC[C@@H]3C3CCC3)CC2)cc1 ZINC000510666493 1024198834 /nfs/dbraw/zinc/19/88/34/1024198834.db2.gz PEXHESCOEGRYRZ-YADHBBJMSA-N 2 0 342.527 4.076 20 0 EIADRP Cc1cc(OCCC[C@H](C)[NH2+]CC2=CC[N@H+](C)CC2)ccc1Cl ZINC000510711445 1024280836 /nfs/dbraw/zinc/28/08/36/1024280836.db2.gz COXMMVPJNFMTPI-INIZCTEOSA-N 2 0 336.907 4.047 20 0 EIADRP Cc1cc(OCCC[C@H](C)[NH2+]CC2CC[NH+](C)CC2)ccc1Cl ZINC000510747012 1024388323 /nfs/dbraw/zinc/38/83/23/1024388323.db2.gz GBUOFABSLQHCCB-INIZCTEOSA-N 2 0 338.923 4.127 20 0 EIADRP C[C@@H]([NH2+]C1(c2ccc(C(F)(F)F)cc2)CC1)C1CC[NH+](C)CC1 ZINC000652329630 1024615648 /nfs/dbraw/zinc/61/56/48/1024615648.db2.gz BVECMFSXNAAKMG-CYBMUJFWSA-N 2 0 326.406 4.014 20 0 EIADRP Oc1cccc2c(NC3CC[NH+](C4CCCCC4)CC3)cc[nH+]c12 ZINC000684574619 1024826857 /nfs/dbraw/zinc/82/68/57/1024826857.db2.gz KCRLUSFAEKZYEP-UHFFFAOYSA-N 2 0 325.456 4.149 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(c2cc[nH+]c3c(O)cccc23)C1 ZINC000684575021 1024828276 /nfs/dbraw/zinc/82/82/76/1024828276.db2.gz IZRMWAWKYAIKLM-IRXDYDNUSA-N 2 0 339.483 4.031 20 0 EIADRP Cc1ccc(C[C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000548483353 1024829793 /nfs/dbraw/zinc/82/97/93/1024829793.db2.gz NPJZKVMHVJGIBO-ILZDJORESA-N 2 0 342.552 4.488 20 0 EIADRP CC(C)c1ccc(OC2CC[NH+](CC[C@H]3CCC[N@@H+]3C)CC2)cc1 ZINC000535765563 1024923212 /nfs/dbraw/zinc/92/32/12/1024923212.db2.gz VYYNVVSOFLIVNZ-LJQANCHMSA-N 2 0 330.516 4.138 20 0 EIADRP Clc1cccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000063551883 1024937911 /nfs/dbraw/zinc/93/79/11/1024937911.db2.gz GKULXSXSUPAOOS-UHFFFAOYSA-N 2 0 328.887 4.342 20 0 EIADRP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1cccc(Cl)c1Cl ZINC000662279685 1025024735 /nfs/dbraw/zinc/02/47/35/1025024735.db2.gz AXGXEVUSRGAVJL-LBPRGKRZSA-N 2 0 335.278 4.490 20 0 EIADRP C[C@H](c1ccc(OC(F)F)cc1)[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662295866 1025049554 /nfs/dbraw/zinc/04/95/54/1025049554.db2.gz IIEDUBYJKJMPJO-PBHICJAKSA-N 2 0 338.442 4.061 20 0 EIADRP CC1=Nc2ccc3cc(NC(=[NH2+])SCC[NH3+])ccc3c2C1(C)C ZINC001167913799 1025346003 /nfs/dbraw/zinc/34/60/03/1025346003.db2.gz DSKXOQMFMVEHAO-UHFFFAOYSA-N 2 0 326.469 4.262 20 0 EIADRP Cc1cccc(C)c1OC[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167965884 1025545880 /nfs/dbraw/zinc/54/58/80/1025545880.db2.gz PFJXIDPOGINIQG-XSLAUPDRSA-N 2 0 342.527 4.066 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@@H](Oc2cccc(OC)c2)C1 ZINC001167824729 1025586865 /nfs/dbraw/zinc/58/68/65/1025586865.db2.gz FZDOOYYTJGQFCV-WIYYLYMNSA-N 2 0 348.531 4.049 20 0 EIADRP Clc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCc3nccn3C1)CCCS2 ZINC000278933299 1025721890 /nfs/dbraw/zinc/72/18/90/1025721890.db2.gz JKFFDRZDYKGTDT-CJNGLKHVSA-N 2 0 347.915 4.316 20 0 EIADRP CC[C@H](c1ccccc1)[NH+]1CCN(C[C@@H]2CCCC[N@@H+]2C(C)C)CC1 ZINC001167508353 1025753249 /nfs/dbraw/zinc/75/32/49/1025753249.db2.gz GQPYXPHHLCLNTL-FCHUYYIVSA-N 2 0 343.559 4.018 20 0 EIADRP c1cc(C[NH2+]C2CCC(c3ccccc3)CC2)n(-c2cc[nH+]cc2)n1 ZINC000657300128 1025802229 /nfs/dbraw/zinc/80/22/29/1025802229.db2.gz IWIXVNBOWWHCBP-UHFFFAOYSA-N 2 0 332.451 4.083 20 0 EIADRP Fc1ccc(/C=C/C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1F ZINC000512031833 1025802724 /nfs/dbraw/zinc/80/27/24/1025802724.db2.gz RETKJGKDSFJANE-SNAWJCMRSA-N 2 0 334.454 4.365 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]C/C=C/c2ccc(F)c(F)c2)c1 ZINC000512036363 1025816908 /nfs/dbraw/zinc/81/69/08/1025816908.db2.gz HQAXKJMEXSTOSF-VMPITWQZSA-N 2 0 330.422 4.220 20 0 EIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000511046584 1025839430 /nfs/dbraw/zinc/83/94/30/1025839430.db2.gz KXVCVIZZTZZZJF-HNNXBMFYSA-N 2 0 342.449 4.348 20 0 EIADRP FC1(F)CCCC[C@@H]1C[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000390919439 1025898879 /nfs/dbraw/zinc/89/88/79/1025898879.db2.gz WEYPNTXOXWLJLP-GOSISDBHSA-N 2 0 336.470 4.109 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]CCC1CC[NH+](C)CC1 ZINC000431334985 1025974857 /nfs/dbraw/zinc/97/48/57/1025974857.db2.gz USQBVZZTVURFEG-HXUWFJFHSA-N 2 0 330.516 4.345 20 0 EIADRP C[N@H+](CCc1cccs1)Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001167540254 1025995319 /nfs/dbraw/zinc/99/53/19/1025995319.db2.gz XJRQSQHLUUBWCD-UHFFFAOYSA-N 2 0 328.525 4.409 20 0 EIADRP c1ccc(-c2cccnc2)c(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167971284 1026055671 /nfs/dbraw/zinc/05/56/71/1026055671.db2.gz WBDPCQJAKQNISU-FRIKZZABSA-N 2 0 347.506 4.244 20 0 EIADRP FC(F)(F)C1CCC(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167971524 1026076105 /nfs/dbraw/zinc/07/61/05/1026076105.db2.gz XFZMVLOUTWEKSS-DWVVOELRSA-N 2 0 344.465 4.350 20 0 EIADRP C[N@H+](Cc1ccc(-n2ccnc2)cc1)C1CCC(C(F)(F)F)CC1 ZINC000344169127 1026090605 /nfs/dbraw/zinc/09/06/05/1026090605.db2.gz OBUIRGXPQHFENU-UHFFFAOYSA-N 2 0 337.389 4.425 20 0 EIADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000111410886 1026161616 /nfs/dbraw/zinc/16/16/16/1026161616.db2.gz NFMPXXPDUHIVOB-VGOFRKELSA-N 2 0 338.495 4.040 20 0 EIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3cccc4[nH]ccc43)C2)CC1 ZINC000512165858 1026193662 /nfs/dbraw/zinc/19/36/62/1026193662.db2.gz IBJLHYRGKYPQCJ-SFHVURJKSA-N 2 0 325.500 4.112 20 0 EIADRP Fc1ccc(CC2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)cc1 ZINC001167975212 1026225046 /nfs/dbraw/zinc/22/50/46/1026225046.db2.gz MJKJKGPUFAKCPK-SEJPIABJSA-N 2 0 342.502 4.143 20 0 EIADRP Cc1nc2c(s1)[C@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CCC2 ZINC000162930362 1026329076 /nfs/dbraw/zinc/32/90/76/1026329076.db2.gz NTJRAMOGRJNWEP-GOSISDBHSA-N 2 0 341.524 4.215 20 0 EIADRP CC[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)cc1 ZINC000320102670 1026349541 /nfs/dbraw/zinc/34/95/41/1026349541.db2.gz QLAHILMXKGENAS-IBGZPJMESA-N 2 0 329.875 4.445 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccccc2F)CC1 ZINC000514097742 1026383985 /nfs/dbraw/zinc/38/39/85/1026383985.db2.gz ANHZAWMHYRJYFN-UHFFFAOYSA-N 2 0 326.459 4.359 20 0 EIADRP COc1ccc2cc(C[NH+]3CCC(C[NH+]4CCCC4)CC3)ccc2c1 ZINC000506932721 1026534645 /nfs/dbraw/zinc/53/46/45/1026534645.db2.gz ZANLZQWYRQTCON-UHFFFAOYSA-N 2 0 338.495 4.156 20 0 EIADRP c1ccc(C(C[NH+]2CCC([NH+]3CCCC3)CC2)c2ccccc2)cc1 ZINC000507118575 1026649222 /nfs/dbraw/zinc/64/92/22/1026649222.db2.gz CWOVRYQTXVEEIK-UHFFFAOYSA-N 2 0 334.507 4.379 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2ccc(C(F)(F)F)cc2)CC[NH+](C)CC1 ZINC000582517283 1026744688 /nfs/dbraw/zinc/74/46/88/1026744688.db2.gz UYPYKISWXBCDJJ-ZDUSSCGKSA-N 2 0 346.462 4.183 20 0 EIADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511148315 1026751361 /nfs/dbraw/zinc/75/13/61/1026751361.db2.gz XOKFCLNKPINFAN-AEFFLSMTSA-N 2 0 340.433 4.369 20 0 EIADRP [NH3+][C@@H]1C[C@@H](NC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)c2ccccc21 ZINC000261629375 1026757207 /nfs/dbraw/zinc/75/72/07/1026757207.db2.gz VTYNMQHREBQRHS-WWPVKYPJSA-N 2 0 349.522 4.023 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@@H]1C[C@@H](C(C)C)c2ccccc21 ZINC000582540450 1026768351 /nfs/dbraw/zinc/76/83/51/1026768351.db2.gz IGTKRZDRGMQTDZ-YHEJKZAPSA-N 2 0 337.511 4.426 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+][C@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000507483400 1026812375 /nfs/dbraw/zinc/81/23/75/1026812375.db2.gz RKZJLCLIGPTBCA-NRFANRHFSA-N 2 0 349.478 4.239 20 0 EIADRP CCc1cccnc1[C@@H](C)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000507528585 1026829668 /nfs/dbraw/zinc/82/96/68/1026829668.db2.gz OCFGQBLPGYLLFH-QHGAOEGBSA-N 2 0 329.532 4.338 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@@H]3CCCc4cccnc43)cc2)C1 ZINC000684954077 1026888785 /nfs/dbraw/zinc/88/87/85/1026888785.db2.gz PJDFCSLTKCFGES-PGRDOPGGSA-N 2 0 349.522 4.481 20 0 EIADRP CC[NH+](CC)CCO[C@H]1CC[N@@H+]([C@@H](C)c2c(C)cc(C)cc2C)C1 ZINC001167603778 1026993359 /nfs/dbraw/zinc/99/33/59/1026993359.db2.gz ZQDGHSMBHIROQW-PMACEKPBSA-N 2 0 332.532 4.106 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)C[NH+]1CCCC1 ZINC000474600112 1027288666 /nfs/dbraw/zinc/28/86/66/1027288666.db2.gz UIQPZCKZDSNJLO-ZQDZILKHSA-N 2 0 326.937 4.215 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@H](C)[C@@H](C)c2ccc(OC)c(OC)c2)CC1 ZINC000474614530 1027310110 /nfs/dbraw/zinc/31/01/10/1027310110.db2.gz WVNCGQDHBATZNY-IAGOWNOFSA-N 2 0 348.531 4.050 20 0 EIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2)cc1Cl ZINC000564988436 1027447972 /nfs/dbraw/zinc/44/79/72/1027447972.db2.gz HBXLDFOCTNSWHE-CQSZACIVSA-N 2 0 332.875 4.437 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2ccc3c(n2)CCC3)cc1 ZINC000582830972 1027455141 /nfs/dbraw/zinc/45/51/41/1027455141.db2.gz APKKUZPSHJWDOY-SFHVURJKSA-N 2 0 349.522 4.235 20 0 EIADRP CC(C)O[C@H](C[NH+]1CCC(CCC[NH+](C)C)CC1)c1ccccc1 ZINC000428303587 1027554779 /nfs/dbraw/zinc/55/47/79/1027554779.db2.gz SURSQGUARCPGJY-OAQYLSRUSA-N 2 0 332.532 4.207 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(F)cc1F ZINC000112518275 1027579788 /nfs/dbraw/zinc/57/97/88/1027579788.db2.gz SWOTYZJFORZLEY-OAHLLOKOSA-N 2 0 330.422 4.411 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(F)cc1F ZINC000112518273 1027581069 /nfs/dbraw/zinc/58/10/69/1027581069.db2.gz SWOTYZJFORZLEY-HNNXBMFYSA-N 2 0 330.422 4.411 20 0 EIADRP Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000582905796 1027650657 /nfs/dbraw/zinc/65/06/57/1027650657.db2.gz RIKINIDHRTZLGC-GOSISDBHSA-N 2 0 330.859 4.111 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1OC ZINC000152465876 1027659469 /nfs/dbraw/zinc/65/94/69/1027659469.db2.gz LGEWIZXJLJYNJQ-IRXDYDNUSA-N 2 0 346.515 4.009 20 0 EIADRP c1ccc(CC(Cc2ccccc2)[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000475570630 1027661054 /nfs/dbraw/zinc/66/10/54/1027661054.db2.gz CNJZUOIBANMDRO-UHFFFAOYSA-N 2 0 348.534 4.447 20 0 EIADRP COc1ccc([C@@H](C)[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167995134 1027741043 /nfs/dbraw/zinc/74/10/43/1027741043.db2.gz XJSCPQUYZLSESJ-AZCLRUCKSA-N 2 0 328.500 4.093 20 0 EIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1 ZINC000474892986 1027746826 /nfs/dbraw/zinc/74/68/26/1027746826.db2.gz VXWLFKQJZKSFSH-DLBZAZTESA-N 2 0 326.484 4.039 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)C1CCSCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000474942044 1027808541 /nfs/dbraw/zinc/80/85/41/1027808541.db2.gz KKSJKFHPEWBXPL-SQGPQFPESA-N 2 0 332.557 4.018 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc(-c4ccsc4)cc3)CC[C@H]21 ZINC001167648122 1027842320 /nfs/dbraw/zinc/84/23/20/1027842320.db2.gz RIYKVYBVUJUIQP-UYAOXDASSA-N 2 0 326.509 4.331 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+]Cc2cc(C(F)(F)F)ccc2Cl)cc1 ZINC000583025309 1027857415 /nfs/dbraw/zinc/85/74/15/1027857415.db2.gz VIMKLVDTFRQWGC-UHFFFAOYSA-N 2 0 328.765 4.107 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000548786339 1027930489 /nfs/dbraw/zinc/93/04/89/1027930489.db2.gz KJQZTKGRJGTALY-IZNAZMGOSA-N 2 0 340.433 4.429 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000548786335 1027932118 /nfs/dbraw/zinc/93/21/18/1027932118.db2.gz KJQZTKGRJGTALY-AAGJOFLKSA-N 2 0 340.433 4.429 20 0 EIADRP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+]CCC1CC[NH+](C)CC1 ZINC000583077052 1027962682 /nfs/dbraw/zinc/96/26/82/1027962682.db2.gz WJBPYNMVZWIODK-NTCAYCPXSA-N 2 0 340.433 4.430 20 0 EIADRP Cc1cccc([C@@H](O)C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)c1 ZINC001167660091 1028269362 /nfs/dbraw/zinc/26/93/62/1028269362.db2.gz ZFKIRFZPWGYURR-UGKGYDQZSA-N 2 0 344.543 4.005 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](Cc1cccs1)C(C)C ZINC000346169350 1028306100 /nfs/dbraw/zinc/30/61/00/1028306100.db2.gz JDBHDZCGGPZXER-UHFFFAOYSA-N 2 0 326.469 4.048 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@@H](C[NH2+][C@@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000280995068 1028315360 /nfs/dbraw/zinc/31/53/60/1028315360.db2.gz XETVQZPTLZQUOZ-NZQKXSOJSA-N 2 0 349.522 4.077 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@@H](C[NH2+][C@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000280995075 1028316533 /nfs/dbraw/zinc/31/65/33/1028316533.db2.gz XETVQZPTLZQUOZ-REWPJTCUSA-N 2 0 349.522 4.077 20 0 EIADRP CC[NH+](CC)Cc1ccc(CN[C@@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000125615158 1028439601 /nfs/dbraw/zinc/43/96/01/1028439601.db2.gz VLLIAVCCRQGRMG-OAQYLSRUSA-N 2 0 348.494 4.131 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)CC[N@@H+]1C ZINC000443983774 1028690747 /nfs/dbraw/zinc/69/07/47/1028690747.db2.gz FXZFFQDJODLJKW-CRAIPNDOSA-N 2 0 328.431 4.190 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccc(Oc2ccccc2)cn1 ZINC000635004915 1028816026 /nfs/dbraw/zinc/81/60/26/1028816026.db2.gz KNRMZCXWOWMFFB-ULQDDVLXSA-N 2 0 325.456 4.042 20 0 EIADRP C[C@H]([NH2+]CCSCc1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000192637958 1028859923 /nfs/dbraw/zinc/85/99/23/1028859923.db2.gz MMFSLYUYMOXJKV-HKUYNNGSSA-N 2 0 332.557 4.162 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)CCc1ccc(OC(F)F)cc1 ZINC000650719123 1028879153 /nfs/dbraw/zinc/87/91/53/1028879153.db2.gz DTYYDFQSQDDRQH-HNNXBMFYSA-N 2 0 348.437 4.118 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2sc(-c3ccccc3)nc2C)C1 ZINC000163286592 1028953496 /nfs/dbraw/zinc/95/34/96/1028953496.db2.gz KPILKJDLKVOZQB-GOEBONIOSA-N 2 0 329.513 4.111 20 0 EIADRP C[C@@H]1CC([N@@H+]2CC[C@H](c3ccccn3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168051811 1029064783 /nfs/dbraw/zinc/06/47/83/1029064783.db2.gz ISBVQZHYSFCBEA-SBHAEUEKSA-N 2 0 349.522 4.313 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000650746022 1029079218 /nfs/dbraw/zinc/07/92/18/1029079218.db2.gz UJTZCKUTJAEJTC-NRFANRHFSA-N 2 0 349.453 4.182 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)CCCS2 ZINC000650755066 1029187243 /nfs/dbraw/zinc/18/72/43/1029187243.db2.gz XRVCERKZRQOWRV-SFHVURJKSA-N 2 0 346.471 4.010 20 0 EIADRP C[NH2+]Cc1ccccc1CNC1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000650755751 1029193655 /nfs/dbraw/zinc/19/36/55/1029193655.db2.gz LWLZCRLNQQBYHU-UHFFFAOYSA-N 2 0 345.575 4.175 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2cccc3ccccc32)CC[NH+](C)CC1 ZINC000583987274 1029465377 /nfs/dbraw/zinc/46/53/77/1029465377.db2.gz KDWOYKAAYASYCY-INIZCTEOSA-N 2 0 328.525 4.318 20 0 EIADRP C[C@@H](CCc1ccccc1F)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475279232 1029487460 /nfs/dbraw/zinc/48/74/60/1029487460.db2.gz XQWNNSPMYHPYEI-AZUAARDMSA-N 2 0 340.486 4.259 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC000475281261 1029497008 /nfs/dbraw/zinc/49/70/08/1029497008.db2.gz PWKAYWQMCYOSJW-AEFFLSMTSA-N 2 0 336.470 4.312 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H]2CCCSc3ccc(OC)cc32)CC1 ZINC000446828427 1029595097 /nfs/dbraw/zinc/59/50/97/1029595097.db2.gz UQBJWSDJKSUDTK-IBGZPJMESA-N 2 0 348.556 4.334 20 0 EIADRP C[C@@H]([NH+](C)Cc1cncc(C[N@@H+](C)[C@H](C)C2(C)CC2)c1)C1(C)CC1 ZINC000584094449 1029612725 /nfs/dbraw/zinc/61/27/25/1029612725.db2.gz PTPUIXZKJKSSLE-IAGOWNOFSA-N 2 0 329.532 4.322 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CCC[C@@H](C(F)F)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168064290 1029627670 /nfs/dbraw/zinc/62/76/70/1029627670.db2.gz PSUSMUZAAHPBMS-UKBAYJJMSA-N 2 0 336.470 4.405 20 0 EIADRP Fc1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)c(Cl)c1Cl ZINC000446888325 1029631760 /nfs/dbraw/zinc/63/17/60/1029631760.db2.gz GTRXMXPVIBOLHX-UHFFFAOYSA-N 2 0 331.262 4.097 20 0 EIADRP Clc1ccccc1[C@@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446885404 1029632012 /nfs/dbraw/zinc/63/20/12/1029632012.db2.gz WHEKTEKXEDMGHL-ICSRJNTNSA-N 2 0 332.919 4.440 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446887189 1029632221 /nfs/dbraw/zinc/63/22/21/1029632221.db2.gz PDLPJMMKHPQOEO-CQSZACIVSA-N 2 0 340.433 4.100 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCc3c2cccc3F)cc1 ZINC000325282988 1029633009 /nfs/dbraw/zinc/63/30/09/1029633009.db2.gz PDSDQNJIQHXNNW-NRFANRHFSA-N 2 0 326.459 4.445 20 0 EIADRP Clc1ccc([C@H]2CCC[C@H]2[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446887700 1029634133 /nfs/dbraw/zinc/63/41/33/1029634133.db2.gz XIRYYRJFKMFDON-WOJBJXKFSA-N 2 0 332.919 4.440 20 0 EIADRP CC(C)[C@H](COCc1ccccc1)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000446929549 1029643762 /nfs/dbraw/zinc/64/37/62/1029643762.db2.gz RBCAQQYZJBSYTQ-QFIPXVFZSA-N 2 0 344.543 4.224 20 0 EIADRP FC(F)(F)C1CCC([NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000192927823 1029648375 /nfs/dbraw/zinc/64/83/75/1029648375.db2.gz NHHDXNSBWWBEIS-WWDZGPRUSA-N 2 0 340.433 4.219 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000447019358 1029671311 /nfs/dbraw/zinc/67/13/11/1029671311.db2.gz WVIYYAZRWKQWJO-CYBMUJFWSA-N 2 0 342.405 4.110 20 0 EIADRP CC(C)[NH+]1CCC([N@H+](C)CCn2ccc3cc(Cl)ccc32)CC1 ZINC000584200847 1029671842 /nfs/dbraw/zinc/67/18/42/1029671842.db2.gz QYIKECADCRIRKM-UHFFFAOYSA-N 2 0 333.907 4.099 20 0 EIADRP Cc1cnccc1OC1CCN(Cc2cnc(C(C)(C)C)s2)CC1 ZINC000447086049 1029683485 /nfs/dbraw/zinc/68/34/85/1029683485.db2.gz LJDBJXRHTNEPAB-UHFFFAOYSA-N 2 0 345.512 4.187 20 0 EIADRP Cc1cnccc1OC1CC[NH+](Cc2cccn2CCC(C)C)CC1 ZINC000447087338 1029683642 /nfs/dbraw/zinc/68/36/42/1029683642.db2.gz OWFOQZBFCWPVBG-UHFFFAOYSA-N 2 0 341.499 4.281 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(C(F)F)nc1 ZINC000657838544 1029721112 /nfs/dbraw/zinc/72/11/12/1029721112.db2.gz VOJBHEFZJPIAHQ-GJZGRUSLSA-N 2 0 325.447 4.324 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(C(F)F)nc1 ZINC000657838542 1029721894 /nfs/dbraw/zinc/72/18/94/1029721894.db2.gz VOJBHEFZJPIAHQ-CABCVRRESA-N 2 0 325.447 4.324 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cc2ccncc2s1 ZINC000657837988 1029733311 /nfs/dbraw/zinc/73/33/11/1029733311.db2.gz LTXXPTONJRQIOW-CVEARBPZSA-N 2 0 331.529 4.459 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1cccc(C2CC2)c1 ZINC000708502473 1029742980 /nfs/dbraw/zinc/74/29/80/1029742980.db2.gz HNSCXKKPRRKWIP-WZONZLPQSA-N 2 0 334.507 4.422 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNCc1ccccc1Cl ZINC000708519858 1029743034 /nfs/dbraw/zinc/74/30/34/1029743034.db2.gz KCVXAEZIGVYGHM-VQIMIIECSA-N 2 0 328.887 4.198 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000657841282 1029754705 /nfs/dbraw/zinc/75/47/05/1029754705.db2.gz OPFNPJMHCNKEAE-OCCSQVGLSA-N 2 0 348.840 4.221 20 0 EIADRP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000657840126 1029756409 /nfs/dbraw/zinc/75/64/09/1029756409.db2.gz MGTNJZLLVVUNOZ-SQNIBIBYSA-N 2 0 340.433 4.243 20 0 EIADRP Cc1ccnc(N[C@@H]2CC[N@H+](Cc3ccc(C(F)(F)F)cc3)C2)c1 ZINC000301632377 1029777260 /nfs/dbraw/zinc/77/72/60/1029777260.db2.gz JQKSMMRSCSKSNB-MRXNPFEDSA-N 2 0 335.373 4.095 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCOc3cc(F)ccc32)c1 ZINC000182062686 1029934444 /nfs/dbraw/zinc/93/44/44/1029934444.db2.gz DUCRFHJDLILIEK-HXUWFJFHSA-N 2 0 342.458 4.281 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](c3ccccc3)C2)[C@@H](C)C1 ZINC000525860286 1030082783 /nfs/dbraw/zinc/08/27/83/1030082783.db2.gz REHZEMRASDYTNT-UVUJQTEASA-N 2 0 344.543 4.049 20 0 EIADRP C[C@H](CCc1ccco1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447522309 1030117839 /nfs/dbraw/zinc/11/78/39/1030117839.db2.gz QDISWBXQPROLSE-WLRLJWMZSA-N 2 0 338.495 4.386 20 0 EIADRP C[C@@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000657875696 1030144357 /nfs/dbraw/zinc/14/43/57/1030144357.db2.gz HSGZOLSWTBAQGI-JSGCOSHPSA-N 2 0 348.840 4.221 20 0 EIADRP FC1(F)CC[C@H](C[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC000450981579 1030156505 /nfs/dbraw/zinc/15/65/05/1030156505.db2.gz IYLQQWYUBYFUKN-RBUKOAKNSA-N 2 0 334.454 4.020 20 0 EIADRP Clc1ccc2c(c1Cl)CC[C@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447574942 1030161296 /nfs/dbraw/zinc/16/12/96/1030161296.db2.gz XFQMZPFWBCYYDV-QGZVFWFLSA-N 2 0 339.310 4.445 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]Cc2ccc4c(c2)COC4)C3)cc1 ZINC000447587131 1030188207 /nfs/dbraw/zinc/18/82/07/1030188207.db2.gz OWKTWBABVZFFNF-NUNAXRQHSA-N 2 0 348.490 4.002 20 0 EIADRP C[C@H]([NH2+]Cc1cnccc1C(C)(C)C)c1cccc(C[NH+](C)C)c1 ZINC000926581865 1030196570 /nfs/dbraw/zinc/19/65/70/1030196570.db2.gz HBDAEIVCWUIFLF-INIZCTEOSA-N 2 0 325.500 4.292 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530217581 1030223176 /nfs/dbraw/zinc/22/31/76/1030223176.db2.gz UFJLZDBAGCGITE-DNVCBOLYSA-N 2 0 325.500 4.098 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]C2CC(c3cc(F)cc(F)c3)C2)C1 ZINC000685421385 1030299076 /nfs/dbraw/zinc/29/90/76/1030299076.db2.gz CSCKROIEMRIMPL-FVWXCPNNSA-N 2 0 336.470 4.313 20 0 EIADRP C[C@H](CC[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1)c1ccccc1 ZINC000447735317 1030313944 /nfs/dbraw/zinc/31/39/44/1030313944.db2.gz CVXCFBZANCNWSL-VAMGGRTRSA-N 2 0 344.543 4.001 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+]CCCCc2ccc(Cl)c(Cl)c2)C1 ZINC000526978238 1030356186 /nfs/dbraw/zinc/35/61/86/1030356186.db2.gz KANQTKUOZUCMIC-HNNXBMFYSA-N 2 0 329.315 4.248 20 0 EIADRP CC[C@@H]([NH2+]CCc1cncn1C)c1ccc(Oc2ccccc2)cc1 ZINC000530407317 1030378973 /nfs/dbraw/zinc/37/89/73/1030378973.db2.gz PRWXJBSSSMHNFG-OAQYLSRUSA-N 2 0 335.451 4.496 20 0 EIADRP Cc1ccc(C[C@@H]([NH2+]CCc2cncn2C)c2ccc(C)cc2)cc1 ZINC000530513311 1030502759 /nfs/dbraw/zinc/50/27/59/1030502759.db2.gz FUXBJSWQEFVWJW-JOCHJYFZSA-N 2 0 333.479 4.153 20 0 EIADRP CSc1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000685621682 1030575014 /nfs/dbraw/zinc/57/50/14/1030575014.db2.gz UHOMEKIUUAFIRS-INIZCTEOSA-N 2 0 332.538 4.082 20 0 EIADRP COCC1(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CCCCC1 ZINC000685665275 1030663398 /nfs/dbraw/zinc/66/33/98/1030663398.db2.gz QERVGKLNGHBMDL-TZIWHRDSSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccc2cc[nH]c21 ZINC000398167214 1030720070 /nfs/dbraw/zinc/72/00/70/1030720070.db2.gz TZNXXSQHOVWSQK-UTKZUKDTSA-N 2 0 333.479 4.168 20 0 EIADRP c1cc(C[NH+]2CCC(C[NH2+][C@H]3CCCC34CCCCC4)CC2)ccn1 ZINC000658161867 1030858366 /nfs/dbraw/zinc/85/83/66/1030858366.db2.gz BGVOHIMBNAZFGZ-NRFANRHFSA-N 2 0 341.543 4.386 20 0 EIADRP C[C@H](CCCC(F)(F)F)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658164963 1030861396 /nfs/dbraw/zinc/86/13/96/1030861396.db2.gz GVYHIXSUFORPFT-OAHLLOKOSA-N 2 0 343.437 4.004 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CCc2cc(Cl)ccc21 ZINC000527797969 1030862281 /nfs/dbraw/zinc/86/22/81/1030862281.db2.gz VAJYKVLWAQGGGC-LJQANCHMSA-N 2 0 338.842 4.006 20 0 EIADRP CCC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccsc1 ZINC000658167513 1030864981 /nfs/dbraw/zinc/86/49/81/1030864981.db2.gz SMMWXYJBASGITM-FQEVSTJZSA-N 2 0 343.540 4.486 20 0 EIADRP CC(C)[C@H]1CCCC[C@@H]1[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658168349 1030866554 /nfs/dbraw/zinc/86/65/54/1030866554.db2.gz WFJMFANYZRDFMI-RTWAWAEBSA-N 2 0 329.532 4.098 20 0 EIADRP C[C@@H]([NH2+]C1CCC2(CC2(F)F)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000658265792 1030919554 /nfs/dbraw/zinc/91/95/54/1030919554.db2.gz PXOAUMDXURDDIG-OVZGMEQFSA-N 2 0 348.481 4.455 20 0 EIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@H]3CCCSCC3)C3(CCC3)C2)cc1 ZINC000658318854 1030977771 /nfs/dbraw/zinc/97/77/71/1030977771.db2.gz SYJIGFXSIYEVLD-PMACEKPBSA-N 2 0 344.568 4.164 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccncc1 ZINC000658319280 1030981654 /nfs/dbraw/zinc/98/16/54/1030981654.db2.gz YWDQQYRVJZEESP-YADHBBJMSA-N 2 0 349.522 4.425 20 0 EIADRP COc1cc([C@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)ccc1SC ZINC000658357716 1031028226 /nfs/dbraw/zinc/02/82/26/1031028226.db2.gz VXZDOZFJQKFOBV-HNNXBMFYSA-N 2 0 348.556 4.190 20 0 EIADRP CC(C)COc1cccc(C[NH+]2CCC(CCC[NH+](C)C)CC2)c1 ZINC001168201870 1031122045 /nfs/dbraw/zinc/12/20/45/1031122045.db2.gz NPINOFOZJCFAAD-UHFFFAOYSA-N 2 0 332.532 4.275 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCCOc1ccc(Cl)cc1Cl ZINC000532464688 1031125172 /nfs/dbraw/zinc/12/51/72/1031125172.db2.gz ZIBFIHXMECYVNM-WWGRRREGSA-N 2 0 345.314 4.081 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H](CC2CC2)c2ccccc2)cc1 ZINC000532474943 1031180245 /nfs/dbraw/zinc/18/02/45/1031180245.db2.gz HJVMIUGSWSBHAP-QFIPXVFZSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccccc1OCc1ccccc1 ZINC000532507298 1031227459 /nfs/dbraw/zinc/22/74/59/1031227459.db2.gz RGQQYFDMWJSTCR-ICSRJNTNSA-N 2 0 338.495 4.258 20 0 EIADRP COc1cc(F)cc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c1 ZINC000449066144 1031394039 /nfs/dbraw/zinc/39/40/39/1031394039.db2.gz APRLNEXWTSQHCX-UHFFFAOYSA-N 2 0 342.458 4.110 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCOC2(CCC2)C1 ZINC000449084225 1031412252 /nfs/dbraw/zinc/41/22/52/1031412252.db2.gz XABGBPIYMUBUKX-GHTZIAJQSA-N 2 0 342.527 4.252 20 0 EIADRP Clc1ccc(C2=CC[C@@H]([NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)CC2)cc1 ZINC000449074347 1031425862 /nfs/dbraw/zinc/42/58/62/1031425862.db2.gz KPBATSWRXUUFFB-HNAYVOBHSA-N 2 0 330.903 4.350 20 0 EIADRP c1cc(C[NH2+][C@@H]2CCOC3(CCC3)C2)cc(C[NH+]2CCCCCC2)c1 ZINC000449109050 1031446959 /nfs/dbraw/zinc/44/69/59/1031446959.db2.gz XCQBXEWBKZXGRH-OAQYLSRUSA-N 2 0 342.527 4.254 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CC2CCSCC2)CC1 ZINC000449144472 1031479303 /nfs/dbraw/zinc/47/93/03/1031479303.db2.gz JEKJLHIBTZQNSZ-UHFFFAOYSA-N 2 0 326.594 4.398 20 0 EIADRP CC[C@@H]([NH2+]CC1(N[C@@H](C)c2ccccc2)CCOCC1)C1CCC1 ZINC000449155195 1031483496 /nfs/dbraw/zinc/48/34/96/1031483496.db2.gz KNYXFAHVINABJS-FXAWDEMLSA-N 2 0 330.516 4.055 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCSc3ccccc32)c1 ZINC000123917814 1031491731 /nfs/dbraw/zinc/49/17/31/1031491731.db2.gz PADVWXUBIVDBNR-IBGZPJMESA-N 2 0 326.509 4.465 20 0 EIADRP Cc1nccn1CC[NH2+][C@@H](Cc1cccc(F)c1)c1cccc(F)c1 ZINC000531708084 1031494592 /nfs/dbraw/zinc/49/45/92/1031494592.db2.gz NOZJRPOKVVWCHX-FQEVSTJZSA-N 2 0 341.405 4.043 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](C)c1cc(F)cc(F)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000449232833 1031565356 /nfs/dbraw/zinc/56/53/56/1031565356.db2.gz JGOXTYFLVQFORB-BZUAXINKSA-N 2 0 336.470 4.311 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC000449298099 1031605520 /nfs/dbraw/zinc/60/55/20/1031605520.db2.gz FSRJSPRAZOAGOQ-WMZOPIPTSA-N 2 0 336.470 4.107 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CCCN(C)[C@H]1c1cccs1)c1ccncc1 ZINC000453116538 1031606138 /nfs/dbraw/zinc/60/61/38/1031606138.db2.gz HRQXXIQHTXNLLN-JENIJYKNSA-N 2 0 329.513 4.267 20 0 EIADRP COCC1(CC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CCC1 ZINC000449341850 1031638876 /nfs/dbraw/zinc/63/88/76/1031638876.db2.gz WYOBYGBBRPDTSA-UHFFFAOYSA-N 2 0 338.580 4.462 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccccc2OC(F)F)c1 ZINC000065976599 1031639371 /nfs/dbraw/zinc/63/93/71/1031639371.db2.gz LMHJXNJCCDJSHS-UHFFFAOYSA-N 2 0 348.437 4.418 20 0 EIADRP CCOc1cccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000065976487 1031639499 /nfs/dbraw/zinc/63/94/99/1031639499.db2.gz FKEYXYVHDCPILZ-UHFFFAOYSA-N 2 0 326.484 4.215 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H]([NH2+]CCCc3ccccn3)[C@H]3CCC[C@@H]32)cc1 ZINC000453163302 1031663576 /nfs/dbraw/zinc/66/35/76/1031663576.db2.gz PXXDVVCJCTYYCO-VJBWXMMDSA-N 2 0 349.522 4.047 20 0 EIADRP Cc1nccn1CCCC[N@@H+](CC(C)C)[C@@H]1CCCc2cccnc21 ZINC000126885418 1031665012 /nfs/dbraw/zinc/66/50/12/1031665012.db2.gz UGXUTARUDQSHHL-HXUWFJFHSA-N 2 0 340.515 4.402 20 0 EIADRP COCCC(C)(C)C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000453198904 1031710274 /nfs/dbraw/zinc/71/02/74/1031710274.db2.gz PESYJQNADREOQK-NJDAHSKKSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@@H](C[NH2+]C(C)(C)CCC[NH+](C)C)c1cccc(Br)c1 ZINC000449529458 1031817182 /nfs/dbraw/zinc/81/71/82/1031817182.db2.gz XGPPBSSGEJQYBR-AWEZNQCLSA-N 2 0 341.337 4.263 20 0 EIADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccc(OC(F)F)c(Cl)c1 ZINC000449528179 1031822855 /nfs/dbraw/zinc/82/28/55/1031822855.db2.gz NQBYEEDXMXDQJV-UHFFFAOYSA-N 2 0 334.838 4.151 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449559855 1031847599 /nfs/dbraw/zinc/84/75/99/1031847599.db2.gz CXMRKXCMXSQNML-TZUVLKIQSA-N 2 0 340.433 4.241 20 0 EIADRP FC1(F)CCC[C@H]1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000453326559 1031852268 /nfs/dbraw/zinc/85/22/68/1031852268.db2.gz YIXCVSIIRZKKQN-CADBVGFASA-N 2 0 334.454 4.207 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cnc(C3CC3)o2)CC1 ZINC000453358528 1031887008 /nfs/dbraw/zinc/88/70/08/1031887008.db2.gz OFUQSCJFYURJRB-UHFFFAOYSA-N 2 0 339.483 4.085 20 0 EIADRP C[N@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)CC1CCC(F)(F)CC1 ZINC000459360528 1031913119 /nfs/dbraw/zinc/91/31/19/1031913119.db2.gz OPVWCXOHGLPXGV-IBGZPJMESA-N 2 0 336.470 4.266 20 0 EIADRP COc1ccc([C@H]([NH2+]CCCC[N@H+](C)C2CC2)c2ccccc2)cc1 ZINC000453399778 1031934818 /nfs/dbraw/zinc/93/48/18/1031934818.db2.gz LIZGDZMFEWGWAD-JOCHJYFZSA-N 2 0 338.495 4.249 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(Oc2ccccc2)cn1 ZINC000453411612 1031946658 /nfs/dbraw/zinc/94/66/58/1031946658.db2.gz VQWQMUJQONIHLU-QGZVFWFLSA-N 2 0 339.483 4.399 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]C[C@H]2CCOC(C)(C)C2)cc1 ZINC000453417283 1031952901 /nfs/dbraw/zinc/95/29/01/1031952901.db2.gz KCOWSAHJEAKWAT-RDJZCZTQSA-N 2 0 327.472 4.037 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1nc(-c2ccccc2)cs1 ZINC000453390049 1031954385 /nfs/dbraw/zinc/95/43/85/1031954385.db2.gz CUHUMLCOOUALAF-HNNXBMFYSA-N 2 0 329.513 4.335 20 0 EIADRP CC(C)[N@@H+]1CCc2nc(CNc3ccc4c[nH+]ccc4c3)sc2C1 ZINC000453624164 1032036255 /nfs/dbraw/zinc/03/62/55/1032036255.db2.gz XNCHGFWWWAUHMW-UHFFFAOYSA-N 2 0 338.480 4.070 20 0 EIADRP C[C@@H](C[NH2+]CCCC[N@H+](C)C1CC1)c1cccc(Br)c1 ZINC000453601701 1032038832 /nfs/dbraw/zinc/03/88/32/1032038832.db2.gz VHCRROJRXCBRID-AWEZNQCLSA-N 2 0 339.321 4.017 20 0 EIADRP CSCCCC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000512633695 1033572954 /nfs/dbraw/zinc/57/29/54/1033572954.db2.gz AWGPDSDOTGQSFS-HSALFYBXSA-N 2 0 332.557 4.020 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ncc(C(F)(F)F)s2)C1 ZINC000433336635 1034254147 /nfs/dbraw/zinc/25/41/47/1034254147.db2.gz WJMMDWJQBGJPDJ-STQMWFEESA-N 2 0 349.466 4.010 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cc3ccccc3[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000513053793 1034373643 /nfs/dbraw/zinc/37/36/43/1034373643.db2.gz YIPUERXUFQKWHR-XLIONFOSSA-N 2 0 333.479 4.311 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C2CCC([NH3+])CC2)CCC3)cc1 ZINC000333232154 1034509128 /nfs/dbraw/zinc/50/91/28/1034509128.db2.gz CGSBVPUSCNMMOZ-JCYILVPMSA-N 2 0 341.524 4.355 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000333272941 1034576337 /nfs/dbraw/zinc/57/63/37/1034576337.db2.gz KUXZVRLSFPOMMK-BZUAXINKSA-N 2 0 345.487 4.186 20 0 EIADRP Clc1ccc([C@H]2C[C@H]([NH2+][C@@H]3CC[C@H]4C[NH2+]C[C@@H]4C3)C2)cc1Cl ZINC000647796722 1034621367 /nfs/dbraw/zinc/62/13/67/1034621367.db2.gz LDSJANMPIDPYBL-GVRJEKJASA-N 2 0 339.310 4.217 20 0 EIADRP C[N@H+](CCc1cccc(Cl)c1Cl)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513143228 1034654535 /nfs/dbraw/zinc/65/45/35/1034654535.db2.gz BLFILVFBEBQXRQ-YIONKMFJSA-N 2 0 327.299 4.093 20 0 EIADRP C[N@H+](CCSC1CCCCC1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000500979142 1034809933 /nfs/dbraw/zinc/80/99/33/1034809933.db2.gz AZOCUMTXDHMJKR-UHFFFAOYSA-N 2 0 347.572 4.296 20 0 EIADRP COc1ccc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000513513013 1035008613 /nfs/dbraw/zinc/00/86/13/1035008613.db2.gz QZNFYGCYPMSIMR-WIYYLYMNSA-N 2 0 338.495 4.086 20 0 EIADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccc(SCC(F)F)cc1 ZINC000414170134 1035056536 /nfs/dbraw/zinc/05/65/36/1035056536.db2.gz BRWLMMLYWXWXTK-HUUCEWRRSA-N 2 0 342.499 4.426 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000513683333 1035100462 /nfs/dbraw/zinc/10/04/62/1035100462.db2.gz JJKCLWWGBHOOFE-ZEPSKSRBSA-N 2 0 327.299 4.443 20 0 EIADRP C[C@@H](c1ccc(F)cc1F)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501025551 1035353576 /nfs/dbraw/zinc/35/35/76/1035353576.db2.gz ZCJNWSGJTFBVJI-HNNXBMFYSA-N 2 0 345.437 4.269 20 0 EIADRP C[C@@H](c1ccc(F)cc1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501043964 1035354988 /nfs/dbraw/zinc/35/49/88/1035354988.db2.gz FHXBUQYGVIIHDK-INIZCTEOSA-N 2 0 327.447 4.130 20 0 EIADRP C[C@H](c1c(F)cccc1F)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501060329 1035364348 /nfs/dbraw/zinc/36/43/48/1035364348.db2.gz AGADWKCKRJDQMG-OAHLLOKOSA-N 2 0 345.437 4.269 20 0 EIADRP C[N@H+](CC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCc2ccc(F)cc21 ZINC000501072137 1035371794 /nfs/dbraw/zinc/37/17/94/1035371794.db2.gz ZEHMPFFFSFJTNN-OAQYLSRUSA-N 2 0 339.458 4.056 20 0 EIADRP C[N@H+](CC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCCc2ccccc21 ZINC000501077846 1035373731 /nfs/dbraw/zinc/37/37/31/1035373731.db2.gz PELMWVMJUJJIEK-JOCHJYFZSA-N 2 0 335.495 4.307 20 0 EIADRP FC(F)(F)c1cc(Cl)ccc1C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204735348 1035405761 /nfs/dbraw/zinc/40/57/61/1035405761.db2.gz PWMFACMSPJEXQD-UHFFFAOYSA-N 2 0 346.824 4.324 20 0 EIADRP CCc1cc(OC)ccc1C[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000501380964 1035436475 /nfs/dbraw/zinc/43/64/75/1035436475.db2.gz HVJRDAQXNZKJCT-UHFFFAOYSA-N 2 0 340.511 4.388 20 0 EIADRP Cc1nc([C@@H](C)[NH+]2CCC(C[NH3+])CC2)oc1-c1ccc(Cl)cc1 ZINC000420267156 1035489706 /nfs/dbraw/zinc/48/97/06/1035489706.db2.gz FAZMEKIJVCGOEA-CYBMUJFWSA-N 2 0 333.863 4.035 20 0 EIADRP Clc1ccc2sc(C3CC[NH+](CC[C@H]4CC[NH2+]C4)CC3)nc2c1 ZINC000420307665 1035504606 /nfs/dbraw/zinc/50/46/06/1035504606.db2.gz RRIKJVYWVUKMMX-CYBMUJFWSA-N 2 0 349.931 4.129 20 0 EIADRP CCSC1(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)CC1 ZINC000595090291 1035600558 /nfs/dbraw/zinc/60/05/58/1035600558.db2.gz AMJUQNAHRLQQBK-UHFFFAOYSA-N 2 0 332.557 4.305 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1ccnc(Cl)c1 ZINC000163781670 1035864945 /nfs/dbraw/zinc/86/49/45/1035864945.db2.gz FHPRRDOUWBWHJN-OAHLLOKOSA-N 2 0 331.891 4.428 20 0 EIADRP C[N@H+](Cc1ccccc1C[NH2+]Cc1ccc(O)cc1)C1CCCCC1 ZINC000237154138 1036032466 /nfs/dbraw/zinc/03/24/66/1036032466.db2.gz YNXNJSFSBKSBKC-UHFFFAOYSA-N 2 0 338.495 4.447 20 0 EIADRP CC(C)OCc1ccccc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000571789630 1036252503 /nfs/dbraw/zinc/25/25/03/1036252503.db2.gz VEKHZTXTUAKDDE-QHAWAJNXSA-N 2 0 330.516 4.012 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@@H]3CC34CCSCC4)CC2)C1 ZINC000421391661 1036354273 /nfs/dbraw/zinc/35/42/73/1036354273.db2.gz WNRBBSBCMWZPIM-ZIFCJYIRSA-N 2 0 336.589 4.152 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000502697630 1036513169 /nfs/dbraw/zinc/51/31/69/1036513169.db2.gz PHMFSEYJZSACGQ-VXKWHMMOSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1cnn(C2CCCC2)c1 ZINC000502727537 1036584722 /nfs/dbraw/zinc/58/47/22/1036584722.db2.gz NRVMEIMBNUTJDW-ZWKOTPCHSA-N 2 0 332.536 4.303 20 0 EIADRP C[C@H]1C[N@@H+](C2CC[NH+](CC3CC3)CC2)CCc2ccc(Cl)cc21 ZINC001168388739 1036738278 /nfs/dbraw/zinc/73/82/78/1036738278.db2.gz HZAAKDNBJYXLJB-HNNXBMFYSA-N 2 0 332.919 4.176 20 0 EIADRP CSC1(C[NH2+][C@H]2C[C@@H](C(C)C)c3ccccc32)CC[NH+](C)CC1 ZINC000589348092 1036760418 /nfs/dbraw/zinc/76/04/18/1036760418.db2.gz QNGZZNSJIIDBBD-OALUTQOASA-N 2 0 332.557 4.288 20 0 EIADRP Fc1ccc2c(c1)CC[C@@H]([NH2+]C1CC[NH+](CC3CCCCC3)CC1)C2 ZINC001168413789 1036766930 /nfs/dbraw/zinc/76/69/30/1036766930.db2.gz AREPHTQIQDFRQL-JOCHJYFZSA-N 2 0 344.518 4.317 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccnc(Cl)c2)cc1 ZINC000163567551 1036833377 /nfs/dbraw/zinc/83/33/77/1036833377.db2.gz PPURYLJFPQAXPM-HNNXBMFYSA-N 2 0 331.891 4.428 20 0 EIADRP CC(C)(C)C[NH+]1CCC(C[NH2+][C@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168414451 1036836516 /nfs/dbraw/zinc/83/65/16/1036836516.db2.gz GFQLEGGVTFGOAT-FQEVSTJZSA-N 2 0 332.507 4.031 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000421872015 1036839241 /nfs/dbraw/zinc/83/92/41/1036839241.db2.gz GLZGHSPGVQDTNS-AJTFCVKESA-N 2 0 349.478 4.380 20 0 EIADRP Cc1cc([C@@H]([NH2+]C2CCC([NH+](C)C)CC2)c2cccnc2)ccc1F ZINC000421871927 1036839267 /nfs/dbraw/zinc/83/92/67/1036839267.db2.gz GHVFELZEQNMZTE-GZNCHQMQSA-N 2 0 341.474 4.081 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000421872017 1036840376 /nfs/dbraw/zinc/84/03/76/1036840376.db2.gz GLZGHSPGVQDTNS-OBFZPWGMSA-N 2 0 349.478 4.380 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2[nH]nc3ccccc32)cc1 ZINC000589640203 1036855546 /nfs/dbraw/zinc/85/55/46/1036855546.db2.gz FXIFMWHWMVAOQQ-QGZVFWFLSA-N 2 0 348.494 4.227 20 0 EIADRP CC[N@H+](CCO[C@H]1CCCC[C@@H]1C)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999652 1036916999 /nfs/dbraw/zinc/91/69/99/1036916999.db2.gz QIMFCIVCMWQDNE-RXVVDRJESA-N 2 0 332.532 4.165 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+]C/C=C/c2ccncc2)C1 ZINC000486980345 1036932168 /nfs/dbraw/zinc/93/21/68/1036932168.db2.gz MLNZGQKTTZRNBH-VGIQHARFSA-N 2 0 349.522 4.363 20 0 EIADRP Fc1ccc2c(c1)CC[C@@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)C2 ZINC001168399145 1036991055 /nfs/dbraw/zinc/99/10/55/1036991055.db2.gz XRSQMEDPFXQFBS-JOCHJYFZSA-N 2 0 338.470 4.069 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000271842563 1037031812 /nfs/dbraw/zinc/03/18/12/1037031812.db2.gz HEFGNJANJCOYEI-HNNXBMFYSA-N 2 0 341.524 4.339 20 0 EIADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000271866946 1037042110 /nfs/dbraw/zinc/04/21/10/1037042110.db2.gz LPYDMWJUKRMALD-CYBMUJFWSA-N 2 0 344.446 4.254 20 0 EIADRP Fc1ccc2c(c1)CC[C@H]([NH2+]CC1CC[NH+](CC3CCCC3)CC1)C2 ZINC001168415913 1037097162 /nfs/dbraw/zinc/09/71/62/1037097162.db2.gz SNUXUIHMKPRFNR-QFIPXVFZSA-N 2 0 344.518 4.175 20 0 EIADRP Cc1oc(-c2cccs2)nc1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000590786155 1037165707 /nfs/dbraw/zinc/16/57/07/1037165707.db2.gz DGJFAIJETARCGB-UHFFFAOYSA-N 2 0 347.528 4.264 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2sccc2Br)CC1 ZINC000590786883 1037166735 /nfs/dbraw/zinc/16/67/35/1037166735.db2.gz IHAXLQKSWJARGA-UHFFFAOYSA-N 2 0 345.350 4.063 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000590818890 1037185351 /nfs/dbraw/zinc/18/53/51/1037185351.db2.gz GBFJMPFIBVRRFA-UHFFFAOYSA-N 2 0 339.321 4.001 20 0 EIADRP Fc1ccc(C2=CC[C@@H]([NH2+]C3CC[NH+](C4CCC4)CC3)CC2)cc1 ZINC000272449221 1037192789 /nfs/dbraw/zinc/19/27/89/1037192789.db2.gz FTZWGEMEQFVWKG-LJQANCHMSA-N 2 0 328.475 4.368 20 0 EIADRP C[C@H]([NH2+]CCCCCC[NH2+][C@@H](C)c1cccnc1)c1cccnc1 ZINC000272828755 1037305879 /nfs/dbraw/zinc/30/58/79/1037305879.db2.gz KNFFZRHBEOOFBJ-ROUUACIJSA-N 2 0 326.488 4.038 20 0 EIADRP Oc1ccc(C2CCC([NH2+]C[C@H]3CCC[N@H+](CC4CC4)C3)CC2)cc1 ZINC000668820339 1037349794 /nfs/dbraw/zinc/34/97/94/1037349794.db2.gz UGHIPQHHVRVQEF-LWEYNCJUSA-N 2 0 342.527 4.130 20 0 EIADRP CCC[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cccnc1 ZINC000273469301 1037473240 /nfs/dbraw/zinc/47/32/40/1037473240.db2.gz FLIGOZAHROUNJN-NRFANRHFSA-N 2 0 341.499 4.043 20 0 EIADRP CC(C)[C@H]1C[C@@H]([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CS1 ZINC000488414668 1037582577 /nfs/dbraw/zinc/58/25/77/1037582577.db2.gz HIDZUXGLTYWYRB-WOJBJXKFSA-N 2 0 332.557 4.018 20 0 EIADRP C[C@@H]1C[C@@H]1C[NH2+]C[C@@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000488415367 1037582681 /nfs/dbraw/zinc/58/26/81/1037582681.db2.gz AMULRZHPYCSPRT-NOVWEMISSA-N 2 0 340.433 4.334 20 0 EIADRP CC[C@H](C(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)[NH+](CC)CC ZINC000605425139 1037777427 /nfs/dbraw/zinc/77/74/27/1037777427.db2.gz WFQOCXCEMFBPLS-YLJYHZDGSA-N 2 0 345.531 4.120 20 0 EIADRP Cc1ccccc1[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)C1CC1 ZINC000422711918 1037804151 /nfs/dbraw/zinc/80/41/51/1037804151.db2.gz NJWNRHFFIJSOLT-YMPZKCBVSA-N 2 0 348.490 4.292 20 0 EIADRP c1ccc([C@@H]2CCC[C@@H]2[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422710971 1037804469 /nfs/dbraw/zinc/80/44/69/1037804469.db2.gz MBUKKSSYJFDNPG-XHRGMSINSA-N 2 0 348.490 4.168 20 0 EIADRP FC(F)(F)c1cccc(CCC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)c1 ZINC000422710657 1037804494 /nfs/dbraw/zinc/80/44/94/1037804494.db2.gz FHJRTOOHKFSMHI-KZNAEPCWSA-N 2 0 340.433 4.148 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC(C)(C)c1ccc(F)cc1Cl ZINC000422732605 1037808108 /nfs/dbraw/zinc/80/81/08/1037808108.db2.gz PZKCXXSTIQXKKV-LBPRGKRZSA-N 2 0 349.881 4.270 20 0 EIADRP c1ccc([C@H]([NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C2CCC2)cc1 ZINC000422720703 1037815179 /nfs/dbraw/zinc/81/51/79/1037815179.db2.gz SYWFMSDALGPUJK-PUHATCMVSA-N 2 0 348.490 4.373 20 0 EIADRP COc1ccc(C2(C[NH2+][C@@H](C)CCCC[NH3+])CCCCC2)cc1OC ZINC000422738365 1037820791 /nfs/dbraw/zinc/82/07/91/1037820791.db2.gz YNKAZZMMNHSKCP-KRWDZBQOSA-N 2 0 348.531 4.013 20 0 EIADRP CC[C@@H]1C[C@H](C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CCO1 ZINC000503572726 1037824392 /nfs/dbraw/zinc/82/43/92/1037824392.db2.gz HHKMJPMHYLVUCB-BDKRGJGYSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cc2ccccc2o1 ZINC000422768540 1037829334 /nfs/dbraw/zinc/82/93/34/1037829334.db2.gz NZUULJMBPZZYBU-REDKUUPNSA-N 2 0 348.446 4.339 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+]CCCCSc1ccccc1Br ZINC000422764185 1037834640 /nfs/dbraw/zinc/83/46/40/1037834640.db2.gz UUTYEWNKJSDGPF-CYBMUJFWSA-N 2 0 345.350 4.038 20 0 EIADRP COc1ccc([C@H](C)CC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000422791220 1037839270 /nfs/dbraw/zinc/83/92/70/1037839270.db2.gz YIAXPBMXMQFHRH-RZXSNQJFSA-N 2 0 330.516 4.089 20 0 EIADRP [NH3+][C@@H]1C[C@@H](NCc2cccc(C[NH+]3CCCCCC3)c2)c2ccccc21 ZINC000422823497 1037841817 /nfs/dbraw/zinc/84/18/17/1037841817.db2.gz DKRCEIXNCKDGRW-DHIUTWEWSA-N 2 0 349.522 4.297 20 0 EIADRP COc1ccccc1[C@@H](CC(C)C)[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422825937 1037842002 /nfs/dbraw/zinc/84/20/02/1037842002.db2.gz QFLMOVBVDAIJPA-OXQOHEQNSA-N 2 0 341.499 4.295 20 0 EIADRP CSCc1cc(F)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000422864246 1037848581 /nfs/dbraw/zinc/84/85/81/1037848581.db2.gz MMYZHNZFQPLRIA-GUDVDZBRSA-N 2 0 336.520 4.089 20 0 EIADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(COCc2ccccc2)cc1 ZINC000422867689 1037848911 /nfs/dbraw/zinc/84/89/11/1037848911.db2.gz SYZUZLYNZRKONA-FCHUYYIVSA-N 2 0 338.495 4.011 20 0 EIADRP C[C@H]([NH2+][C@H]1CCCc2nc(-c3ccccc3)sc21)[C@@H]1CCC[NH2+]C1 ZINC000422866002 1037849188 /nfs/dbraw/zinc/84/91/88/1037849188.db2.gz ZUHMHKNDQUGLHM-UAGQMJEPSA-N 2 0 341.524 4.165 20 0 EIADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1cccc(COCc2ccccc2)c1 ZINC000422866503 1037849389 /nfs/dbraw/zinc/84/93/89/1037849389.db2.gz QKRXCABNMVTHJB-YADHBBJMSA-N 2 0 338.495 4.011 20 0 EIADRP Fc1cccc2c1SCC[C@@H]2[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000422844724 1037850207 /nfs/dbraw/zinc/85/02/07/1037850207.db2.gz MWFIJMMHMDEMJQ-RUGDWHBFSA-N 2 0 334.504 4.263 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CN[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422885701 1037854443 /nfs/dbraw/zinc/85/44/43/1037854443.db2.gz UZHWUEWLEJXHDK-MQNAVGNWSA-N 2 0 349.522 4.295 20 0 EIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000422898142 1037860703 /nfs/dbraw/zinc/86/07/03/1037860703.db2.gz DJFMGKWOFATKOO-BVOGOJNSSA-N 2 0 330.516 4.055 20 0 EIADRP CC(C)c1ccc(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422874718 1037861556 /nfs/dbraw/zinc/86/15/56/1037861556.db2.gz ASPAXCHLLICOHO-IRLDBZIGSA-N 2 0 336.479 4.156 20 0 EIADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1ccc2ccccc2c1 ZINC000422906302 1037863747 /nfs/dbraw/zinc/86/37/47/1037863747.db2.gz JNSOPAOGYZHLPB-DHIUTWEWSA-N 2 0 348.490 4.273 20 0 EIADRP c1ccc(OC2CCC2)c(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000422910827 1037866183 /nfs/dbraw/zinc/86/61/83/1037866183.db2.gz JMFIHXQXMFEYBW-VAMGGRTRSA-N 2 0 328.500 4.018 20 0 EIADRP c1ccc2c(c1)cccc2C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422924191 1037871166 /nfs/dbraw/zinc/87/11/66/1037871166.db2.gz YCVQWZXZVBAFHM-GMAHTHKFSA-N 2 0 344.458 4.185 20 0 EIADRP Clc1ccc(OCCCC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000422934251 1037873581 /nfs/dbraw/zinc/87/35/81/1037873581.db2.gz JKBQQDVULYJUHJ-GUDVDZBRSA-N 2 0 336.907 4.009 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1Cl)c1cc(F)ccc1F ZINC000422917576 1037878845 /nfs/dbraw/zinc/87/88/45/1037878845.db2.gz GKQXRERQKZUEMV-SGTLLEGYSA-N 2 0 338.829 4.425 20 0 EIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+][C@@H](C)CCCC[NH3+])s2)cc1 ZINC000422984511 1037895005 /nfs/dbraw/zinc/89/50/05/1037895005.db2.gz YDCROLUKSJPNEH-UONOGXRCSA-N 2 0 347.528 4.295 20 0 EIADRP C([NH2+][C@@H]1CCOC[C@H]1[C@H]1CCC[NH2+]1)C1(C2CCCCC2)CCCCC1 ZINC000423022257 1037907991 /nfs/dbraw/zinc/90/79/91/1037907991.db2.gz HHALDIFTVBSXMA-PWRODBHTSA-N 2 0 348.575 4.264 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000423045183 1037923396 /nfs/dbraw/zinc/92/33/96/1037923396.db2.gz CLHNNTKZMYAKJK-CZUORRHYSA-N 2 0 347.503 4.434 20 0 EIADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000423070846 1037934496 /nfs/dbraw/zinc/93/44/96/1037934496.db2.gz NWXWKXWVLOPYNB-QWRGUYRKSA-N 2 0 334.813 4.106 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]C1CC(c2cc(F)cc(F)c2)C1 ZINC000574199215 1037949570 /nfs/dbraw/zinc/94/95/70/1037949570.db2.gz ROVNTTFYHIBVOQ-XRTORIHISA-N 2 0 336.470 4.455 20 0 EIADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000423097297 1037953077 /nfs/dbraw/zinc/95/30/77/1037953077.db2.gz QRVGNSBVGNVHQQ-QSPRXWTASA-N 2 0 326.406 4.201 20 0 EIADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000423100574 1037957742 /nfs/dbraw/zinc/95/77/42/1037957742.db2.gz HCVXLRKMZGHJND-BBRMVZONSA-N 2 0 335.904 4.071 20 0 EIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+][C@@H](C)CCCC[NH3+])cc1 ZINC000423120411 1037968233 /nfs/dbraw/zinc/96/82/33/1037968233.db2.gz GKVYNDPLAPSDEA-UWJYYQICSA-N 2 0 326.484 4.086 20 0 EIADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000423126476 1037978666 /nfs/dbraw/zinc/97/86/66/1037978666.db2.gz IVPJBMLHGHSKPK-FTRWYGJKSA-N 2 0 346.902 4.313 20 0 EIADRP COCC[C@H]([NH2+][C@H](C)CCCC[NH3+])c1ccc(Cl)c(Cl)c1 ZINC000423108912 1037992656 /nfs/dbraw/zinc/99/26/56/1037992656.db2.gz RSJILAGEIAZZGV-WBMJQRKESA-N 2 0 333.303 4.178 20 0 EIADRP c1ccc(C2CC(C[NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)C2)cc1 ZINC000423111263 1037992805 /nfs/dbraw/zinc/99/28/05/1037992805.db2.gz INORSBRZEXZMNJ-XJPWDFEISA-N 2 0 348.490 4.026 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H]3CCCC[C@H]3OC(F)F)CC2)C1 ZINC000503919236 1037998381 /nfs/dbraw/zinc/99/83/81/1037998381.db2.gz FUWJOMXSGYWPGO-VDHUWJSZSA-N 2 0 344.490 4.170 20 0 EIADRP C[C@@H]([NH2+]CC1CCC(F)(F)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000503906429 1038007892 /nfs/dbraw/zinc/00/78/92/1038007892.db2.gz ZKOOACSSMHPGAJ-APWZRJJASA-N 2 0 336.470 4.312 20 0 EIADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@@H](Cc1ccccc1)c1nc2ccccc2s1 ZINC000423161424 1038019583 /nfs/dbraw/zinc/01/95/83/1038019583.db2.gz NUOPIZKFCWISOP-MPGHIAIKSA-N 2 0 339.508 4.296 20 0 EIADRP CC(C)=CCOc1ccc(CC[C@@H](C)[NH2+]C2CCC([NH3+])CC2)cc1 ZINC000423208793 1038038413 /nfs/dbraw/zinc/03/84/13/1038038413.db2.gz DWQJNWITMOBQJF-QHGAOEGBSA-N 2 0 330.516 4.212 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000423215637 1038056657 /nfs/dbraw/zinc/05/66/57/1038056657.db2.gz NGSVGBNIBQURLS-IENTYSSBSA-N 2 0 331.287 4.009 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc2cc(OC)ccc2c1 ZINC000423219265 1038060864 /nfs/dbraw/zinc/06/08/64/1038060864.db2.gz SZKPNLYKUGMAFF-DLVCFXQMSA-N 2 0 326.484 4.277 20 0 EIADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(OC(F)(F)F)cc1 ZINC000423217808 1038063213 /nfs/dbraw/zinc/06/32/13/1038063213.db2.gz QMHYFKGHOJJRQT-XPKDYRNWSA-N 2 0 330.394 4.014 20 0 EIADRP CSC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1 ZINC000423218960 1038063678 /nfs/dbraw/zinc/06/36/78/1038063678.db2.gz SQQSSTMXXXVKOX-BJJXKVORSA-N 2 0 346.462 4.087 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423244931 1038075765 /nfs/dbraw/zinc/07/57/65/1038075765.db2.gz HYSSCFKCIHTVPR-IRXDYDNUSA-N 2 0 342.458 4.055 20 0 EIADRP Fc1ccc([C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2cnc3ccccc3c2)cc1 ZINC000423245458 1038077640 /nfs/dbraw/zinc/07/76/40/1038077640.db2.gz IYGYTGWBKMKOGE-AOMKIAJQSA-N 2 0 349.453 4.053 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)CCC3)cc1 ZINC000423253825 1038084667 /nfs/dbraw/zinc/08/46/67/1038084667.db2.gz WLMCILFWXQIBMY-DOTOQJQBSA-N 2 0 341.524 4.085 20 0 EIADRP COc1cc(OC)c([C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1Cl ZINC000423288954 1038093213 /nfs/dbraw/zinc/09/32/13/1038093213.db2.gz ACVUHPDJRKGZCL-OLZOCXBDSA-N 2 0 348.874 4.228 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2OC(F)F)cc1 ZINC000423296559 1038120100 /nfs/dbraw/zinc/12/01/00/1038120100.db2.gz ZKDLGKANRXVTBL-RYUDHWBXSA-N 2 0 338.373 4.298 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423321447 1038123717 /nfs/dbraw/zinc/12/37/17/1038123717.db2.gz GEERVCXDNSNNCV-CYBMUJFWSA-N 2 0 347.503 4.298 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc(OC(F)(F)F)cc1 ZINC000423296590 1038123962 /nfs/dbraw/zinc/12/39/62/1038123962.db2.gz ZMBLLRLHJWGMQU-QWHCGFSZSA-N 2 0 338.373 4.456 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+][C@@H]2CCCc3cc(N)ccc32)cc1 ZINC000423344708 1038133200 /nfs/dbraw/zinc/13/32/00/1038133200.db2.gz FMNZFCLQCZPLAZ-IVZQSRNASA-N 2 0 346.478 4.491 20 0 EIADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000423346317 1038135460 /nfs/dbraw/zinc/13/54/60/1038135460.db2.gz ZTWXCWYMBJDKJE-ZDUSSCGKSA-N 2 0 346.462 4.381 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]CC2(C)CC[NH2+]CC2)cc1 ZINC000423326395 1038139621 /nfs/dbraw/zinc/13/96/21/1038139621.db2.gz KLNSVLWJPDPFRR-KRWDZBQOSA-N 2 0 338.495 4.403 20 0 EIADRP C[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423336484 1038149152 /nfs/dbraw/zinc/14/91/52/1038149152.db2.gz HAABKCMEUQCHOI-OAHLLOKOSA-N 2 0 326.415 4.188 20 0 EIADRP CSc1cccc([C@H]([NH2+]CCCC[NH3+])c2ccc(F)c(F)c2)c1 ZINC000423335678 1038149385 /nfs/dbraw/zinc/14/93/85/1038149385.db2.gz UCIKBGRLEDWJHF-SFHVURJKSA-N 2 0 336.451 4.105 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cccc(Br)c1 ZINC000423358041 1038168020 /nfs/dbraw/zinc/16/80/20/1038168020.db2.gz NCCKZMNHSYBSDL-GOSISDBHSA-N 2 0 345.284 4.293 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000423368242 1038183176 /nfs/dbraw/zinc/18/31/76/1038183176.db2.gz DYOHCUVTYQIWKP-JKIFEVAISA-N 2 0 329.513 4.218 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(Br)cc1 ZINC000423366563 1038183283 /nfs/dbraw/zinc/18/32/83/1038183283.db2.gz XWRYCPFKOGWSHW-SFHVURJKSA-N 2 0 345.284 4.293 20 0 EIADRP Clc1cccc([C@H]2CC[C@@H]([NH2+]Cc3ccc4c(c3)C[NH2+]C4)C2)c1 ZINC000423383637 1038194845 /nfs/dbraw/zinc/19/48/45/1038194845.db2.gz KMWFNNZRWIVIFN-OXJNMPFZSA-N 2 0 326.871 4.369 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC[NH2+]1 ZINC000423385835 1038195835 /nfs/dbraw/zinc/19/58/35/1038195835.db2.gz RCCHAWSARPKDGS-VZEFYGNVSA-N 2 0 326.406 4.072 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@@H]1C)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423396361 1038202340 /nfs/dbraw/zinc/20/23/40/1038202340.db2.gz NSSWVROZIWJJNO-CKJXQJPGSA-N 2 0 342.458 4.053 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000423402124 1038214703 /nfs/dbraw/zinc/21/47/03/1038214703.db2.gz WFYHXLDGNIMRJI-LMMKCTJWSA-N 2 0 346.421 4.237 20 0 EIADRP COCC1(C[NH2+][C@H](C)c2ccc(-c3ccccc3)s2)CC[NH2+]CC1 ZINC000423411973 1038218304 /nfs/dbraw/zinc/21/83/04/1038218304.db2.gz VWPJHLPNKWGTSS-MRXNPFEDSA-N 2 0 344.524 4.082 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000423431535 1038234315 /nfs/dbraw/zinc/23/43/15/1038234315.db2.gz LSKFUSPDEHOMGQ-KXBFYZLASA-N 2 0 331.891 4.126 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](c1ccc(Br)cc1)C1CC1 ZINC000423440468 1038238899 /nfs/dbraw/zinc/23/88/99/1038238899.db2.gz TUGBULSQAPJBLL-MLGOLLRUSA-N 2 0 325.294 4.007 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000423439604 1038239176 /nfs/dbraw/zinc/23/91/76/1038239176.db2.gz SLXCRQYEXIYHNE-XJKSGUPXSA-N 2 0 347.503 4.434 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+][C@H](C)CCC[NH3+])CCC3)cc1 ZINC000423458986 1038240513 /nfs/dbraw/zinc/24/05/13/1038240513.db2.gz QTVWHLBHAIEAKU-ZBFHGGJFSA-N 2 0 329.513 4.213 20 0 EIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)CCC3)cc1 ZINC000423467181 1038245453 /nfs/dbraw/zinc/24/54/53/1038245453.db2.gz BGMGZQPPNOUEBR-IAGOWNOFSA-N 2 0 341.524 4.309 20 0 EIADRP Clc1cccc([C@@H](Cc2cccnc2)[NH2+]CCC[C@@H]2CCC[NH2+]2)c1 ZINC000423469093 1038245663 /nfs/dbraw/zinc/24/56/63/1038245663.db2.gz CHLJRHVTOPDTFC-VQTJNVASSA-N 2 0 343.902 4.141 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000423470718 1038247020 /nfs/dbraw/zinc/24/70/20/1038247020.db2.gz LUTGWGKHJWBQON-IKGGRYGDSA-N 2 0 327.516 4.331 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1cccc(Br)c1 ZINC000423454252 1038254162 /nfs/dbraw/zinc/25/41/62/1038254162.db2.gz BZCMADQJCLKPBP-KCXAZCMYSA-N 2 0 325.294 4.007 20 0 EIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccccc1OC(F)F ZINC000423497348 1038255549 /nfs/dbraw/zinc/25/55/49/1038255549.db2.gz GQSRXIZLNHLLKX-WMLDXEAASA-N 2 0 334.410 4.419 20 0 EIADRP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000423494487 1038263741 /nfs/dbraw/zinc/26/37/41/1038263741.db2.gz SFTBPWLBOASJFI-YSIASYRMSA-N 2 0 330.516 4.070 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000423493042 1038264966 /nfs/dbraw/zinc/26/49/66/1038264966.db2.gz PJBPNTHSRSODBD-GHJWDPDVSA-N 2 0 333.476 4.036 20 0 EIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+]CCC[NH2+]C1CC1)CCC2 ZINC000423532598 1038269046 /nfs/dbraw/zinc/26/90/46/1038269046.db2.gz VKTQAULIVYRSNX-MRXNPFEDSA-N 2 0 345.487 4.058 20 0 EIADRP c1ccc2c(c1)sc1c2CCC[C@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423557510 1038278325 /nfs/dbraw/zinc/27/83/25/1038278325.db2.gz ZWNWCCJRRFSLTH-BASYENTBSA-N 2 0 326.509 4.256 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1cc(F)c(Cl)cc1Cl ZINC000423539186 1038285507 /nfs/dbraw/zinc/28/55/07/1038285507.db2.gz HUIBENQUHZHPIH-NNYUYHANSA-N 2 0 331.262 4.171 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CCC[C@H]2[NH2+]CCC2=CC[NH2+]CC2)cc1 ZINC000423544177 1038290252 /nfs/dbraw/zinc/29/02/52/1038290252.db2.gz VZTQAPPWSQYDMZ-ZWKOTPCHSA-N 2 0 338.417 4.241 20 0 EIADRP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+][C@@H]1CC[C@H]2CCC[C@H]2C1 ZINC000608064842 1038475056 /nfs/dbraw/zinc/47/50/56/1038475056.db2.gz WPEXXMIUKUWHKG-QHAWAJNXSA-N 2 0 342.527 4.220 20 0 EIADRP Fc1ccc2c(c1)[nH+]ccc2N1CCC(C[NH+]2CCCCCC2)CC1 ZINC000608079635 1038495147 /nfs/dbraw/zinc/49/51/47/1038495147.db2.gz YBSBMLSXCFMBRW-UHFFFAOYSA-N 2 0 341.474 4.466 20 0 EIADRP CCCc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000539064134 1038794325 /nfs/dbraw/zinc/79/43/25/1038794325.db2.gz FTRFMCDBQVNANY-HSQYWUDLSA-N 2 0 344.543 4.058 20 0 EIADRP CCCCCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000480769816 1038795990 /nfs/dbraw/zinc/79/59/90/1038795990.db2.gz MQSLKWJNMVCVTM-MSOLQXFVSA-N 2 0 330.516 4.391 20 0 EIADRP COc1cccc2c1CC[C@H]2[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000480778576 1038804323 /nfs/dbraw/zinc/80/43/23/1038804323.db2.gz IRLZZGHBUBCCAV-OAQYLSRUSA-N 2 0 338.495 4.313 20 0 EIADRP C[NH+](C)C1CCC([NH+]2CCC(Cc3cccc(Cl)c3)CC2)CC1 ZINC001168313436 1038809038 /nfs/dbraw/zinc/80/90/38/1038809038.db2.gz CTEGAOOJZLJJPH-UHFFFAOYSA-N 2 0 334.935 4.467 20 0 EIADRP CCc1ccccc1-c1nc(C[NH2+]C2CCC([NH+](C)C)CC2)cs1 ZINC001168315772 1038814853 /nfs/dbraw/zinc/81/48/53/1038814853.db2.gz OCVKYMZCRCSQBW-UHFFFAOYSA-N 2 0 343.540 4.335 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2nc(C)sc2C)CC1)CC(C)C ZINC000539099390 1038838670 /nfs/dbraw/zinc/83/86/70/1038838670.db2.gz CTLJCYXHYVDWRU-UHFFFAOYSA-N 2 0 337.577 4.340 20 0 EIADRP CSC1(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)CCC1 ZINC000555098858 1038868494 /nfs/dbraw/zinc/86/84/94/1038868494.db2.gz CXMKJDDDNQJMIT-UHFFFAOYSA-N 2 0 332.557 4.116 20 0 EIADRP COc1ccccc1[C@@H]([NH2+]C1CC[NH+](C(C)C)CC1)C1CCCC1 ZINC000539215127 1038884715 /nfs/dbraw/zinc/88/47/15/1038884715.db2.gz AOJSOGLLQJYJCW-NRFANRHFSA-N 2 0 330.516 4.389 20 0 EIADRP CCCOc1ccc([C@@H](C)[NH2+]CC[C@H]2CCCC[N@@H+]2C)cc1OC ZINC000539252280 1038895883 /nfs/dbraw/zinc/89/58/83/1038895883.db2.gz ILKJDAFIPRPSJX-SJLPKXTDSA-N 2 0 334.504 4.009 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H](CCc2ccccc2)Cc2ccccc2)CCN1C ZINC000462104073 1038907708 /nfs/dbraw/zinc/90/77/08/1038907708.db2.gz JONLIIFIIAHOBE-UEVCKROQSA-N 2 0 336.523 4.303 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(F)cc2C(F)(F)F)cc1 ZINC000414805561 1038988243 /nfs/dbraw/zinc/98/82/43/1038988243.db2.gz GNQYIJPDABCKDZ-LLVKDONJSA-N 2 0 326.337 4.154 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)ccc1Br ZINC000414812824 1039075386 /nfs/dbraw/zinc/07/53/86/1039075386.db2.gz RYQWLLNLGTYEGS-CYBMUJFWSA-N 2 0 333.273 4.067 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1ccc(OC)cc1 ZINC000120446860 1039107771 /nfs/dbraw/zinc/10/77/71/1039107771.db2.gz FXYURFGOVDKSPE-QGZVFWFLSA-N 2 0 326.484 4.388 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cccc(OC)c2)cc1 ZINC000120580461 1039179306 /nfs/dbraw/zinc/17/93/06/1039179306.db2.gz PRXFHMRHLZAGKD-QGZVFWFLSA-N 2 0 326.484 4.388 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cccc(OCc3ccccc3)c2)C1 ZINC000481294927 1039228912 /nfs/dbraw/zinc/22/89/12/1039228912.db2.gz MZQGGPMAXWLLAT-UYAOXDASSA-N 2 0 338.495 4.258 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCc3cc(F)ccc32)c1 ZINC000481296893 1039233442 /nfs/dbraw/zinc/23/34/42/1039233442.db2.gz VCCUXHMRKYTHTC-OAQYLSRUSA-N 2 0 326.459 4.445 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000481298470 1039238720 /nfs/dbraw/zinc/23/87/20/1039238720.db2.gz INBDZTSAJOQWME-DYESRHJHSA-N 2 0 344.449 4.180 20 0 EIADRP Cc1ccnc([C@H](C)[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000552277140 1039350633 /nfs/dbraw/zinc/35/06/33/1039350633.db2.gz PJUCXQMDZIZKDG-IRFCIJBXSA-N 2 0 337.511 4.341 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(N[C@@H]2CC[NH+](C)[C@H]3CCC[C@H]32)cc1 ZINC000552276355 1039354848 /nfs/dbraw/zinc/35/48/48/1039354848.db2.gz UNCGNKJUYDYSCW-YCZSINBZSA-N 2 0 341.543 4.346 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc2n[nH]cc2c1 ZINC000552336985 1039401798 /nfs/dbraw/zinc/40/17/98/1039401798.db2.gz LWAJWDORSHESDN-HNNXBMFYSA-N 2 0 326.488 4.011 20 0 EIADRP Fc1ccc2oc(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)nc2c1 ZINC000121760574 1039441883 /nfs/dbraw/zinc/44/18/83/1039441883.db2.gz BGQJNWITAJBARN-UHFFFAOYSA-N 2 0 345.462 4.055 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CC2(c3cccc(C(F)(F)F)c3)CCC2)CC[N@@H+]1C ZINC000122161076 1039605367 /nfs/dbraw/zinc/60/53/67/1039605367.db2.gz QHKXXMRBHYNJQP-WMLDXEAASA-N 2 0 340.433 4.199 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cccc(C)c1 ZINC000514106130 1039614410 /nfs/dbraw/zinc/61/44/10/1039614410.db2.gz VVFIDPMDGVQRTH-OAQYLSRUSA-N 2 0 326.484 4.176 20 0 EIADRP Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cn1 ZINC000514097965 1039635246 /nfs/dbraw/zinc/63/52/46/1039635246.db2.gz CHLSOGABQDBQPF-RJGXRXQPSA-N 2 0 349.522 4.170 20 0 EIADRP CC(C)SCC[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000514117981 1039647933 /nfs/dbraw/zinc/64/79/33/1039647933.db2.gz DCLYWMMCMKJAQR-UHFFFAOYSA-N 2 0 332.557 4.116 20 0 EIADRP c1ccc(-c2cccc(C[N@@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)c2)nc1 ZINC000093563983 1039714476 /nfs/dbraw/zinc/71/44/76/1039714476.db2.gz UXCZANJYSIIMHH-OAQYLSRUSA-N 2 0 335.495 4.199 20 0 EIADRP c1ccc(-c2cccc(C[N@@H+]3CCC[C@H]([NH+]4CCCC4)CC3)c2)nc1 ZINC000093563982 1039717381 /nfs/dbraw/zinc/71/73/81/1039717381.db2.gz UXCZANJYSIIMHH-NRFANRHFSA-N 2 0 335.495 4.199 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2cccc(OC(F)F)c2)CC1 ZINC000122708609 1039780284 /nfs/dbraw/zinc/78/02/84/1039780284.db2.gz COBGNWBIFMNUST-CQSZACIVSA-N 2 0 326.431 4.061 20 0 EIADRP COc1ccc(C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1OCC(C)C ZINC000061003192 1039780777 /nfs/dbraw/zinc/78/07/77/1039780777.db2.gz YMKHJGIFTNVXBU-UHFFFAOYSA-N 2 0 348.531 4.129 20 0 EIADRP CCC[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccccc1 ZINC000481724736 1039788573 /nfs/dbraw/zinc/78/85/73/1039788573.db2.gz NPIQQBZZDYKPSX-HXUWFJFHSA-N 2 0 326.484 4.258 20 0 EIADRP Cc1ccc(CCC[NH+]2CCC(c3ncc4n3CCCC4)CC2)cc1 ZINC000434680235 1039798874 /nfs/dbraw/zinc/79/88/74/1039798874.db2.gz UARYEQFAUNAUQW-UHFFFAOYSA-N 2 0 337.511 4.340 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCc2ccccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000505465512 1039803202 /nfs/dbraw/zinc/80/32/02/1039803202.db2.gz VRNJWMOSSZGMJE-YUXAGFNASA-N 2 0 334.507 4.217 20 0 EIADRP Clc1ccc(CCC[NH2+]C2CC[NH+](CC3CC3)CC2)c(Cl)c1 ZINC001168360957 1039812383 /nfs/dbraw/zinc/81/23/83/1039812383.db2.gz XXVNESPMZBGJDU-UHFFFAOYSA-N 2 0 341.326 4.390 20 0 EIADRP Cc1cccc(C)c1OCC[NH2+][C@@H]1CCN(C)[C@H](c2ccccc2)C1 ZINC000551013213 1039876578 /nfs/dbraw/zinc/87/65/78/1039876578.db2.gz GVXIAUWJKFJCRC-RTWAWAEBSA-N 2 0 338.495 4.107 20 0 EIADRP COc1ccc(Cl)cc1[C@H](CC(C)C)[NH2+]CCCC[NH+](C)C ZINC000552978188 1039893284 /nfs/dbraw/zinc/89/32/84/1039893284.db2.gz DSMGOMSLLPCEPN-KRWDZBQOSA-N 2 0 326.912 4.367 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccccc1-c1ccc(Cl)cc1 ZINC000481923495 1039898802 /nfs/dbraw/zinc/89/88/02/1039898802.db2.gz OQOFGLIBMMFBKR-QRWLVFNGSA-N 2 0 328.887 4.437 20 0 EIADRP CCC[C@@H]([NH2+]C1CC[NH+](CCCOC)CC1)c1ccc(Cl)cc1 ZINC000481928438 1039901290 /nfs/dbraw/zinc/90/12/90/1039901290.db2.gz AAAJFDGGHOBZMI-LJQANCHMSA-N 2 0 338.923 4.272 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1cccc(OCc2ccccc2)c1 ZINC000481957766 1039913635 /nfs/dbraw/zinc/91/36/35/1039913635.db2.gz MVWZNIIRFYYGQJ-ZWKOTPCHSA-N 2 0 326.484 4.256 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cnc(C3CCCC3)s2)CC1 ZINC000535082839 1039918987 /nfs/dbraw/zinc/91/89/87/1039918987.db2.gz DFDQUQLDUGJFON-UHFFFAOYSA-N 2 0 335.561 4.353 20 0 EIADRP CCCOc1cc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)ccc1OC ZINC000535082086 1039920026 /nfs/dbraw/zinc/92/00/26/1039920026.db2.gz NXCUDMNZPNAFNB-UHFFFAOYSA-N 2 0 348.531 4.036 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(C(F)(F)F)cc1 ZINC000623503877 1039980278 /nfs/dbraw/zinc/98/02/78/1039980278.db2.gz RFACSZBYBDEXGN-CZUORRHYSA-N 2 0 328.422 4.271 20 0 EIADRP Fc1ccccc1[C@H]1CC[C@H]([NH2+]C2CCN(c3ccccn3)CC2)C1 ZINC000482074515 1039982117 /nfs/dbraw/zinc/98/21/17/1039982117.db2.gz WHXVLYNKSMJYNE-WMZOPIPTSA-N 2 0 339.458 4.115 20 0 EIADRP Cc1cc(C[NH+](C)C)cc(N[C@@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000551147671 1040007309 /nfs/dbraw/zinc/00/73/09/1040007309.db2.gz HNIDGWRGKPLORZ-IRLDBZIGSA-N 2 0 337.511 4.304 20 0 EIADRP CCO[C@H](C[NH2+][C@@H]1CCN(C)[C@@H](c2ccccc2)C1)c1ccccc1 ZINC000551174998 1040017670 /nfs/dbraw/zinc/01/76/70/1040017670.db2.gz DXBBAXBMINPPBH-YPAWHYETSA-N 2 0 338.495 4.189 20 0 EIADRP CSc1ccc(CC[NH2+][C@H]2CCN(C)[C@@H](c3ccccc3)C2)cc1 ZINC000551174778 1040019765 /nfs/dbraw/zinc/01/97/65/1040019765.db2.gz DAIKOORIQDXPQY-PZJWPPBQSA-N 2 0 340.536 4.376 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@@H]1CC(C)(C)c2ccc(Br)cc21 ZINC000479067053 1040091688 /nfs/dbraw/zinc/09/16/88/1040091688.db2.gz XIWWABZNDZHXQO-MRXNPFEDSA-N 2 0 339.321 4.103 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCc2cccc(F)c2)CC1 ZINC000551268060 1040129995 /nfs/dbraw/zinc/12/99/95/1040129995.db2.gz YIGZFKCEPPXEQK-UHFFFAOYSA-N 2 0 340.486 4.401 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1c(Cl)ccc2cccnc21)c1ccccc1 ZINC000666977327 1040181543 /nfs/dbraw/zinc/18/15/43/1040181543.db2.gz PWRKZOIJZDVGKX-LJQANCHMSA-N 2 0 339.870 4.458 20 0 EIADRP C[NH+](C)CCC1CCN(Cc2cc(Cl)ccc2OC(F)F)CC1 ZINC000551383056 1040248324 /nfs/dbraw/zinc/24/83/24/1040248324.db2.gz DQSHNZMSGXAQAX-UHFFFAOYSA-N 2 0 346.849 4.105 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)CC1 ZINC000482500647 1040292287 /nfs/dbraw/zinc/29/22/87/1040292287.db2.gz AUFOQAUZBKQQDS-CQSZACIVSA-N 2 0 328.422 4.478 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2cc(C)ccc2OC(F)F)CC1 ZINC000482501636 1040302662 /nfs/dbraw/zinc/30/26/62/1040302662.db2.gz CBJVTLWUDRHNSX-OAHLLOKOSA-N 2 0 340.458 4.369 20 0 EIADRP c1ccc(C[C@@H]([NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)C2CC2)cc1 ZINC000479462196 1040370081 /nfs/dbraw/zinc/37/00/81/1040370081.db2.gz FPIKYDSQQWXYQU-FYYLOGMGSA-N 2 0 334.507 4.119 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000551530079 1040388470 /nfs/dbraw/zinc/38/84/70/1040388470.db2.gz NLMDRIMAVNBKAN-HUYLIWGRSA-N 2 0 332.532 4.143 20 0 EIADRP CC[C@@H](C[N@@H+](Cc1scnc1C)C[C@H]1CC[NH2+]C1)c1ccccc1 ZINC000435447649 1040395281 /nfs/dbraw/zinc/39/52/81/1040395281.db2.gz HVSMZVGYXGXIGI-ROUUACIJSA-N 2 0 343.540 4.057 20 0 EIADRP CCCCOc1ccc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1OCC ZINC000666996983 1040415742 /nfs/dbraw/zinc/41/57/42/1040415742.db2.gz OWFIKPKZZOVKGE-SFHVURJKSA-N 2 0 346.515 4.029 20 0 EIADRP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]CCCCC[NH+]1CCCC1 ZINC000515048527 1040446149 /nfs/dbraw/zinc/44/61/49/1040446149.db2.gz GAJFWVJOOZZVLP-INIZCTEOSA-N 2 0 342.449 4.492 20 0 EIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]CCCCC[NH+]1CCCC1 ZINC000515048528 1040447857 /nfs/dbraw/zinc/44/78/57/1040447857.db2.gz GAJFWVJOOZZVLP-MRXNPFEDSA-N 2 0 342.449 4.492 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[N@@H+]2C2CCCCC2)C1 ZINC000435742447 1040595938 /nfs/dbraw/zinc/59/59/38/1040595938.db2.gz NMMVJGFXELBHPM-HLLBOEOZSA-N 2 0 332.454 4.494 20 0 EIADRP c1c2ccccc2oc1C[NH+]1CCN(c2cc[nH+]c3ccccc32)CC1 ZINC000553884829 1040614856 /nfs/dbraw/zinc/61/48/56/1040614856.db2.gz TYOBUJZQEAWBMF-UHFFFAOYSA-N 2 0 343.430 4.303 20 0 EIADRP Oc1cccc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c1Cl ZINC000508858065 1040681173 /nfs/dbraw/zinc/68/11/73/1040681173.db2.gz RUVNXPQCXALWDJ-UHFFFAOYSA-N 2 0 336.907 4.134 20 0 EIADRP CN(Cc1ccccc1)[C@@H](C[NH2+]Cc1cccc2[nH]ccc21)C1CC1 ZINC000479870927 1040732812 /nfs/dbraw/zinc/73/28/12/1040732812.db2.gz CVDJUVIMVBENGI-QFIPXVFZSA-N 2 0 333.479 4.168 20 0 EIADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000504905722 1040738522 /nfs/dbraw/zinc/73/85/22/1040738522.db2.gz MWZUXDMIQYEOHG-CABCVRRESA-N 2 0 328.422 4.273 20 0 EIADRP COc1cc([C@@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)ccc1SC ZINC000483204026 1040760002 /nfs/dbraw/zinc/76/00/02/1040760002.db2.gz RXSIJQNSJBXHRJ-KDOFPFPSSA-N 2 0 338.561 4.434 20 0 EIADRP Cc1ccc(C[C@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)s1 ZINC000483312905 1040816266 /nfs/dbraw/zinc/81/62/66/1040816266.db2.gz WMHFHLAZUJDAEE-RDJZCZTQSA-N 2 0 346.540 4.279 20 0 EIADRP Cc1ncsc1CN(C[C@@H]1CC[NH2+]C1)[C@@H](C)c1cccc(Cl)c1 ZINC000436045944 1040837324 /nfs/dbraw/zinc/83/73/24/1040837324.db2.gz AAZMLIUXAPEVHS-LSDHHAIUSA-N 2 0 349.931 4.278 20 0 EIADRP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000669846974 1040851577 /nfs/dbraw/zinc/85/15/77/1040851577.db2.gz UIKYOLMWUFUGSM-PCCBWWKXSA-N 2 0 332.507 4.407 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](CCCOc3ccc4ccccc4c3)CC[C@@H]21 ZINC000483479436 1040873511 /nfs/dbraw/zinc/87/35/11/1040873511.db2.gz DWSGJCBCXCTQIF-IRLDBZIGSA-N 2 0 338.495 4.025 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](c2ccccc2F)C2CCOCC2)C1 ZINC000903090962 1040897983 /nfs/dbraw/zinc/89/79/83/1040897983.db2.gz KAKOUIHRIQXDMR-UWJYYQICSA-N 2 0 348.506 4.003 20 0 EIADRP CC[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)C1CCOCC1 ZINC000537940132 1040906707 /nfs/dbraw/zinc/90/67/07/1040906707.db2.gz VNUXUOXSFYICHU-CBQOVEMMSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@@H]1C[C@H](N[C@H](COCc2ccccc2)c2ccccc2)CC[N@@H+]1C ZINC000537980878 1040948903 /nfs/dbraw/zinc/94/89/03/1040948903.db2.gz OIJARRVZJYUPQN-STZQEDGTSA-N 2 0 338.495 4.017 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)o1 ZINC000483654651 1040949895 /nfs/dbraw/zinc/94/98/95/1040949895.db2.gz OJXVVOZISDNUCT-FUHWJXTLSA-N 2 0 344.499 4.200 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@H](C)N(C)C1CC1 ZINC000462805136 1040971354 /nfs/dbraw/zinc/97/13/54/1040971354.db2.gz MJTAMGJJFYDZKO-CVEARBPZSA-N 2 0 327.516 4.296 20 0 EIADRP c1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH2+][C@@H]4CCCSCC4)C[C@@H]3C2)cc1 ZINC000898519247 1040971873 /nfs/dbraw/zinc/97/18/73/1040971873.db2.gz OBFQDPVLDUINKF-BQJUDKOJSA-N 2 0 344.568 4.162 20 0 EIADRP C[NH+]1CCC(CC[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)CC1 ZINC000436226470 1040976714 /nfs/dbraw/zinc/97/67/14/1040976714.db2.gz IIEJDJPLGPDNSC-UHFFFAOYSA-N 2 0 334.813 4.180 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](COC)c2ccccc2)c1 ZINC000554348715 1041020863 /nfs/dbraw/zinc/02/08/63/1041020863.db2.gz DPEPFKMCAOUBPX-OAQYLSRUSA-N 2 0 326.484 4.006 20 0 EIADRP CCN(CC)[C@@H](C[NH2+][C@H](c1cccnc1)C(C)C)c1ccccc1 ZINC000538060567 1041029982 /nfs/dbraw/zinc/02/99/82/1041029982.db2.gz NNKYZICGTMYVAD-SFTDATJTSA-N 2 0 325.500 4.451 20 0 EIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+][C@@H]2CC[C@@H]2C2CC2)CC1 ZINC000554360896 1041036980 /nfs/dbraw/zinc/03/69/80/1041036980.db2.gz NOJUEJRABOUHFF-UYAOXDASSA-N 2 0 332.919 4.330 20 0 EIADRP COC1(C[NH2+]C2CC[NH+](C(C)C)CC2)CCC(c2ccccc2)CC1 ZINC000554370137 1041048384 /nfs/dbraw/zinc/04/83/84/1041048384.db2.gz KBTZEYMGAIVNBF-UHFFFAOYSA-N 2 0 344.543 4.192 20 0 EIADRP Fc1ccccc1[C@H]1C[C@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C1 ZINC000436308794 1041099191 /nfs/dbraw/zinc/09/91/91/1041099191.db2.gz NESUPHNRMYVBIO-SAABIXHNSA-N 2 0 330.491 4.458 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc(Cl)cn1 ZINC000480232910 1041111694 /nfs/dbraw/zinc/11/16/94/1041111694.db2.gz YFOWFDDJVUIRTI-CQSZACIVSA-N 2 0 349.931 4.359 20 0 EIADRP C[C@H](Nc1cc2c(c[nH+]1)CCCC2)c1ccc(OCC[NH+](C)C)cc1 ZINC000462940564 1041121263 /nfs/dbraw/zinc/12/12/63/1041121263.db2.gz BVJQEWQNHPVBHI-INIZCTEOSA-N 2 0 339.483 4.074 20 0 EIADRP C[C@@H](Nc1cc2c(c[nH+]1)CCCC2)c1ccc(OCC[NH+](C)C)cc1 ZINC000462940565 1041123261 /nfs/dbraw/zinc/12/32/61/1041123261.db2.gz BVJQEWQNHPVBHI-MRXNPFEDSA-N 2 0 339.483 4.074 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)CCC2 ZINC000540148316 1041161934 /nfs/dbraw/zinc/16/19/34/1041161934.db2.gz YVPQNKRDNLQWPH-UWJYYQICSA-N 2 0 330.516 4.030 20 0 EIADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000540143048 1041165882 /nfs/dbraw/zinc/16/58/82/1041165882.db2.gz BZAPHNCSVUFNDJ-JTSKRJEESA-N 2 0 338.495 4.274 20 0 EIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)C(C)(C)c1ccccc1 ZINC000540137538 1041180111 /nfs/dbraw/zinc/18/01/11/1041180111.db2.gz FXMHXIOXDVMTDO-GOSISDBHSA-N 2 0 337.511 4.254 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1 ZINC000484289489 1041197574 /nfs/dbraw/zinc/19/75/74/1041197574.db2.gz FXQQQBPMPTVTEA-BLLLJJGKSA-N 2 0 333.303 4.001 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1cccc(NC(C)=O)c1 ZINC000484293014 1041197782 /nfs/dbraw/zinc/19/77/82/1041197782.db2.gz PWYHZOVNGHSYEW-LKUPVBHCSA-N 2 0 345.531 4.196 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cc2cc(C)c(C)cc2o1 ZINC000484299170 1041203463 /nfs/dbraw/zinc/20/34/63/1041203463.db2.gz DSUOWGFDLAGAPL-FUHWJXTLSA-N 2 0 332.488 4.057 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1cccc(O)c1 ZINC000194839364 1041228908 /nfs/dbraw/zinc/22/89/08/1041228908.db2.gz VXGOHABCKGKHRE-GOSISDBHSA-N 2 0 338.495 4.475 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]CCCCn1ccnc1 ZINC000554553019 1041236433 /nfs/dbraw/zinc/23/64/33/1041236433.db2.gz BAEUUJYONQESFT-QINSGFPZSA-N 2 0 337.389 4.375 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1cccc(OC(F)(F)F)c1 ZINC000484475480 1041270015 /nfs/dbraw/zinc/27/00/15/1041270015.db2.gz RRWSQYWEZSECIN-CFVMTHIKSA-N 2 0 330.394 4.109 20 0 EIADRP Cc1ccc(C[C@@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C2CC2)cc1 ZINC000484497316 1041275090 /nfs/dbraw/zinc/27/50/90/1041275090.db2.gz FUVIWCYVNDZLLV-JOCHJYFZSA-N 2 0 326.528 4.313 20 0 EIADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc2ccccc2c1OC(F)F ZINC000538406080 1041301816 /nfs/dbraw/zinc/30/18/16/1041301816.db2.gz ORJNPBHTLSXSSE-AWEZNQCLSA-N 2 0 346.421 4.354 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1 ZINC000538502529 1041381936 /nfs/dbraw/zinc/38/19/36/1041381936.db2.gz YBQFIHXHLPZWER-KRWDZBQOSA-N 2 0 328.475 4.307 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)c(OC)c1 ZINC000480608404 1041420487 /nfs/dbraw/zinc/42/04/87/1041420487.db2.gz KUTNPWBQVZABKY-IAGOWNOFSA-N 2 0 334.504 4.009 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2c(c1)COC2 ZINC000480612954 1041423259 /nfs/dbraw/zinc/42/32/59/1041423259.db2.gz RPJSHZXXKGXWNW-KSZLIROESA-N 2 0 330.516 4.126 20 0 EIADRP COc1ccc(OC)c([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)c1 ZINC000480617991 1041426944 /nfs/dbraw/zinc/42/69/44/1041426944.db2.gz VRBMIILHSPLWRZ-IAGOWNOFSA-N 2 0 334.504 4.009 20 0 EIADRP CC[NH+]1CCC([NH2+]CCc2ccc(Oc3ccc(F)cc3)cc2)CC1 ZINC000540395455 1041427451 /nfs/dbraw/zinc/42/74/51/1041427451.db2.gz SPMIFFFIDRHBRX-UHFFFAOYSA-N 2 0 342.458 4.234 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(C(C)C)c2)[C@H](C)C1 ZINC000480674049 1041464799 /nfs/dbraw/zinc/46/47/99/1041464799.db2.gz WPLMDACGDOAROX-WIYYLYMNSA-N 2 0 332.532 4.037 20 0 EIADRP c1ccc(C[N@H+]2CC[C@@H](C[NH2+][C@@H]3CCSc4ccccc43)C2)cc1 ZINC000195134379 1041486237 /nfs/dbraw/zinc/48/62/37/1041486237.db2.gz UIUPMCIFKFYCKM-AZUAARDMSA-N 2 0 338.520 4.335 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Br)cc2C)C[C@@H]1C ZINC000538718057 1041488080 /nfs/dbraw/zinc/48/80/80/1041488080.db2.gz RUEVPYXSJWBQJQ-WMLDXEAASA-N 2 0 339.321 4.062 20 0 EIADRP C[N@H+](C[C@H]1C[C@@H]1c1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000538731489 1041501006 /nfs/dbraw/zinc/50/10/06/1041501006.db2.gz PGEYQDXHYOLBLN-MDNUFGMLSA-N 2 0 334.507 4.244 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc(-c4ccccc4F)o3)CC[C@H]21 ZINC000538799165 1041539738 /nfs/dbraw/zinc/53/97/38/1041539738.db2.gz RRENVKHCEKAYTI-DNVCBOLYSA-N 2 0 328.431 4.002 20 0 EIADRP c1sc2ccccc2c1C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000538799445 1041540244 /nfs/dbraw/zinc/54/02/44/1041540244.db2.gz GDYBWSBGAIJXDZ-DNVCBOLYSA-N 2 0 326.509 4.350 20 0 EIADRP CC1(C[NH2+]Cc2ccc(-c3nc4ccccc4s3)o2)CC[NH2+]CC1 ZINC000414895991 1041600496 /nfs/dbraw/zinc/60/04/96/1041600496.db2.gz AILJKMCPQMTSJZ-UHFFFAOYSA-N 2 0 341.480 4.036 20 0 EIADRP CC[N@@H+]1CC[C@H](Nc2ccc(C[NH+]3CCCC[C@@H]3C)cc2)[C@H](C)C1 ZINC000540699432 1041613704 /nfs/dbraw/zinc/61/37/04/1041613704.db2.gz FDEHMQRWLSYIBQ-LQWHRVPQSA-N 2 0 329.532 4.203 20 0 EIADRP CC[N@@H+]1CC[C@H](Nc2ccc(C[NH+]3CCCC[C@H]3C)cc2)[C@@H](C)C1 ZINC000540699434 1041613972 /nfs/dbraw/zinc/61/39/72/1041613972.db2.gz FDEHMQRWLSYIBQ-UEXGIBASSA-N 2 0 329.532 4.203 20 0 EIADRP [NH3+]CCCC[NH2+]Cc1ccc(-c2ccc(Br)cc2)s1 ZINC000414898260 1041638913 /nfs/dbraw/zinc/63/89/13/1041638913.db2.gz DMUSAOMSGNVLHX-UHFFFAOYSA-N 2 0 339.302 4.006 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414900470 1041738000 /nfs/dbraw/zinc/73/80/00/1041738000.db2.gz DSKJKEABPHYFNM-PBHICJAKSA-N 2 0 328.422 4.006 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@@H]2CCCc3c4ccccc4[nH]c32)CC1 ZINC000516808406 1041768683 /nfs/dbraw/zinc/76/86/83/1041768683.db2.gz LVZAOTNHLCOIDG-HXUWFJFHSA-N 2 0 325.500 4.255 20 0 EIADRP CC[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000402486990 1041818873 /nfs/dbraw/zinc/81/88/73/1041818873.db2.gz ASRVHNKRKAKRDR-BQFCYCMXSA-N 2 0 342.449 4.465 20 0 EIADRP CC(C)(Cc1ccc(F)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167962214 1041865064 /nfs/dbraw/zinc/86/50/64/1041865064.db2.gz VLMMKRRMNBWSII-IHWFROFDSA-N 2 0 330.491 4.142 20 0 EIADRP c1csc(CN2CCC[C@@H](C[NH2+]Cc3ccc4[nH]ccc4c3)C2)c1 ZINC000517172206 1041890019 /nfs/dbraw/zinc/89/00/19/1041890019.db2.gz FOFYHLBUHGKCMH-KRWDZBQOSA-N 2 0 339.508 4.231 20 0 EIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCCOCc3ccccc3)C2)CC1 ZINC000541591194 1042025410 /nfs/dbraw/zinc/02/54/10/1042025410.db2.gz RTBXGWILTLFDDW-JOCHJYFZSA-N 2 0 344.543 4.037 20 0 EIADRP c1ccc(OCCCCC[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000438121443 1042062473 /nfs/dbraw/zinc/06/24/73/1042062473.db2.gz PKEDYNLRPXFFJI-KNQAVFIVSA-N 2 0 342.527 4.184 20 0 EIADRP CCCC[C@H](CC)C[N@@H+]1CCC[C@@]2(CCC[NH+](C[C@H](C)CO)C2)C1 ZINC001280201521 1042112917 /nfs/dbraw/zinc/11/29/17/1042112917.db2.gz SMDWAPFRCSZCJC-PCCBWWKXSA-N 2 0 338.580 4.009 20 0 EIADRP Cc1nc(C(C)C)ccc1CN1C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000550000704 1042123615 /nfs/dbraw/zinc/12/36/15/1042123615.db2.gz WVFMBIWWTKWCIM-SZPZYZBQSA-N 2 0 349.522 4.077 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CCCc4cc(N)ccc43)CC2)C1 ZINC000414928570 1042162240 /nfs/dbraw/zinc/16/22/40/1042162240.db2.gz MVGZCRAKIBUJSF-QGCDCVKKSA-N 2 0 341.543 4.279 20 0 EIADRP C[N@H+](CCSc1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464833798 1042180049 /nfs/dbraw/zinc/18/00/49/1042180049.db2.gz GCIMVBJBGAPILU-FQEVSTJZSA-N 2 0 340.536 4.233 20 0 EIADRP C[C@H]([NH2+]CCCOc1ccc(F)cc1)c1cccc(-n2ccnc2)c1 ZINC000542010146 1042231015 /nfs/dbraw/zinc/23/10/15/1042231015.db2.gz WMJKEUYSTCWBAB-INIZCTEOSA-N 2 0 339.414 4.131 20 0 EIADRP C[N@H+](CCC[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1)Cc1ccccc1 ZINC000303093373 1042296564 /nfs/dbraw/zinc/29/65/64/1042296564.db2.gz BUXAZRPSNGJMET-IRXDYDNUSA-N 2 0 328.422 4.219 20 0 EIADRP C([C@@H]1CCC2(CCCC2)O1)[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000669927525 1042329714 /nfs/dbraw/zinc/32/97/14/1042329714.db2.gz GOJUTYVMPORKRW-FQEVSTJZSA-N 2 0 334.548 4.066 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000438830244 1042372172 /nfs/dbraw/zinc/37/21/72/1042372172.db2.gz NLRUFDRDKXFAOK-HXUWFJFHSA-N 2 0 325.500 4.316 20 0 EIADRP COc1ccc(Oc2ccc(C[NH2+][C@H]3CC[N@H+](C)[C@@H](C)C3)cc2)cc1 ZINC000542322937 1042388359 /nfs/dbraw/zinc/38/83/59/1042388359.db2.gz NGRSGYTZFYGJTN-WMZOPIPTSA-N 2 0 340.467 4.060 20 0 EIADRP CC(C)Oc1ccc([C@H]2CCC[C@H]2[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)cc1 ZINC000415000254 1042676762 /nfs/dbraw/zinc/67/67/62/1042676762.db2.gz AOKSGEPSJSBNAV-CIAFKFPVSA-N 2 0 342.527 4.088 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(Cl)s1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309912989 1042824167 /nfs/dbraw/zinc/82/41/67/1042824167.db2.gz MWGOGHDMVJUKMZ-GOEBONIOSA-N 2 0 334.916 4.402 20 0 EIADRP CCc1ncc(CNC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)s1 ZINC000310422757 1042836548 /nfs/dbraw/zinc/83/65/48/1042836548.db2.gz QXTJIKRHAYEAQQ-GOSISDBHSA-N 2 0 343.540 4.097 20 0 EIADRP Cc1cc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1F ZINC000310522227 1042839579 /nfs/dbraw/zinc/83/95/79/1042839579.db2.gz NVJWGIYVOVMALP-FXAWDEMLSA-N 2 0 326.459 4.134 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1ccc(OCc2ccccc2)cc1 ZINC000311016328 1042851096 /nfs/dbraw/zinc/85/10/96/1042851096.db2.gz NADWJIPWPYTHFU-HMFYCAOWSA-N 2 0 338.495 4.084 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc2ccccc2n1 ZINC000178099075 1042859012 /nfs/dbraw/zinc/85/90/12/1042859012.db2.gz DXRAEQFAPDHHRN-MSOLQXFVSA-N 2 0 325.500 4.398 20 0 EIADRP C[C@@H]1CC([NH2+]C(C)(C)c2cccnc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168005145 1042958396 /nfs/dbraw/zinc/95/83/96/1042958396.db2.gz GVPDKMDFNUROHO-QZTJIDSGSA-N 2 0 337.511 4.348 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2cc(Br)cs2)CC1 ZINC000493898287 1042980698 /nfs/dbraw/zinc/98/06/98/1042980698.db2.gz VPELJEWVSRJMHN-GFCCVEGCSA-N 2 0 345.350 4.283 20 0 EIADRP Cc1cncc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)c1 ZINC000184280299 1043087890 /nfs/dbraw/zinc/08/78/90/1043087890.db2.gz JWXLXLQZJULKQX-IBGZPJMESA-N 2 0 337.511 4.473 20 0 EIADRP c1nc(C2CC2)c(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)s1 ZINC000494927730 1043089955 /nfs/dbraw/zinc/08/99/55/1043089955.db2.gz AURAOJWMTIVDDH-UHFFFAOYSA-N 2 0 333.545 4.109 20 0 EIADRP CCO[C@@H]1C[C@@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C12CCCCC2 ZINC000766187437 1043156743 /nfs/dbraw/zinc/15/67/43/1043156743.db2.gz MMJBVNQTENXNJV-WOJBJXKFSA-N 2 0 334.548 4.111 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(OCC(F)F)c1)c1cccc(C[NH+](C)C)c1 ZINC000925364633 1043184785 /nfs/dbraw/zinc/18/47/85/1043184785.db2.gz PFHDDSQWLRUUAB-HNNXBMFYSA-N 2 0 348.437 4.243 20 0 EIADRP FC(F)(F)C1CCC(C[NH+]2CCC(C[NH+]3CCCC3)CC2)CC1 ZINC000185495179 1043190918 /nfs/dbraw/zinc/19/09/18/1043190918.db2.gz QYQDUBDTBGGSPL-UHFFFAOYSA-N 2 0 332.454 4.163 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1sccc1OC ZINC000186089391 1043244829 /nfs/dbraw/zinc/24/48/29/1043244829.db2.gz HKAFEQMKDNJIBL-HNNXBMFYSA-N 2 0 332.513 4.449 20 0 EIADRP COc1cccc2cc(C[NH2+]CCCC[NH+]3C[C@H](C)C[C@@H](C)C3)oc21 ZINC000727643566 1043255329 /nfs/dbraw/zinc/25/53/29/1043255329.db2.gz BNHXCXDIECWQRZ-IAGOWNOFSA-N 2 0 344.499 4.289 20 0 EIADRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3OC)cc2)C1 ZINC000508135284 1043288099 /nfs/dbraw/zinc/28/80/99/1043288099.db2.gz DICRAPBCINJDPH-LJQANCHMSA-N 2 0 338.495 4.184 20 0 EIADRP COc1ccc(C[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001168010948 1043299367 /nfs/dbraw/zinc/29/93/67/1043299367.db2.gz LOTJLHBZHXKZEK-ROUUACIJSA-N 2 0 338.495 4.226 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2cccnc2c1 ZINC000674067646 1043386173 /nfs/dbraw/zinc/38/61/73/1043386173.db2.gz MRFXEFYUGRPDEB-PGRDOPGGSA-N 2 0 345.490 4.235 20 0 EIADRP CN(C)c1ccc(N2CCC([NH2+][C@H]3CCCCC3(C)C)CC2)cc1 ZINC000766189626 1043398002 /nfs/dbraw/zinc/39/80/02/1043398002.db2.gz GLLPCIWJFIAJRZ-FQEVSTJZSA-N 2 0 329.532 4.280 20 0 EIADRP CCC1(C[NH2+]C2CCC(OC)CC2)CC[NH+](Cc2ccccc2)CC1 ZINC000542485219 1043579555 /nfs/dbraw/zinc/57/95/55/1043579555.db2.gz AYVWDTIDXLOVJY-UHFFFAOYSA-N 2 0 344.543 4.226 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000665280595 1043661521 /nfs/dbraw/zinc/66/15/21/1043661521.db2.gz HDJCGOSBILDOAR-RHSMWYFYSA-N 2 0 331.529 4.066 20 0 EIADRP CCCc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658069298 1043739391 /nfs/dbraw/zinc/73/93/91/1043739391.db2.gz LVSZOOMOXBFOAD-GOSISDBHSA-N 2 0 344.543 4.181 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cnn(C(C)C)c2C)c1 ZINC000191267099 1043803878 /nfs/dbraw/zinc/80/38/78/1043803878.db2.gz CTGASTRYSRYJTN-INIZCTEOSA-N 2 0 328.504 4.075 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000442705873 1043812960 /nfs/dbraw/zinc/81/29/60/1043812960.db2.gz CEWCTJQGZHYVAP-UWWQBHOKSA-N 2 0 340.433 4.273 20 0 EIADRP COCCC[C@H]([NH2+]C[C@@H](C)C[NH+]1CCCCC1)c1ccc(F)cc1 ZINC000442723113 1043823241 /nfs/dbraw/zinc/82/32/41/1043823241.db2.gz YONZDLNTGGLDAV-XLIONFOSSA-N 2 0 336.495 4.005 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CC(C)(C)c2ccc(C(F)(F)F)cc2)CC[N@@H+]1C ZINC000191548954 1043825747 /nfs/dbraw/zinc/82/57/47/1043825747.db2.gz MDHZUEBSKVIIJX-BBRMVZONSA-N 2 0 328.422 4.055 20 0 EIADRP C[C@@H]1CC([NH2+]CCc2ccsc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168014382 1043826448 /nfs/dbraw/zinc/82/64/48/1043826448.db2.gz KVFMGYFOBRQZKB-IAGOWNOFSA-N 2 0 328.525 4.322 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442829246 1043859327 /nfs/dbraw/zinc/85/93/27/1043859327.db2.gz UJKWAAVFNUKVRJ-SJLPKXTDSA-N 2 0 338.417 4.193 20 0 EIADRP [NH3+]CC[C@H]1CCC[N@H+](Cc2ccc(-c3nc4ccccc4s3)o2)C1 ZINC000442918224 1043890146 /nfs/dbraw/zinc/89/01/46/1043890146.db2.gz CEHOTZQZWDEMIZ-CQSZACIVSA-N 2 0 341.480 4.117 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2cc3ccccc3nc2Cl)CC1 ZINC000079492085 1043926144 /nfs/dbraw/zinc/92/61/44/1043926144.db2.gz MZLUQNDIWWFBLE-UHFFFAOYSA-N 2 0 331.891 4.052 20 0 EIADRP C[C@@H](c1ccc(OC(F)F)cc1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000067457436 1043955570 /nfs/dbraw/zinc/95/55/70/1043955570.db2.gz JYGBULFAXQYRFY-AWEZNQCLSA-N 2 0 326.431 4.013 20 0 EIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]Cc3ccc4ncccc4c3)CC2)C1 ZINC000192982792 1043987260 /nfs/dbraw/zinc/98/72/60/1043987260.db2.gz RWWYCQXGMLSRCG-LAUBAEHRSA-N 2 0 337.511 4.368 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2cnc(-c3ccco3)s2)CC1 ZINC000193007121 1043992727 /nfs/dbraw/zinc/99/27/27/1043992727.db2.gz ADKFNUGZLGPNNN-UHFFFAOYSA-N 2 0 333.501 4.005 20 0 EIADRP COC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCCC1 ZINC000193304082 1044037521 /nfs/dbraw/zinc/03/75/21/1044037521.db2.gz JNVFOCBAGAZFCR-SEJPIABJSA-N 2 0 342.527 4.121 20 0 EIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)oc1C ZINC000282341136 1044172138 /nfs/dbraw/zinc/17/21/38/1044172138.db2.gz VHEFVEDZCRTDAE-INIZCTEOSA-N 2 0 330.472 4.078 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(Br)cs2)C1 ZINC000194027906 1044243559 /nfs/dbraw/zinc/24/35/59/1044243559.db2.gz FBVDPBPAPAFXNI-QWHCGFSZSA-N 2 0 345.350 4.282 20 0 EIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccc(F)cc1 ZINC000174450089 1044273444 /nfs/dbraw/zinc/27/34/44/1044273444.db2.gz RPIYPSPQSNERRV-UHFFFAOYSA-N 2 0 338.426 4.341 20 0 EIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccsc1 ZINC000174450451 1044274409 /nfs/dbraw/zinc/27/44/09/1044274409.db2.gz CCCHVZOVYABMTN-UHFFFAOYSA-N 2 0 326.465 4.263 20 0 EIADRP c1cc(OCC[NH+]2CCCC2)ccc1CC[NH2+][C@@H]1CCC12CCCC2 ZINC000474045495 1044293371 /nfs/dbraw/zinc/29/33/71/1044293371.db2.gz PBGHAEJROITUHQ-OAQYLSRUSA-N 2 0 342.527 4.016 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)C1CCC(F)(F)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000474079413 1044357916 /nfs/dbraw/zinc/35/79/16/1044357916.db2.gz IXISZHDEECMEMO-UXLLHSPISA-N 2 0 328.491 4.443 20 0 EIADRP C([NH2+]C1CCC2(CCCCC2)CC1)C1CC[NH+](C2CCOCC2)CC1 ZINC000657537207 1044378277 /nfs/dbraw/zinc/37/82/77/1044378277.db2.gz CJHKRFFFVKWBTM-UHFFFAOYSA-N 2 0 348.575 4.360 20 0 EIADRP CCC(C)(C)[NH2+][C@@H](C)C(=O)Nc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000542515437 1044393994 /nfs/dbraw/zinc/39/39/94/1044393994.db2.gz YGUPKMUGHAVJQG-IRXDYDNUSA-N 2 0 345.531 4.024 20 0 EIADRP C[C@@H]([NH2+][C@H](c1cccs1)c1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC000675732681 1044449596 /nfs/dbraw/zinc/44/95/96/1044449596.db2.gz DJANSWWUFZUNJK-KUHUBIRLSA-N 2 0 332.488 4.297 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCc3c4ccccc4[nH]c32)C1 ZINC000675728291 1044460008 /nfs/dbraw/zinc/46/00/08/1044460008.db2.gz FVLGTTIIQYEYGU-OXJNMPFZSA-N 2 0 325.500 4.255 20 0 EIADRP CC1CC[NH+](CCC[NH2+][C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000494880273 1044464645 /nfs/dbraw/zinc/46/46/45/1044464645.db2.gz RXSSHALTDWKEBC-GHTZIAJQSA-N 2 0 348.506 4.005 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)C1CC[NH+](C)CC1)c1c(Cl)cccc1Cl ZINC000675802978 1044504578 /nfs/dbraw/zinc/50/45/78/1044504578.db2.gz JNPQDGISKNZLDF-STQMWFEESA-N 2 0 329.315 4.417 20 0 EIADRP Cc1cccc(C(=[NH2+])N[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168022690 1044532366 /nfs/dbraw/zinc/53/23/66/1044532366.db2.gz AWSYDFILNBJKKO-RMFSNUHRSA-N 2 0 335.495 4.352 20 0 EIADRP CC(C)(C[NH2+][C@@H](C[C@@H]1CCOC1)c1ccc(F)cc1)C[NH+]1CCCC1 ZINC000494937810 1044534146 /nfs/dbraw/zinc/53/41/46/1044534146.db2.gz GBNQSQVRKSUPFS-PXNSSMCTSA-N 2 0 348.506 4.005 20 0 EIADRP C[C@@H]1CC([NH2+][C@H]2CCc3ncccc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168024269 1044606891 /nfs/dbraw/zinc/60/68/91/1044606891.db2.gz CZYMKNIIAFRCFI-YVHKJVDXSA-N 2 0 335.495 4.100 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H](c2ccccc2C)C2CCCC2)CC1 ZINC000495060851 1044623925 /nfs/dbraw/zinc/62/39/25/1044623925.db2.gz RWJITJLDKPSRSN-QFIPXVFZSA-N 2 0 344.543 4.317 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000495072532 1044640380 /nfs/dbraw/zinc/64/03/80/1044640380.db2.gz SDANDMHRXUZNQI-GHTZIAJQSA-N 2 0 348.506 4.005 20 0 EIADRP C[C@H]([NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1)c1ccc(N)cc1 ZINC001168028533 1044744238 /nfs/dbraw/zinc/74/42/38/1044744238.db2.gz PGIKSLUUXRPRBE-KURKYZTESA-N 2 0 337.511 4.361 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(C(F)(F)F)s2)C1 ZINC000428874630 1044802902 /nfs/dbraw/zinc/80/29/02/1044802902.db2.gz ADXXFIMPOVGKBN-CYBMUJFWSA-N 2 0 334.451 4.369 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+]C/C(C)=C/c2cccc(C(F)(F)F)c2)C1 ZINC000673600442 1044854945 /nfs/dbraw/zinc/85/49/45/1044854945.db2.gz XCQRJQGARZZKLI-SCZPIIQISA-N 2 0 326.406 4.040 20 0 EIADRP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+]CCCCn1ccnc1 ZINC000673600665 1044859616 /nfs/dbraw/zinc/85/96/16/1044859616.db2.gz GAFMGZSUFQACPA-RVDMUPIBSA-N 2 0 337.389 4.375 20 0 EIADRP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000673600220 1044861674 /nfs/dbraw/zinc/86/16/74/1044861674.db2.gz WPAXHEQWJOTUKX-LNLBINEFSA-N 2 0 338.417 4.325 20 0 EIADRP Clc1cccc2c1C[C@@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001168735393 1044979924 /nfs/dbraw/zinc/97/99/24/1044979924.db2.gz SDIDRTWYDFKIIE-MSOLQXFVSA-N 2 0 332.919 4.148 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2ccc(CSC(F)F)o2)CC1 ZINC000922848332 1044997296 /nfs/dbraw/zinc/99/72/96/1044997296.db2.gz RKVBABJRTMGJOE-UHFFFAOYSA-N 2 0 344.471 4.232 20 0 EIADRP CC[NH+]1CCC([NH2+]CCCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000474469766 1045009191 /nfs/dbraw/zinc/00/91/91/1045009191.db2.gz MKCZXPSLNPIVHJ-UHFFFAOYSA-N 2 0 329.315 4.390 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCCNc3ccccc32)C1 ZINC000347919702 1045097902 /nfs/dbraw/zinc/09/79/02/1045097902.db2.gz KIPXHLLYKJFQPS-LVCYWYKZSA-N 2 0 329.532 4.281 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)CCC2 ZINC000673665621 1045191115 /nfs/dbraw/zinc/19/11/15/1045191115.db2.gz YLBPWJNLPGOVFW-QFIPXVFZSA-N 2 0 338.495 4.103 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2scnc2C2CC2)c1 ZINC000486928762 1045218768 /nfs/dbraw/zinc/21/87/68/1045218768.db2.gz OESFHKVLHAEPCI-UHFFFAOYSA-N 2 0 329.513 4.152 20 0 EIADRP CC[N@@H+]1CC[C@H](N[C@@H]2CCOc3c(Cl)c(Cl)ccc32)[C@H](C)C1 ZINC000766259411 1045251188 /nfs/dbraw/zinc/25/11/88/1045251188.db2.gz YLSAAUYOGXAUSR-BYCMXARLSA-N 2 0 343.298 4.137 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccccc1F ZINC000495763696 1045328265 /nfs/dbraw/zinc/32/82/65/1045328265.db2.gz HJBVIVKIFCCPAM-HNNXBMFYSA-N 2 0 332.488 4.450 20 0 EIADRP c1ccc(C(C[NH2+]C2CC[NH+](CC3CC3)CC2)c2ccccc2)cc1 ZINC000236718503 1045364667 /nfs/dbraw/zinc/36/46/67/1045364667.db2.gz FYWLFKWFBPDZFF-UHFFFAOYSA-N 2 0 334.507 4.283 20 0 EIADRP CCCC[NH+]1CCC([NH2+]Cc2ccc3cc(OC)ccc3c2)CC1 ZINC000236767405 1045365833 /nfs/dbraw/zinc/36/58/33/1045365833.db2.gz DPYOWUWIFBEPDW-UHFFFAOYSA-N 2 0 326.484 4.203 20 0 EIADRP Cc1ccc(COc2ccc(C[NH2+]C[C@H]3CCC[N@@H+](C)C3)cc2)cc1 ZINC000237185112 1045377211 /nfs/dbraw/zinc/37/72/11/1045377211.db2.gz ZUXVTLSWGBONAT-OAQYLSRUSA-N 2 0 338.495 4.005 20 0 EIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CCc1cccs1 ZINC000763079955 1045499421 /nfs/dbraw/zinc/49/94/21/1045499421.db2.gz CTXUXOWMXAWYIR-YRWFTTLQSA-N 2 0 328.525 4.037 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767874479 1045668814 /nfs/dbraw/zinc/66/88/14/1045668814.db2.gz FUWBUTWZHJRUHT-AEFFLSMTSA-N 2 0 340.433 4.369 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1ccc2c(c1)CCCO2 ZINC000768101493 1045713781 /nfs/dbraw/zinc/71/37/81/1045713781.db2.gz HISCZRPDWNOOSY-YLJYHZDGSA-N 2 0 330.516 4.173 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(CSC(F)F)o2)CC1 ZINC000768302535 1045784588 /nfs/dbraw/zinc/78/45/88/1045784588.db2.gz HRTKTGIQWXXGHQ-UHFFFAOYSA-N 2 0 346.487 4.289 20 0 EIADRP Cc1nc2c(s1)[C@H]([NH2+][C@H](C)[C@H]1CCC[N@@H+](C3CCC3)C1)CCC2 ZINC000248392816 1045867713 /nfs/dbraw/zinc/86/77/13/1045867713.db2.gz DHDHOQQKKDMISZ-UKPHBRMFSA-N 2 0 333.545 4.072 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccccc2N2CCCCC2)CC1 ZINC000769498062 1045994393 /nfs/dbraw/zinc/99/43/93/1045994393.db2.gz KYWLLEIFXSNEJE-UHFFFAOYSA-N 2 0 343.559 4.231 20 0 EIADRP c1ccc2c(c1)cncc2C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000769513268 1046003497 /nfs/dbraw/zinc/00/34/97/1046003497.db2.gz AUEJVAILSPAIPA-UHFFFAOYSA-N 2 0 337.511 4.323 20 0 EIADRP CCc1noc(C)c1[C@@H](C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000769872217 1046100393 /nfs/dbraw/zinc/10/03/93/1046100393.db2.gz HUEUCNXDTDSIKV-CQSZACIVSA-N 2 0 347.528 4.170 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C(c1ccccc1)c1ccccc1 ZINC000124379428 1046234763 /nfs/dbraw/zinc/23/47/63/1046234763.db2.gz MFHDJIAQENILBZ-OALUTQOASA-N 2 0 334.507 4.281 20 0 EIADRP C[C@@H](Nc1cccc(C[NH+](C)C)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508688659 1046321872 /nfs/dbraw/zinc/32/18/72/1046321872.db2.gz DLAGTOFQMIXOFR-NQIIRXRSSA-N 2 0 337.511 4.071 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(Cl)cc1 ZINC000162584271 1046365925 /nfs/dbraw/zinc/36/59/25/1046365925.db2.gz GRYWMYYJDILCCK-OAHLLOKOSA-N 2 0 332.875 4.131 20 0 EIADRP C[C@@H](NC1(c2ccccc2F)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508717800 1046375007 /nfs/dbraw/zinc/37/50/07/1046375007.db2.gz IBOBXUSGNOHDRE-MJGOQNOKSA-N 2 0 338.470 4.315 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000126171040 1046453181 /nfs/dbraw/zinc/45/31/81/1046453181.db2.gz VBFUMFRYGITKND-ZDUSSCGKSA-N 2 0 347.503 4.250 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000126205745 1046463700 /nfs/dbraw/zinc/46/37/00/1046463700.db2.gz YIKSHTIBSXXEAK-CYBMUJFWSA-N 2 0 347.503 4.250 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000126344103 1046477261 /nfs/dbraw/zinc/47/72/61/1046477261.db2.gz NMJRMSCXRLGLOB-AWEZNQCLSA-N 2 0 329.513 4.111 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC)c3ccccc23)[C@@H](C)C1 ZINC000536682576 1046645847 /nfs/dbraw/zinc/64/58/47/1046645847.db2.gz YTJIHQCDTSXIMP-OXJNMPFZSA-N 2 0 326.484 4.011 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@H](C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000459428619 1046660583 /nfs/dbraw/zinc/66/05/83/1046660583.db2.gz OUQOVBISLUBZND-LSDHHAIUSA-N 2 0 341.421 4.009 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@@H](C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000459428617 1046660978 /nfs/dbraw/zinc/66/09/78/1046660978.db2.gz OUQOVBISLUBZND-HUUCEWRRSA-N 2 0 341.421 4.009 20 0 EIADRP CN(CC[C@@H]1CCCC[N@@H+]1C)Cc1cnc(-c2ccccc2)s1 ZINC000536677825 1046663625 /nfs/dbraw/zinc/66/36/25/1046663625.db2.gz MDEYLBSEHWWCDG-KRWDZBQOSA-N 2 0 329.513 4.116 20 0 EIADRP c1ccc([C@@H]2CCC[C@H]([NH2+]C3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000459498277 1046725540 /nfs/dbraw/zinc/72/55/40/1046725540.db2.gz AGTPLUJFHKMYDP-CTNGQTDRSA-N 2 0 335.495 4.366 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)cc1 ZINC000379641556 1046745310 /nfs/dbraw/zinc/74/53/10/1046745310.db2.gz YKEBXQKZHBLVLA-LVCYWYKZSA-N 2 0 338.495 4.399 20 0 EIADRP c1ccc(C[C@@H]2CC[C@@H]([NH2+]C3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000459510852 1046748705 /nfs/dbraw/zinc/74/87/05/1046748705.db2.gz MHPBJCWCNASVOU-PZJWPPBQSA-N 2 0 335.495 4.051 20 0 EIADRP CCOCCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CCC1 ZINC000536845204 1046817493 /nfs/dbraw/zinc/81/74/93/1046817493.db2.gz KRPJOJPOCREQLT-FPOVZHCZSA-N 2 0 344.543 4.084 20 0 EIADRP C/C=C\COc1ccc(CC[C@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)cc1 ZINC000536856410 1046825576 /nfs/dbraw/zinc/82/55/76/1046825576.db2.gz GCLZODXEFNJSOS-VOFKWLDRSA-N 2 0 344.543 4.425 20 0 EIADRP Cc1ccc([C@@H]2CCC[C@@H]2[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000536855975 1046825714 /nfs/dbraw/zinc/82/57/14/1046825714.db2.gz CVIQTDCLMNLHJN-WKDRNLAYSA-N 2 0 344.543 4.110 20 0 EIADRP C/C=C/COc1ccc(CC[C@@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)cc1 ZINC000536856411 1046826116 /nfs/dbraw/zinc/82/61/16/1046826116.db2.gz GCLZODXEFNJSOS-ZMBJWTFHSA-N 2 0 344.543 4.425 20 0 EIADRP Cc1c2ccccc2oc1[C@@H](C)[NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000536860662 1046828709 /nfs/dbraw/zinc/82/87/09/1046828709.db2.gz ZWJDLMMTJZEWTK-SOLBZPMBSA-N 2 0 344.499 4.281 20 0 EIADRP C[C@@H](CCCc1cccnc1)[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1 ZINC000459645828 1046832740 /nfs/dbraw/zinc/83/27/40/1046832740.db2.gz HOZDBUYPELEKMM-DXIQSLLYSA-N 2 0 343.559 4.426 20 0 EIADRP CC(C)[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(F)cn1 ZINC000497526217 1046841230 /nfs/dbraw/zinc/84/12/30/1046841230.db2.gz RMSNEBYZNXYUJR-OAQYLSRUSA-N 2 0 341.474 4.303 20 0 EIADRP C[C@H](C[NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000459725126 1046865861 /nfs/dbraw/zinc/86/58/61/1046865861.db2.gz BATFYJPYBJRHIE-CABCVRRESA-N 2 0 328.422 4.130 20 0 EIADRP CC(C)CCC[C@H](C)[NH2+][C@H]1CC[C@H]([NH+]2CCN(CC3CC3)CC2)CC1 ZINC001170063873 1046865979 /nfs/dbraw/zinc/86/59/79/1046865979.db2.gz ILTIBLXJFOHICE-BVSLBCMMSA-N 2 0 349.607 4.130 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C3CCC(C(F)F)CC3)CC2)C1 ZINC000459713205 1046868175 /nfs/dbraw/zinc/86/81/75/1046868175.db2.gz NZJYVQDSHMUDJQ-YHOLWWCESA-N 2 0 328.491 4.443 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H](c2ccc(F)cc2)C2CC2)c1 ZINC000536946984 1046877146 /nfs/dbraw/zinc/87/71/46/1046877146.db2.gz DCSQDYKZCHEGGN-NRFANRHFSA-N 2 0 342.458 4.007 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1cccc(-n2ccnc2)c1 ZINC000787295353 1046970865 /nfs/dbraw/zinc/97/08/65/1046970865.db2.gz PBEGMJKWPVGMHQ-IBGZPJMESA-N 2 0 340.515 4.179 20 0 EIADRP C[C@@H]1CCCC[C@H]1C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000537160734 1046996205 /nfs/dbraw/zinc/99/62/05/1046996205.db2.gz GNFZKWUUZQXYLP-WSTZPKSXSA-N 2 0 342.527 4.391 20 0 EIADRP C(=C\c1ccc(OCc2ccccc2)cc1)\C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000666858092 1047010690 /nfs/dbraw/zinc/01/06/90/1047010690.db2.gz WTFDOFJTMUVMFY-AEZRFQNJSA-N 2 0 336.479 4.011 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCc2nc(Cl)ccc21 ZINC000806127757 1047147279 /nfs/dbraw/zinc/14/72/79/1047147279.db2.gz JEQXPLWCXFTEQT-SFHVURJKSA-N 2 0 343.902 4.354 20 0 EIADRP C[NH+]1CCC(C[N@H+](Cc2cccc(-c3cccnc3)c2)C2CC2)CC1 ZINC000788484616 1047201743 /nfs/dbraw/zinc/20/17/43/1047201743.db2.gz BSFUBRJUAJQWQT-UHFFFAOYSA-N 2 0 335.495 4.055 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)C1CC1 ZINC000556060339 1047428106 /nfs/dbraw/zinc/42/81/06/1047428106.db2.gz DLNQOUSMYCILKU-HXUWFJFHSA-N 2 0 332.919 4.125 20 0 EIADRP [NH3+]C1CCC([NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 ZINC000322356384 1047656936 /nfs/dbraw/zinc/65/69/36/1047656936.db2.gz GWHPLJCCZVKGLU-UHFFFAOYSA-N 2 0 340.311 4.084 20 0 EIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC[C@@H]1C1CCOCC1 ZINC000537511245 1047657460 /nfs/dbraw/zinc/65/74/60/1047657460.db2.gz UOLHJYJGWLCPDN-OAQYLSRUSA-N 2 0 344.543 4.036 20 0 EIADRP CC[C@@H]([NH2+]CCCCn1ccnc1)c1ccc(Br)cc1 ZINC000045094440 1047679739 /nfs/dbraw/zinc/67/97/39/1047679739.db2.gz KKPTVVGFYJNRSB-MRXNPFEDSA-N 2 0 336.277 4.167 20 0 EIADRP CC[C@H]([NH2+]CCCCn1ccnc1)c1ccc(Br)cc1 ZINC000045094439 1047680063 /nfs/dbraw/zinc/68/00/63/1047680063.db2.gz KKPTVVGFYJNRSB-INIZCTEOSA-N 2 0 336.277 4.167 20 0 EIADRP Cc1ccc([C@@H](O)C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)cc1 ZINC000763432491 1047747085 /nfs/dbraw/zinc/74/70/85/1047747085.db2.gz MBSRKARZGUVNEJ-UGKGYDQZSA-N 2 0 344.543 4.005 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H](c2ccncc2C(F)(F)F)C2CC2)CC1 ZINC001168305818 1047775648 /nfs/dbraw/zinc/77/56/48/1047775648.db2.gz NPWPYVIMNCBHRJ-KVULBXGLSA-N 2 0 341.421 4.014 20 0 EIADRP C[NH+](C)C1CCC([NH2+]C(C)(C)c2ccccc2C(F)(F)F)CC1 ZINC001168306096 1047781332 /nfs/dbraw/zinc/78/13/32/1047781332.db2.gz ZXWQNNNSSGVVRO-UHFFFAOYSA-N 2 0 328.422 4.403 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@H](C)[C@H]2C[C@@H]2c2ccc(OC)cc2)CC1 ZINC000556587130 1047832600 /nfs/dbraw/zinc/83/26/00/1047832600.db2.gz VELJICKUPKWNJX-MAODMQOUSA-N 2 0 330.516 4.041 20 0 EIADRP C[NH+]1CCC(C2CC[NH+]([C@H]3CCc4c(Cl)cccc4C3)CC2)CC1 ZINC001171049918 1047846210 /nfs/dbraw/zinc/84/62/10/1047846210.db2.gz OLZZIWWOPBCVFN-IBGZPJMESA-N 2 0 346.946 4.251 20 0 EIADRP COc1ccccc1C[N@H+]([C@@H]1C[C@@H]2[C@H](C1)C2(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170738476 1047965491 /nfs/dbraw/zinc/96/54/91/1047965491.db2.gz MSDAQQRAEUUGSV-DHUDUYKCSA-N 2 0 342.527 4.202 20 0 EIADRP C[N@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+]([C@H]1C[C@@H]3[C@H](C1)C3(C)C)CC2 ZINC001170752069 1048064515 /nfs/dbraw/zinc/06/45/15/1048064515.db2.gz IMINEGUHDLPFIH-GSEOLPGOSA-N 2 0 342.527 4.391 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)C1 ZINC000556857534 1048075253 /nfs/dbraw/zinc/07/52/53/1048075253.db2.gz CKSDQMAWLNNSAC-NSHGMRRFSA-N 2 0 346.563 4.379 20 0 EIADRP Clc1cc(Cl)c2c(c1)CC[C@H](N1CCC([NH+]3CCC3)CC1)C2 ZINC001171089809 1048096646 /nfs/dbraw/zinc/09/66/46/1048096646.db2.gz BXSFNMHCZNKPHL-INIZCTEOSA-N 2 0 339.310 4.021 20 0 EIADRP CC[N@H+](CCC1CC[NH+](CC[C@H](O)c2ccccc2)CC1)CC(C)C ZINC000808742525 1048099707 /nfs/dbraw/zinc/09/97/07/1048099707.db2.gz BAUGVRMZBPIGFL-QFIPXVFZSA-N 2 0 346.559 4.190 20 0 EIADRP Cc1cncc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)c1 ZINC000556884243 1048102769 /nfs/dbraw/zinc/10/27/69/1048102769.db2.gz HNESLWXSUKDJBL-YTFSRNRJSA-N 2 0 349.522 4.170 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CCc3cc(Cl)ccc3C2)cc1 ZINC001171092924 1048117653 /nfs/dbraw/zinc/11/76/53/1048117653.db2.gz BGJUMCAHZUBEAM-HXUWFJFHSA-N 2 0 328.887 4.049 20 0 EIADRP CC(C)(C)[C@@H]1OCCC[C@@H]1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000131737135 1048129678 /nfs/dbraw/zinc/12/96/78/1048129678.db2.gz SLCYCWBSCSUGOZ-YLJYHZDGSA-N 2 0 336.564 4.214 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@@H]2CCc3cc(Cl)ccc3C2)C[C@@](C)(C[NH3+])C1 ZINC001171100199 1048179933 /nfs/dbraw/zinc/17/99/33/1048179933.db2.gz PFAITRAOMLASLR-WSTZPKSXSA-N 2 0 334.935 4.331 20 0 EIADRP [NH3+]C1(CC2CCC2)CC[NH+]([C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171107960 1048208069 /nfs/dbraw/zinc/20/80/69/1048208069.db2.gz FDECUXXAMJXZHL-IBGZPJMESA-N 2 0 332.919 4.181 20 0 EIADRP CC(C)C[NH+]1CCC(C[NH2+][C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171107520 1048208604 /nfs/dbraw/zinc/20/86/04/1048208604.db2.gz CBFLRFDOUREAHZ-FQEVSTJZSA-N 2 0 334.935 4.155 20 0 EIADRP Oc1cccc2c1CC[C@@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499153573 1048361128 /nfs/dbraw/zinc/36/11/28/1048361128.db2.gz RVFXRCBDDJZJFB-WEMPKCCASA-N 2 0 348.490 4.165 20 0 EIADRP Cc1c(O)cccc1C[N@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001144116909 1048429240 /nfs/dbraw/zinc/42/92/40/1048429240.db2.gz FHJWRJLATBXARK-UHFFFAOYSA-N 2 0 338.495 4.045 20 0 EIADRP Clc1ccc(CNC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)cn1 ZINC000810178462 1048668215 /nfs/dbraw/zinc/66/82/15/1048668215.db2.gz UDBWPLGFQUOWDK-LJQANCHMSA-N 2 0 343.902 4.127 20 0 EIADRP c1cc2cccc(C[NH+]3CC[C@H]4C[N@@H+](Cc5ccccc5)C[C@@H]4C3)c2[nH]1 ZINC001144718330 1048818938 /nfs/dbraw/zinc/81/89/38/1048818938.db2.gz HQZRWDQUAYKAET-UNMCSNQZSA-N 2 0 345.490 4.122 20 0 EIADRP Cc1nc(-c2cc3c(s2)CC[N@H+](CCCCCC[NH3+])C3)cs1 ZINC000846222281 1048844633 /nfs/dbraw/zinc/84/46/33/1048844633.db2.gz CPHICHKVUKODSU-UHFFFAOYSA-N 2 0 335.542 4.057 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+]CC2CCC(C(F)(F)F)CC2)cc1 ZINC000237052804 1048882991 /nfs/dbraw/zinc/88/29/91/1048882991.db2.gz UADMMDUWKPNDAK-UHFFFAOYSA-N 2 0 328.422 4.207 20 0 EIADRP CC[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(OC)c(C[NH+](CC)CC)c2)CCO1 ZINC000817586690 1049018774 /nfs/dbraw/zinc/01/87/74/1049018774.db2.gz QCCWXQRRBTVELF-PWIZWCRZSA-N 2 0 348.531 4.145 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCCc2sccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000134971045 1049047123 /nfs/dbraw/zinc/04/71/23/1049047123.db2.gz LVMVZDGGLLXSBL-DNVCBOLYSA-N 2 0 344.524 4.417 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1csc2ccccc21 ZINC000817900679 1049055781 /nfs/dbraw/zinc/05/57/81/1049055781.db2.gz UYNHKSFFUVJSKB-TZMCWYRMSA-N 2 0 325.481 4.475 20 0 EIADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCCN1c2ccccc2Sc2ccccc21 ZINC000817913016 1049058732 /nfs/dbraw/zinc/05/87/32/1049058732.db2.gz TYPAKHZJVZHTOH-HZPDHXFCSA-N 2 0 341.524 4.395 20 0 EIADRP COc1ccc2oc([C@H](C)[NH2+]Cc3ccc(CC[NH3+])cc3)c(C)c2c1 ZINC000817950276 1049063806 /nfs/dbraw/zinc/06/38/06/1049063806.db2.gz XQKLEEASEOIXLS-HNNXBMFYSA-N 2 0 338.451 4.102 20 0 EIADRP [NH3+]CCc1ccc(C[NH2+][C@H]2CCSc3ccc(Cl)cc32)cc1 ZINC000817947950 1049063828 /nfs/dbraw/zinc/06/38/28/1049063828.db2.gz GVEPRADIISGDHP-KRWDZBQOSA-N 2 0 332.900 4.168 20 0 EIADRP [NH3+]CCc1ccc(C[NH2+][C@H]2CCSc3c(Cl)cccc32)cc1 ZINC000817949617 1049064913 /nfs/dbraw/zinc/06/49/13/1049064913.db2.gz SLRDVKAJNQEJSN-KRWDZBQOSA-N 2 0 332.900 4.168 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000817981658 1049077356 /nfs/dbraw/zinc/07/73/56/1049077356.db2.gz MHHRQTKWSKLLQJ-AXAPSJFSSA-N 2 0 326.456 4.096 20 0 EIADRP C[C@H](CSC(C)(C)C)[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000817979531 1049077736 /nfs/dbraw/zinc/07/77/36/1049077736.db2.gz LHUMWABOQUDGKC-UWWQBHOKSA-N 2 0 338.536 4.029 20 0 EIADRP FC(F)Sc1ccc2c(c1)CCC[C@@H]2[NH2+]CCC1=CC[NH2+]CC1 ZINC000817985086 1049079628 /nfs/dbraw/zinc/07/96/28/1049079628.db2.gz GWFBFZWJOVLHGB-KRWDZBQOSA-N 2 0 338.467 4.278 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2CCc3cccc(Cl)c3C2)c1 ZINC001170894927 1049139540 /nfs/dbraw/zinc/13/95/40/1049139540.db2.gz BMCXCOZBVWKDDR-GOSISDBHSA-N 2 0 328.887 4.049 20 0 EIADRP [NH3+]CCC[C@@H]([NH3+])Nc1ccccc1-n1c2ccccc2c2ccccc21 ZINC001170902439 1049156890 /nfs/dbraw/zinc/15/68/90/1049156890.db2.gz CCLXZRCPEYLIRM-QFIPXVFZSA-N 2 0 344.462 4.219 20 0 EIADRP [NH3+]C1(CC2CCC2)CC[NH+]([C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170911177 1049185180 /nfs/dbraw/zinc/18/51/80/1049185180.db2.gz UPSXLQOQHSUFDC-KRWDZBQOSA-N 2 0 332.919 4.181 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCC2)[C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170911487 1049187485 /nfs/dbraw/zinc/18/74/85/1049187485.db2.gz XVGNEPOUFJKNKL-SZMVWBNQSA-N 2 0 332.919 4.322 20 0 EIADRP CC[NH+](CC)[C@H](CNc1cc[nH+]c2cc(F)ccc12)c1ccco1 ZINC000078695040 1049271151 /nfs/dbraw/zinc/27/11/51/1049271151.db2.gz ZMHWQOGPFDLZFX-GOSISDBHSA-N 2 0 327.403 4.462 20 0 EIADRP CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2cccc(C[NH+](C)C)c2)C12CCCC2 ZINC000820813117 1049557872 /nfs/dbraw/zinc/55/78/72/1049557872.db2.gz YYIHBXIKJQZKEL-LSTHTHJFSA-N 2 0 330.516 4.137 20 0 EIADRP Cc1cc(C[NH+](C)C)cc(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H]2C)c1 ZINC000820836051 1049565828 /nfs/dbraw/zinc/56/58/28/1049565828.db2.gz IZFYUQIMOOCFGF-PGRDOPGGSA-N 2 0 337.511 4.132 20 0 EIADRP CC[N@H+](CCC[NH+]1CCCCC1)CCc1ccc(C(F)(F)F)cc1 ZINC001171400515 1049621405 /nfs/dbraw/zinc/62/14/05/1049621405.db2.gz XVBLMPZADJYJJI-UHFFFAOYSA-N 2 0 342.449 4.446 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)c1cccc(O)c1 ZINC000716693172 1049701880 /nfs/dbraw/zinc/70/18/80/1049701880.db2.gz OGBURNTVXIMOMX-LGYWMIHWSA-N 2 0 336.479 4.096 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H]1CCc2cc(F)c(F)c(F)c2C1 ZINC001171505598 1049738983 /nfs/dbraw/zinc/73/89/83/1049738983.db2.gz KHDFLCBSIDPHLF-UKRRQHHQSA-N 2 0 342.449 4.061 20 0 EIADRP Cc1cccc2c1CC[C@H]([N@H+](C)C[C@@H]1CC[NH+](Cc3ccccc3)C1)C2 ZINC001171573521 1049760053 /nfs/dbraw/zinc/76/00/53/1049760053.db2.gz IYVKHQYLIGSPFI-GMAHTHKFSA-N 2 0 348.534 4.306 20 0 EIADRP C[N@H+](CC[C@@H]1CC1(Cl)Cl)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000822654601 1049781507 /nfs/dbraw/zinc/78/15/07/1049781507.db2.gz NTGAGONNOWMHJP-DLBZAZTESA-N 2 0 341.326 4.024 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171731439 1049786430 /nfs/dbraw/zinc/78/64/30/1049786430.db2.gz BCAYVCOJERKCFZ-SYYKKAFVSA-N 2 0 349.522 4.258 20 0 EIADRP C[NH2+]CCc1cn([C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171760334 1049791480 /nfs/dbraw/zinc/79/14/80/1049791480.db2.gz UDOQZCXTVGNIOX-NQIIRXRSSA-N 2 0 347.506 4.239 20 0 EIADRP CC1(C)C[C@H]([NH2+]CCOc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001171961616 1049824466 /nfs/dbraw/zinc/82/44/66/1049824466.db2.gz ASPAXBUQGQVMHU-HXUWFJFHSA-N 2 0 338.495 4.098 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001171966604 1049827203 /nfs/dbraw/zinc/82/72/03/1049827203.db2.gz WNWPVDUTYYFGRT-COXVUDFISA-N 2 0 328.422 4.099 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001171966608 1049827619 /nfs/dbraw/zinc/82/76/19/1049827619.db2.gz WNWPVDUTYYFGRT-XYPHTWIQSA-N 2 0 328.422 4.099 20 0 EIADRP COCC(C)(C)C[NH2+][C@@H](C)c1ccc(OC)c(C[NH+]2CCCCC2)c1 ZINC000813883291 1049831308 /nfs/dbraw/zinc/83/13/08/1049831308.db2.gz SFFIHKYGARONKC-KRWDZBQOSA-N 2 0 348.531 4.004 20 0 EIADRP Fc1ccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000245697643 1049832168 /nfs/dbraw/zinc/83/21/68/1049832168.db2.gz LGIYGHUIYIOZNV-KOUNCHBCSA-N 2 0 338.470 4.153 20 0 EIADRP Fc1cccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000245724103 1049838749 /nfs/dbraw/zinc/83/87/49/1049838749.db2.gz PCXDOLCPOOGIHU-DKUWSORSSA-N 2 0 338.470 4.153 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@H]2CCCc3cnccc32)CC[N@@H+]1Cc1ccccc1 ZINC001171980484 1049839470 /nfs/dbraw/zinc/83/94/70/1049839470.db2.gz VNXRCFCSOBXWHF-IRLDBZIGSA-N 2 0 349.522 4.492 20 0 EIADRP CC1(C)C[C@@H]([NH+]2CC[C@@H](c3cccnc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171985389 1049840598 /nfs/dbraw/zinc/84/05/98/1049840598.db2.gz WAWRLKIWNLBWIJ-YADHBBJMSA-N 2 0 349.522 4.314 20 0 EIADRP CCN1CC[C@@H]([NH2+]CCC[PH+](C(C)(C)C)C(C)(C)C)CC1=O ZINC001172040564 1049843078 /nfs/dbraw/zinc/84/30/78/1049843078.db2.gz YLPBJHJKPOANTA-OAHLLOKOSA-N 2 0 328.481 4.056 20 0 EIADRP CC(C)N([C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)(C)C[NH3+] ZINC001172079172 1049846484 /nfs/dbraw/zinc/84/64/84/1049846484.db2.gz MPWZEBRRXDPQCZ-WKCHPHFGSA-N 2 0 343.559 4.020 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H](N2CC(c4cccnc4)C2)C3)cc1 ZINC001172084536 1049847969 /nfs/dbraw/zinc/84/79/69/1049847969.db2.gz YMFFQKQELOIIHH-NUNAXRQHSA-N 2 0 347.506 4.067 20 0 EIADRP Cc1ccc(CN[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)nc1 ZINC001172061905 1049850009 /nfs/dbraw/zinc/85/00/09/1049850009.db2.gz JQEWVUBPLRKFMO-DKUWSORSSA-N 2 0 335.495 4.065 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](N[C@H](c1ccccc1)[C@H]([NH3+])c1ccccc1)C2 ZINC001172101590 1049855521 /nfs/dbraw/zinc/85/55/21/1049855521.db2.gz ZQJMJDQJRVPUSB-XNBWIAOKSA-N 2 0 349.522 4.033 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](n1cc(C(C)(C)C[NH3+])c3ccccc31)C2 ZINC001172114063 1049859067 /nfs/dbraw/zinc/85/90/67/1049859067.db2.gz LSIOAIAKBMDSFN-BJWYYQGGSA-N 2 0 325.500 4.065 20 0 EIADRP CC[C@H](C)OCC[C@@H](C)[NH2+]CC1CC[NH+](CC2CCCCC2)CC1 ZINC001172326348 1049879604 /nfs/dbraw/zinc/87/96/04/1049879604.db2.gz CRTCDMXQECZUGS-MOPGFXCFSA-N 2 0 338.580 4.462 20 0 EIADRP C[C@@H]1CC[C@H]([NH+]2CCC3(CC[N@H+](Cc4ccoc4)C3)CC2)C[C@@H]1C ZINC001172379934 1049885849 /nfs/dbraw/zinc/88/58/49/1049885849.db2.gz UJZIVSXLMXZTKI-HBFSDRIKSA-N 2 0 330.516 4.392 20 0 EIADRP CC[C@@H](C)OCC[C@H](C)[NH+]1CCC2(CC[N@H+](Cc3ccoc3)C2)CC1 ZINC001172339794 1049888649 /nfs/dbraw/zinc/88/86/49/1049888649.db2.gz QQODUWZMEHHNIH-RBUKOAKNSA-N 2 0 348.531 4.161 20 0 EIADRP CC[C@H](C)OCC[C@@H](C)[N@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172355841 1049894133 /nfs/dbraw/zinc/89/41/33/1049894133.db2.gz WQAJDXWGMKZMFR-UXHICEINSA-N 2 0 346.559 4.424 20 0 EIADRP CC(C)COCC[C@H](C)[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1 ZINC001172485864 1049911191 /nfs/dbraw/zinc/91/11/91/1049911191.db2.gz ZOYPTAZAPTYBJY-FQEVSTJZSA-N 2 0 344.543 4.036 20 0 EIADRP CC(C)OCC[C@H](C)[NH+]1CCC2(CC[C@@H]2[N@H+](C)Cc2ccco2)CC1 ZINC001172446145 1049914833 /nfs/dbraw/zinc/91/48/33/1049914833.db2.gz ISHMXWZCLOJJIJ-ICSRJNTNSA-N 2 0 348.531 4.160 20 0 EIADRP CC(C)OCC[C@@H](C)[N@@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001172453240 1049915903 /nfs/dbraw/zinc/91/59/03/1049915903.db2.gz FRPUHDBNGXOMTI-IFMALSPDSA-N 2 0 344.543 4.178 20 0 EIADRP CC(C)COCC[C@H](C)[NH2+]CC1CC[NH+](CC2CCCCC2)CC1 ZINC001172467557 1049919281 /nfs/dbraw/zinc/91/92/81/1049919281.db2.gz LKVVNHFXXCBKON-IBGZPJMESA-N 2 0 338.580 4.320 20 0 EIADRP CCCCCC[C@H](CCCC)[NH2+]CCN1CC[NH+](C(C)C)CC1 ZINC001172516705 1049928072 /nfs/dbraw/zinc/92/80/72/1049928072.db2.gz LCWKPDWTJDWGAY-FQEVSTJZSA-N 2 0 325.585 4.131 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CCc2nc(C3CCCCC3)cs2)[C@@H](C)C1 ZINC000246263812 1049942330 /nfs/dbraw/zinc/94/23/30/1049942330.db2.gz AADPSAOILARXLX-RDJZCZTQSA-N 2 0 335.561 4.053 20 0 EIADRP c1ccc(C[N@H+]2CC[C@@H](C[NH2+][C@@H]3CC[C@@H](c4ccccc4)C3)C2)cc1 ZINC001172546725 1049946527 /nfs/dbraw/zinc/94/65/27/1049946527.db2.gz PHGFMRLCTISBTC-MDNUFGMLSA-N 2 0 334.507 4.434 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1Cc2ccc(Cl)cc2C1 ZINC001172721647 1049964540 /nfs/dbraw/zinc/96/45/40/1049964540.db2.gz IIPPCFCULXSBKH-XUVXKRRUSA-N 2 0 332.919 4.146 20 0 EIADRP Cc1cccnc1N1CCC([NH2+]C2CCC3(CCCC3)CC2)CC1 ZINC001172724711 1049966002 /nfs/dbraw/zinc/96/60/02/1049966002.db2.gz XZDIIYUBMBDSFJ-UHFFFAOYSA-N 2 0 327.516 4.451 20 0 EIADRP C[NH+](C)CC[C@@H]([NH2+][C@H]1Cc2ccc(Cl)cc2C1)c1ccccc1 ZINC001172708950 1049970901 /nfs/dbraw/zinc/97/09/01/1049970901.db2.gz QFIOGWLBLUPARM-VQTJNVASSA-N 2 0 328.887 4.090 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@@H]2Cc3ccc(Cl)cc3C2)CC1 ZINC001172713689 1049972017 /nfs/dbraw/zinc/97/20/17/1049972017.db2.gz YAEREEJUGRGTMV-MISYRCLQSA-N 2 0 332.919 4.322 20 0 EIADRP Cc1cc(C)c([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)cc1C ZINC000246510435 1049981161 /nfs/dbraw/zinc/98/11/61/1049981161.db2.gz TZKVRCFXXPVOHI-VLCRHTCISA-N 2 0 344.543 4.030 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(SCC(F)F)cc2)C1 ZINC000246816861 1050001748 /nfs/dbraw/zinc/00/17/48/1050001748.db2.gz AXVUSPKFOGBSMF-KGLIPLIRSA-N 2 0 328.472 4.036 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cc(C)sc2C)[C@@H](C)C1 ZINC000247087724 1050013410 /nfs/dbraw/zinc/01/34/10/1050013410.db2.gz PEQLWUNCNZJPFO-QOKNQOGYSA-N 2 0 338.561 4.153 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cnc2ccsc2c1 ZINC000247177739 1050016649 /nfs/dbraw/zinc/01/66/49/1050016649.db2.gz VBHCNGHWZKVUEC-HZPDHXFCSA-N 2 0 331.529 4.459 20 0 EIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]C[C@H]1CCCc2ccccc21 ZINC000247974862 1050037623 /nfs/dbraw/zinc/03/76/23/1050037623.db2.gz KLZAKUVVBONECR-KKLQWCBXSA-N 2 0 349.522 4.002 20 0 EIADRP CC(C)OCCCC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000248374867 1050051488 /nfs/dbraw/zinc/05/14/88/1050051488.db2.gz UREQFCINUUQEPT-YPAWHYETSA-N 2 0 344.543 4.082 20 0 EIADRP Cc1c([C@H](C)N[C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cnn1C(C)C ZINC000248716671 1050074580 /nfs/dbraw/zinc/07/45/80/1050074580.db2.gz RPPYYGBKOWFJBI-RYRKJORJSA-N 2 0 332.536 4.076 20 0 EIADRP Cc1c([C@H](C)N[C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cnn1C(C)C ZINC000248716665 1050074676 /nfs/dbraw/zinc/07/46/76/1050074676.db2.gz RPPYYGBKOWFJBI-BQFCYCMXSA-N 2 0 332.536 4.076 20 0 EIADRP FC(F)(F)C1CCC(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)CC1 ZINC000248762413 1050078056 /nfs/dbraw/zinc/07/80/56/1050078056.db2.gz WIUANNIINMIKRO-VLWBHCEFSA-N 2 0 344.465 4.304 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCCNc2ccccc2)C3)cc1 ZINC000248997056 1050087191 /nfs/dbraw/zinc/08/71/91/1050087191.db2.gz PGWYTTYZMSJKKF-WBDAEOGXSA-N 2 0 349.522 4.274 20 0 EIADRP Cn1c(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc2ccccc21 ZINC001177143856 1050155347 /nfs/dbraw/zinc/15/53/47/1050155347.db2.gz ZPVJVPKSXQXHGZ-UHFFFAOYSA-N 2 0 333.479 4.064 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([N@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828184 1050165708 /nfs/dbraw/zinc/16/57/08/1050165708.db2.gz JGOCMNSVYYYDSQ-PMVMPFDFSA-N 2 0 349.522 4.019 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([NH2+]CC1CC[NH+](CC(C)(C)C)CC1)CC2 ZINC001172832294 1050169788 /nfs/dbraw/zinc/16/97/88/1050169788.db2.gz SBWCBEDTEXWSRT-OAQYLSRUSA-N 2 0 328.544 4.200 20 0 EIADRP CCC1(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)CCOCC1 ZINC001177257639 1050174893 /nfs/dbraw/zinc/17/48/93/1050174893.db2.gz XRVARCNPUAFOJQ-IBGZPJMESA-N 2 0 344.543 4.215 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H]([NH2+][C@H](C)Cc2ccc(F)cc2Cl)[C@H](C)C1 ZINC001172864989 1050175039 /nfs/dbraw/zinc/17/50/39/1050175039.db2.gz JFLZOMWEYHLLBZ-HBUWYVDXSA-N 2 0 326.887 4.119 20 0 EIADRP CCO[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)C1 ZINC001177256391 1050175665 /nfs/dbraw/zinc/17/56/65/1050175665.db2.gz DYPAKMVNKXKTPW-YUXAGFNASA-N 2 0 344.543 4.356 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@@H]1CC2(CCCC2)Oc2ccccc21 ZINC000090461152 1050179341 /nfs/dbraw/zinc/17/93/41/1050179341.db2.gz NYCFYHUGMNNSSP-ZAWLATJESA-N 2 0 328.500 4.141 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@@H](C)Cc2ccc(F)cc2Cl)CC1 ZINC001172860669 1050198886 /nfs/dbraw/zinc/19/88/86/1050198886.db2.gz NLYDWIVWTBQCRV-AWEZNQCLSA-N 2 0 326.887 4.120 20 0 EIADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2cccc(Cl)c2Br)CC1 ZINC001206303141 1050217069 /nfs/dbraw/zinc/21/70/69/1050217069.db2.gz BQKGNFJEPUPLAJ-HNNXBMFYSA-N 2 0 345.712 4.053 20 0 EIADRP C[C@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1cccc(OCC[NH+](C)C)c1 ZINC000090963514 1050219170 /nfs/dbraw/zinc/21/91/70/1050219170.db2.gz FWBAEKGTXQLKPT-GJZGRUSLSA-N 2 0 348.437 4.317 20 0 EIADRP C[C@@H](CSc1ccc(Cl)cc1)[N@H+](C)CC1CC[NH+](C)CC1 ZINC001172879496 1050219270 /nfs/dbraw/zinc/21/92/70/1050219270.db2.gz NVXATUXQJVMKDJ-AWEZNQCLSA-N 2 0 326.937 4.094 20 0 EIADRP Cc1[nH+]c2ccc(F)cn2c1Nc1ccc(C2CC[NH+](C)CC2)cc1 ZINC001212690244 1050232123 /nfs/dbraw/zinc/23/21/23/1050232123.db2.gz ZPPFUEFHIKBFPZ-UHFFFAOYSA-N 2 0 338.430 4.335 20 0 EIADRP CO[C@@H]1CCC[C@H]([N@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)C1 ZINC001172922261 1050235894 /nfs/dbraw/zinc/23/58/94/1050235894.db2.gz GMXLSBDRIXULET-AIKVAWSJSA-N 2 0 342.527 4.072 20 0 EIADRP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)CC1 ZINC001177528797 1050239820 /nfs/dbraw/zinc/23/98/20/1050239820.db2.gz HSNAFYHONXEQSJ-FCHUYYIVSA-N 2 0 344.543 4.500 20 0 EIADRP C[N@H+](Cc1ccccc1C[NH2+]C[C@@H]1CCC=CO1)C1CCCCC1 ZINC000774975075 1050243836 /nfs/dbraw/zinc/24/38/36/1050243836.db2.gz AHBRVAGVNYROEU-NRFANRHFSA-N 2 0 328.500 4.233 20 0 EIADRP COc1ccccc1[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C1CCCC1 ZINC000091284475 1050248507 /nfs/dbraw/zinc/24/85/07/1050248507.db2.gz BSYNNMADZKSCCJ-IIBYNOLFSA-N 2 0 328.500 4.000 20 0 EIADRP CCc1ccccc1C[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC001177562498 1050252108 /nfs/dbraw/zinc/25/21/08/1050252108.db2.gz QDPWHAXPNUPWQK-UHFFFAOYSA-N 2 0 328.525 4.312 20 0 EIADRP CCC(CC)[N@@H+](C1CCC2(CCOCC2)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173043680 1050271260 /nfs/dbraw/zinc/27/12/60/1050271260.db2.gz GCKVYZGJEOXFAE-UAPYVXQJSA-N 2 0 336.564 4.486 20 0 EIADRP CCCC[N@@H+]1CCCC[C@@H]1CNC1CC[NH+](C2CCCCC2)CC1 ZINC001177744129 1050291225 /nfs/dbraw/zinc/29/12/25/1050291225.db2.gz RSXMYEQMKFCAPP-OAQYLSRUSA-N 2 0 335.580 4.028 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2cccc(OC(F)F)c2)CC1 ZINC001173105127 1050305795 /nfs/dbraw/zinc/30/57/95/1050305795.db2.gz FHHSDQORFWRTEH-UHFFFAOYSA-N 2 0 326.431 4.031 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCc2ccc(C(F)(F)F)cc2)CC1 ZINC001173106602 1050307488 /nfs/dbraw/zinc/30/74/88/1050307488.db2.gz ZYYGPNPXTJVJQR-UHFFFAOYSA-N 2 0 342.449 4.491 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C(C)(C)Cc2ccc(OC)cc2)CC1 ZINC001173106067 1050307624 /nfs/dbraw/zinc/30/76/24/1050307624.db2.gz GLABTQGIGDDLSV-UHFFFAOYSA-N 2 0 332.532 4.259 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2(Cc3ccccc3OC)CC2)CC1 ZINC001173105735 1050307688 /nfs/dbraw/zinc/30/76/88/1050307688.db2.gz CTTSOLCGUIFNTO-UHFFFAOYSA-N 2 0 330.516 4.013 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC(Oc3ccccc3)CC2)CC1 ZINC001173108309 1050307786 /nfs/dbraw/zinc/30/77/86/1050307786.db2.gz BFGGYMJZXFPULN-UHFFFAOYSA-N 2 0 330.516 4.183 20 0 EIADRP CC[NH+](CC)C1CCC([N@H+](C)[C@@H](C)Cc2ccccc2OC)CC1 ZINC001173113311 1050309689 /nfs/dbraw/zinc/30/96/89/1050309689.db2.gz MZBUNHBKDJKSFE-KKXNLOMOSA-N 2 0 332.532 4.211 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CC[C@@H](c3cccc(OC)c3)C2)CC1 ZINC001173113106 1050309789 /nfs/dbraw/zinc/30/97/89/1050309789.db2.gz HEZOERYGOTWEBE-XEVCZEQESA-N 2 0 330.516 4.138 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@@H]2c2cccc(OC)c2)CC1 ZINC001173114315 1050309871 /nfs/dbraw/zinc/30/98/71/1050309871.db2.gz GEELUYRMOCCQSE-GZNCHQMQSA-N 2 0 330.516 4.485 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC(Oc3ccc(C)cc3)CC2)CC1 ZINC001173111931 1050310882 /nfs/dbraw/zinc/31/08/82/1050310882.db2.gz NMBMMXQNMGRHSI-UHFFFAOYSA-N 2 0 344.543 4.491 20 0 EIADRP CC(C)CC(C)(C)C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC001177954592 1050348073 /nfs/dbraw/zinc/34/80/73/1050348073.db2.gz HSKRICOMTSERFU-UHFFFAOYSA-N 2 0 345.575 4.379 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+][C@@H]3CCO[C@@H](C)C3)[C@@H](C)C2)CC[C@@H]1[NH3+] ZINC001173170157 1050349240 /nfs/dbraw/zinc/34/92/40/1050349240.db2.gz LYMXSDHTMGCEQE-KXOUKXDCSA-N 2 0 336.564 4.102 20 0 EIADRP CC[NH+]1C[C@@H]2C[NH+]([C@H](C)CC(c3ccccc3)c3ccccc3)C[C@H]2C1 ZINC001173213751 1050373741 /nfs/dbraw/zinc/37/37/41/1050373741.db2.gz HONRGJXYNZYDOQ-UEVCKROQSA-N 2 0 348.534 4.481 20 0 EIADRP CC[C@H]1CC[C@@H](n2cc(CC[NH+]3CCC([NH3+])CC3)c3ccccc32)C1 ZINC001173269555 1050390455 /nfs/dbraw/zinc/39/04/55/1050390455.db2.gz XIGTYZNJSVDGSC-FXAWDEMLSA-N 2 0 339.527 4.358 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3ccc4c(c3)CCC4)CC2)CC1 ZINC001178280811 1050426914 /nfs/dbraw/zinc/42/69/14/1050426914.db2.gz UXRZMDMPRDWYSA-UHFFFAOYSA-N 2 0 326.528 4.308 20 0 EIADRP Fc1ccccc1C[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC001178285384 1050428717 /nfs/dbraw/zinc/42/87/17/1050428717.db2.gz QAXIYOGTYUTDBU-RZUBCFFCSA-N 2 0 338.470 4.216 20 0 EIADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1 ZINC001178284842 1050429411 /nfs/dbraw/zinc/42/94/11/1050429411.db2.gz CTZVDLJPZFNAEF-XPWALMASSA-N 2 0 334.507 4.385 20 0 EIADRP CC[N@H+]([C@H]1CCOC1)C1CC[NH+]([C@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173343036 1050432217 /nfs/dbraw/zinc/43/22/17/1050432217.db2.gz GKYKFAJMGBBABW-SFTDATJTSA-N 2 0 348.575 4.455 20 0 EIADRP [NH3+]C1(Cc2ccccn2)CC[NH+]([C@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173342618 1050432501 /nfs/dbraw/zinc/43/25/01/1050432501.db2.gz DAEUCYSGCQJWCC-FQEVSTJZSA-N 2 0 341.543 4.311 20 0 EIADRP COC1CC[NH+](C2CC[NH+]([C@H]3CCCC4(CCCCC4)C3)CC2)CC1 ZINC001173347821 1050436582 /nfs/dbraw/zinc/43/65/82/1050436582.db2.gz BIHQRTPBSAIJBE-FQEVSTJZSA-N 2 0 348.575 4.455 20 0 EIADRP COC1CC[NH+](C2CC[NH+]([C@@H]3CCCC4(CCCCC4)C3)CC2)CC1 ZINC001173347822 1050437006 /nfs/dbraw/zinc/43/70/06/1050437006.db2.gz BIHQRTPBSAIJBE-HXUWFJFHSA-N 2 0 348.575 4.455 20 0 EIADRP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@@H]1CCC[N@H+](C)CC1 ZINC001173541795 1050475691 /nfs/dbraw/zinc/47/56/91/1050475691.db2.gz DAOQWMZFJIOVAQ-DZGCQCFKSA-N 2 0 329.315 4.388 20 0 EIADRP COc1cccc2c(C[NH2+]CC[C@@H](C)[NH+]3CCCCC3)cccc12 ZINC001178464348 1050476805 /nfs/dbraw/zinc/47/68/05/1050476805.db2.gz XCXDMBWIPGHPJJ-QGZVFWFLSA-N 2 0 326.484 4.203 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1CC2(C1)CC[NH+](C)CC2 ZINC001173549007 1050484976 /nfs/dbraw/zinc/48/49/76/1050484976.db2.gz FWSLXUUPOJZDRL-CQSZACIVSA-N 2 0 341.326 4.342 20 0 EIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000450740964 1050525639 /nfs/dbraw/zinc/52/56/39/1050525639.db2.gz XGNZIOTZYBGJIC-JFIYKMOQSA-N 2 0 336.470 4.168 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H](C)c2cccnc2)ccc1OC ZINC000182226369 1050563498 /nfs/dbraw/zinc/56/34/98/1050563498.db2.gz OKJCBFHDFAZUBY-IRXDYDNUSA-N 2 0 341.499 4.344 20 0 EIADRP CC[C@H]1C[C@@H](C[NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC001179277888 1050668474 /nfs/dbraw/zinc/66/84/74/1050668474.db2.gz OZQRCNBBARYZPF-VXKWHMMOSA-N 2 0 344.543 4.084 20 0 EIADRP Cc1cc(C[NH2+][C@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)cc(C)n1 ZINC001179771692 1050768472 /nfs/dbraw/zinc/76/84/72/1050768472.db2.gz LAWFQMQHBCCFBL-VJBWXMMDSA-N 2 0 349.522 4.089 20 0 EIADRP CC[N@H+](CC1CC[NH+](C)CC1)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC001179937047 1050823123 /nfs/dbraw/zinc/82/31/23/1050823123.db2.gz JGIQFKGGGJWZKU-AWEZNQCLSA-N 2 0 328.422 4.430 20 0 EIADRP CC[N@H+](CC1CC[NH+](C)CC1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC001179937049 1050823711 /nfs/dbraw/zinc/82/37/11/1050823711.db2.gz JGIQFKGGGJWZKU-CQSZACIVSA-N 2 0 328.422 4.430 20 0 EIADRP c1cn2cc(Nc3ccc4c(c3)CC[C@H]([NH+]3CCCC3)CC4)ccc2[nH+]1 ZINC001174280056 1050861846 /nfs/dbraw/zinc/86/18/46/1050861846.db2.gz PCDOGVMSACWQTB-OAQYLSRUSA-N 2 0 346.478 4.421 20 0 EIADRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](C/C=C/c2cc(C)c(C)cc2C)C1 ZINC001180081739 1050877871 /nfs/dbraw/zinc/87/78/71/1050877871.db2.gz NLLAXUWXTMNCQD-HYGBKTPJSA-N 2 0 344.543 4.058 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(N(C)c3ccccc3)cc2)C1 ZINC000619772504 1050908184 /nfs/dbraw/zinc/90/81/84/1050908184.db2.gz JGHQESKZPMLGOC-HXUWFJFHSA-N 2 0 337.511 4.276 20 0 EIADRP Cc1cc(F)ncc1C[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC001180225921 1050920382 /nfs/dbraw/zinc/92/03/82/1050920382.db2.gz XCGUDBPIQJLAAH-QGZVFWFLSA-N 2 0 333.495 4.006 20 0 EIADRP CC[N@H+](Cc1ccc(OCCC[NH+](C)C)cc1)Cc1ccccc1F ZINC001204269944 1051005224 /nfs/dbraw/zinc/00/52/24/1051005224.db2.gz MGNLWLONFAPDGV-UHFFFAOYSA-N 2 0 344.474 4.178 20 0 EIADRP C[C@H](CCC1CCCCC1)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC001180802465 1051087388 /nfs/dbraw/zinc/08/73/88/1051087388.db2.gz QWLFDKWMGRIRJH-GCJKJVERSA-N 2 0 344.543 4.092 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC001180810289 1051087532 /nfs/dbraw/zinc/08/75/32/1051087532.db2.gz KZVSXISZRZMZFE-CVEARBPZSA-N 2 0 342.449 4.491 20 0 EIADRP C(CCC[NH2+][C@@H]1CC[C@H]2SCCS[C@@H]12)CCC[NH+]1CCCC1 ZINC000775385087 1051177029 /nfs/dbraw/zinc/17/70/29/1051177029.db2.gz IXZRFYXGVGZKRO-KURKYZTESA-N 2 0 342.618 4.002 20 0 EIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](CC3([C@H]4CCCCO4)CCC3)C2)CC1 ZINC001190651126 1051244759 /nfs/dbraw/zinc/24/47/59/1051244759.db2.gz JFEXTMCRUHUJDX-NHCUHLMSSA-N 2 0 348.575 4.170 20 0 EIADRP COc1ccccc1CCC[N@@H+]1CCC[C@H](C[NH+]2CCC(C)CC2)C1 ZINC001190652078 1051245378 /nfs/dbraw/zinc/24/53/78/1051245378.db2.gz VPDOHUCAEBVNTD-FQEVSTJZSA-N 2 0 344.543 4.072 20 0 EIADRP CC(C)(C[N@@H+]1CCC[C@](F)(C[NH3+])CC1)Sc1ccc(Cl)cc1 ZINC001205537937 1051254858 /nfs/dbraw/zinc/25/48/58/1051254858.db2.gz KQUIWSUSUAXUHU-QGZVFWFLSA-N 2 0 344.927 4.364 20 0 EIADRP C[C@@H](O)C[N@H+](Cc1cccc(C[NH+]2CCCCC2)c1)C1CCCCC1 ZINC001190855563 1051292788 /nfs/dbraw/zinc/29/27/88/1051292788.db2.gz SYKMPHFJZNERDW-LJQANCHMSA-N 2 0 344.543 4.188 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ccc(OC)c(COC)c1 ZINC000268727341 1051385699 /nfs/dbraw/zinc/38/56/99/1051385699.db2.gz KJFQISVVQSIZHC-IAGOWNOFSA-N 2 0 336.520 4.003 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1cncs1 ZINC000268835724 1051395725 /nfs/dbraw/zinc/39/57/25/1051395725.db2.gz SFOQRWXVGBYLHK-JKSUJKDBSA-N 2 0 329.513 4.368 20 0 EIADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cc2cc(Br)ccc2o1 ZINC000271902765 1051556036 /nfs/dbraw/zinc/55/60/36/1051556036.db2.gz VXQQSJNMBHSFGL-GFCCVEGCSA-N 2 0 349.272 4.108 20 0 EIADRP c1ccc(C[N@H+]2CC=C(Nc3ccc(C[NH+]4CCCC4)cc3)CC2)cc1 ZINC001175506401 1051638323 /nfs/dbraw/zinc/63/83/23/1051638323.db2.gz XPZHFOLJAQHQSB-UHFFFAOYSA-N 2 0 347.506 4.484 20 0 EIADRP CC(C)C[N@@H+](Cc1cc(Cl)nc(Cl)c1)CC1CC[NH+](C)CC1 ZINC001175601951 1051667384 /nfs/dbraw/zinc/66/73/84/1051667384.db2.gz ZHOZPYJWRZGZLW-UHFFFAOYSA-N 2 0 344.330 4.188 20 0 EIADRP CCc1ccccc1C[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000157958055 1051687280 /nfs/dbraw/zinc/68/72/80/1051687280.db2.gz NECBQTIMSOFMDZ-QGZVFWFLSA-N 2 0 326.484 4.040 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000158103816 1051712283 /nfs/dbraw/zinc/71/22/83/1051712283.db2.gz VWGONZGOKZVIMA-UONOGXRCSA-N 2 0 346.462 4.333 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000158103947 1051712378 /nfs/dbraw/zinc/71/23/78/1051712378.db2.gz VWGONZGOKZVIMA-ZIAGYGMSSA-N 2 0 346.462 4.333 20 0 EIADRP CC[N@H+](CCC1CC[NH+](CCc2ncc(C)cc2C)CC1)CC1CC1 ZINC001192501285 1051748788 /nfs/dbraw/zinc/74/87/88/1051748788.db2.gz MHSJRADLGUCHEJ-UHFFFAOYSA-N 2 0 343.559 4.075 20 0 EIADRP C[C@H]1CC[N@H+](Cc2cccc(C(F)(F)F)c2Cl)CC[C@@H]1C[NH3+] ZINC001205602229 1051757070 /nfs/dbraw/zinc/75/70/70/1051757070.db2.gz HUAYSQCOFGMPIQ-NWDGAFQWSA-N 2 0 334.813 4.166 20 0 EIADRP Cc1nc2c(s1)[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)CCC2 ZINC000158591395 1051762434 /nfs/dbraw/zinc/76/24/34/1051762434.db2.gz XVXAWIHLAXMMKM-HLLBOEOZSA-N 2 0 335.561 4.177 20 0 EIADRP CSC(C)(C)CC[NH2+]CCC1CC[NH+](Cc2ccccc2)CC1 ZINC001183144731 1051792923 /nfs/dbraw/zinc/79/29/23/1051792923.db2.gz CCVXKERKMGYZPO-UHFFFAOYSA-N 2 0 334.573 4.410 20 0 EIADRP C[C@@H]([NH2+]CCC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1C[C@H]1C1CC1 ZINC001183145618 1051793588 /nfs/dbraw/zinc/79/35/88/1051793588.db2.gz KIBIUYYGCXLDIV-WTNAPCKOSA-N 2 0 326.528 4.313 20 0 EIADRP C[C@@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1cccc(OC(F)(F)F)c1 ZINC000775549666 1051815716 /nfs/dbraw/zinc/81/57/16/1051815716.db2.gz ZGZFYQFQQKMWJZ-UKRRQHHQSA-N 2 0 330.394 4.110 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001193249482 1051890310 /nfs/dbraw/zinc/89/03/10/1051890310.db2.gz NAPLJYBWCOVLHG-GOEBONIOSA-N 2 0 338.442 4.031 20 0 EIADRP C[C@@H]1CC[N@H+](Cc2c(Cl)cccc2C(F)(F)F)CC[C@H]1C[NH3+] ZINC001205628553 1051914463 /nfs/dbraw/zinc/91/44/63/1051914463.db2.gz VZXUTCYMPLUGOM-NEPJUHHUSA-N 2 0 334.813 4.166 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCOC23CCCCC3)CC1 ZINC001184067502 1051941380 /nfs/dbraw/zinc/94/13/80/1051941380.db2.gz RRXJRILXVFAMII-YZGWKJHDSA-N 2 0 334.548 4.111 20 0 EIADRP COC1(C[NH+]2CCC(c3ccccc3)([NH+]3CCCC3)CC2)CCCC1 ZINC001184036234 1051944274 /nfs/dbraw/zinc/94/42/74/1051944274.db2.gz VHPUNAKMEQGXCQ-UHFFFAOYSA-N 2 0 342.527 4.033 20 0 EIADRP CCN1CCC([NH2+][C@@H](C)c2ccc(SCC(F)F)cc2)CC1 ZINC000159262546 1051965482 /nfs/dbraw/zinc/96/54/82/1051965482.db2.gz OARDIGLFTLMDOA-ZDUSSCGKSA-N 2 0 328.472 4.179 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)[C@@H](C)c1nc2ccccc2s1)C[NH+]1CCCC1 ZINC000165304970 1052057851 /nfs/dbraw/zinc/05/78/51/1052057851.db2.gz NABFLIATXLWRBM-OAGGEKHMSA-N 2 0 331.529 4.110 20 0 EIADRP [NH3+]CC1CCC([NH2+]C2(c3ccc(C(F)(F)F)cc3)CCC2)CC1 ZINC000622044092 1052083279 /nfs/dbraw/zinc/08/32/79/1052083279.db2.gz UNAVLRVCVHHIRM-UHFFFAOYSA-N 2 0 326.406 4.192 20 0 EIADRP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)CCc3cccc(F)c3)C2)s1 ZINC001194152587 1052088152 /nfs/dbraw/zinc/08/81/52/1052088152.db2.gz DUHOQJFECXYZTM-GOSISDBHSA-N 2 0 346.515 4.192 20 0 EIADRP CC(C)O[C@@H]1C[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)C1(C)C ZINC001194458346 1052149174 /nfs/dbraw/zinc/14/91/74/1052149174.db2.gz RIRSWRTXQVVTGO-LEWJYISDSA-N 2 0 344.543 4.354 20 0 EIADRP CC(C)(C)[C@@H]1CC[N@H+](Cc2cccc(C[NH+]3CCCCC3)c2)CCO1 ZINC001176995894 1052217196 /nfs/dbraw/zinc/21/71/96/1052217196.db2.gz OZRZIDWLPAFGCJ-NRFANRHFSA-N 2 0 344.543 4.310 20 0 EIADRP CC1CC[NH+](CCC[NH2+]Cc2ccccc2CC(F)(F)F)CC1 ZINC001177122586 1052227574 /nfs/dbraw/zinc/22/75/74/1052227574.db2.gz NDTPVLJKUPTWIG-UHFFFAOYSA-N 2 0 328.422 4.003 20 0 EIADRP CCC[NH+]1CCC([N@H+](C)Cc2cc(Cl)cc3cccnc32)CC1 ZINC000171940396 1052461959 /nfs/dbraw/zinc/46/19/59/1052461959.db2.gz HNHIBJJQBNRIEK-UHFFFAOYSA-N 2 0 331.891 4.194 20 0 EIADRP c1cc2c(s1)CCC[C@@H]2[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000336707954 1052513166 /nfs/dbraw/zinc/51/31/66/1052513166.db2.gz JFXYQAFAHHBICT-MJGOQNOKSA-N 2 0 326.509 4.237 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCOc1ccccc1-c1ccccc1 ZINC000177933335 1052694533 /nfs/dbraw/zinc/69/45/33/1052694533.db2.gz RGILGGXUTLPYBU-OPYAIIAOSA-N 2 0 338.495 4.051 20 0 EIADRP Cc1csc([C@H](C)NC[C@@H]2CCC[N@H+](C)[C@@H]2c2cccs2)n1 ZINC000623898805 1052831542 /nfs/dbraw/zinc/83/15/42/1052831542.db2.gz RKQNOGNWMVQUOP-DZKIICNBSA-N 2 0 335.542 4.247 20 0 EIADRP Clc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H]1CCc2nc[nH]c2C1 ZINC000623985991 1052844453 /nfs/dbraw/zinc/84/44/53/1052844453.db2.gz IFNFDZVLIMEYDW-PXAZEXFGSA-N 2 0 340.858 4.069 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]C[C@@H]1CCCC[N@H+](C)C1 ZINC000624121280 1052867480 /nfs/dbraw/zinc/86/74/80/1052867480.db2.gz SCYUWCGFGVJXEN-PMPSAXMXSA-N 2 0 331.529 4.110 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cccc(F)c1F ZINC000183212160 1052966572 /nfs/dbraw/zinc/96/65/72/1052966572.db2.gz IBSJGMADDLHCAL-HNNXBMFYSA-N 2 0 330.422 4.411 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cccc(F)c1F ZINC000183212179 1052966610 /nfs/dbraw/zinc/96/66/10/1052966610.db2.gz IBSJGMADDLHCAL-OAHLLOKOSA-N 2 0 330.422 4.411 20 0 EIADRP C[C@H]([NH2+]CCSc1ccccc1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185706657 1053021361 /nfs/dbraw/zinc/02/13/61/1053021361.db2.gz JJEFSPWWSXWCRU-JKSUJKDBSA-N 2 0 336.520 4.160 20 0 EIADRP COc1ccc(C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000381343448 1053069606 /nfs/dbraw/zinc/06/96/06/1053069606.db2.gz LATOABLAJNQDGQ-OAQYLSRUSA-N 2 0 338.495 4.087 20 0 EIADRP C[C@@H]([NH2+]Cc1cnc2ccccc2c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000382169308 1053158638 /nfs/dbraw/zinc/15/86/38/1053158638.db2.gz PKKQCTFSXKLHFD-XMSQKQJNSA-N 2 0 345.490 4.235 20 0 EIADRP CO[C@H](C)C[N@@H+]1CCCCC[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001194940897 1053191470 /nfs/dbraw/zinc/19/14/70/1053191470.db2.gz CZCUHPVLRNEPBN-DENIHFKCSA-N 2 0 344.543 4.178 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)CCC2 ZINC000339066105 1053216915 /nfs/dbraw/zinc/21/69/15/1053216915.db2.gz BEZRDSBGBNZUQJ-NRFANRHFSA-N 2 0 326.459 4.363 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000383360163 1053329165 /nfs/dbraw/zinc/32/91/65/1053329165.db2.gz SHQAORAQKSFPSW-DOTOQJQBSA-N 2 0 330.422 4.138 20 0 EIADRP Cc1ccc(F)cc1C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000383507514 1053347111 /nfs/dbraw/zinc/34/71/11/1053347111.db2.gz KMZPZKCAKOAWAU-HKUYNNGSSA-N 2 0 326.459 4.134 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(C)o1 ZINC000383543028 1053354599 /nfs/dbraw/zinc/35/45/99/1053354599.db2.gz UXPFVLFNVNGUBZ-UWVAXJGDSA-N 2 0 326.484 4.458 20 0 EIADRP CSc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000383677411 1053374703 /nfs/dbraw/zinc/37/47/03/1053374703.db2.gz NSCKIMJFFTYGOC-XLIONFOSSA-N 2 0 340.536 4.409 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1cnn(-c2ccccc2)c1 ZINC000764965140 1053403285 /nfs/dbraw/zinc/40/32/85/1053403285.db2.gz URPKBSGTXBHZTN-RBUKOAKNSA-N 2 0 340.515 4.178 20 0 EIADRP COc1ccc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)c(C)c1 ZINC000765259602 1053478842 /nfs/dbraw/zinc/47/88/42/1053478842.db2.gz HPOOUBVYSLZFGC-UHFFFAOYSA-N 2 0 338.495 4.279 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cnc(Cl)c(F)c1 ZINC000865405429 1053492008 /nfs/dbraw/zinc/49/20/08/1053492008.db2.gz ZQOYZYDFACENRB-UHFFFAOYSA-N 2 0 335.854 4.006 20 0 EIADRP CC(C)O[C@@H]1CCC[N@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC001195809843 1053495281 /nfs/dbraw/zinc/49/52/81/1053495281.db2.gz OCABUJYUOPJIID-OAQYLSRUSA-N 2 0 330.516 4.062 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)s1 ZINC000765305779 1053500369 /nfs/dbraw/zinc/50/03/69/1053500369.db2.gz QDVQWOMUCUCZMD-JKSUJKDBSA-N 2 0 332.513 4.409 20 0 EIADRP COc1ccc2c(NC[C@@H](c3cccs3)[NH+](C)C)cc[nH+]c2c1 ZINC000765452344 1053554950 /nfs/dbraw/zinc/55/49/50/1053554950.db2.gz FIDRKWZIJNXDGN-KRWDZBQOSA-N 2 0 327.453 4.020 20 0 EIADRP c1ccc(CN2CC[C@H]([NH2+]CC[C@@H]3CCCS3)CC23CC3)cc1 ZINC000865725614 1053579164 /nfs/dbraw/zinc/57/91/64/1053579164.db2.gz NCPJRROVXDZHGU-OALUTQOASA-N 2 0 330.541 4.059 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2cnc(-c3ccccc3)s2)CC1 ZINC000865765876 1053588224 /nfs/dbraw/zinc/58/82/24/1053588224.db2.gz PZKNQEBUIUUOGX-UHFFFAOYSA-N 2 0 329.513 4.163 20 0 EIADRP C[C@@H](CCc1cncc2ccccc21)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000866236646 1053658938 /nfs/dbraw/zinc/65/89/38/1053658938.db2.gz BGHYAIOISUOXMT-KRWDZBQOSA-N 2 0 337.511 4.020 20 0 EIADRP C[C@H](CCc1c[nH]c2ccccc12)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000866290672 1053681044 /nfs/dbraw/zinc/68/10/44/1053681044.db2.gz WLIDSJJUTGBMPT-MRXNPFEDSA-N 2 0 327.516 4.342 20 0 EIADRP C[C@@H](CCc1cccnc1)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000866310362 1053686101 /nfs/dbraw/zinc/68/61/01/1053686101.db2.gz NAODOGQYYCUJOP-PELRDEGISA-N 2 0 329.532 4.035 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc2c(ccnc2Cl)o1 ZINC000866349569 1053699860 /nfs/dbraw/zinc/69/98/60/1053699860.db2.gz JUYTYDLYEFLRCY-LBPRGKRZSA-N 2 0 333.863 4.006 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+][C@@H](C)c2ccc(C(F)F)nc2)CC1 ZINC000866469597 1053740491 /nfs/dbraw/zinc/74/04/91/1053740491.db2.gz NICNYFIQGQGVLF-AWEZNQCLSA-N 2 0 325.447 4.180 20 0 EIADRP Cc1ccc(C2CC([NH2+]C[C@@H]3CC[N@H+](Cc4ccccc4)C3)C2)cc1 ZINC000386481545 1053743547 /nfs/dbraw/zinc/74/35/47/1053743547.db2.gz WGKZQVYKOUKNDP-RBKXMNCYSA-N 2 0 334.507 4.353 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+](CCCCc1cccc(Cl)c1)CC2 ZINC001196790409 1053755876 /nfs/dbraw/zinc/75/58/76/1053755876.db2.gz UCWZGPBDOMRKAB-UHFFFAOYSA-N 2 0 334.935 4.471 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCc2c1cccc2F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386578558 1053782101 /nfs/dbraw/zinc/78/21/01/1053782101.db2.gz ZGJCZCGMRKYEEG-SGXKBVARSA-N 2 0 338.470 4.313 20 0 EIADRP [NH3+]CC[C@H]1CN(c2ccc(F)c(C[NH+]3CCCC3)c2)c2ccccc21 ZINC001168548396 1053805058 /nfs/dbraw/zinc/80/50/58/1053805058.db2.gz MPRDDIFYKMPONN-INIZCTEOSA-N 2 0 339.458 4.006 20 0 EIADRP [NH3+]CC[C@H]1CN(c2ccc3c(c2)[nH]c2cc[nH+]cc23)c2ccccc21 ZINC001168549777 1053828064 /nfs/dbraw/zinc/82/80/64/1053828064.db2.gz VPLFBVZNSZYWGS-AWEZNQCLSA-N 2 0 328.419 4.300 20 0 EIADRP Cc1ccc2c(c1)CC[C@H]2[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000765704532 1053851537 /nfs/dbraw/zinc/85/15/37/1053851537.db2.gz ZEQKDTGUVDKPLU-NFBKMPQASA-N 2 0 334.507 4.137 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CC[C@@H]2CC2(F)F)ccc1OC ZINC000857082520 1054173870 /nfs/dbraw/zinc/17/38/70/1054173870.db2.gz WUHINHLAGAPSJR-RHSMWYFYSA-N 2 0 340.458 4.233 20 0 EIADRP Cc1cc(C)c([C@H](C)[N@@H+]2C[C@@]34C[NH+](C)C[C@]3(C2)CCCC4)c(C)c1 ZINC001198821551 1054276206 /nfs/dbraw/zinc/27/62/06/1054276206.db2.gz SSALMYGBKKHHAS-ILWGZMRPSA-N 2 0 326.528 4.481 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1c(Cl)ccc2cccnc21 ZINC001198952204 1054311381 /nfs/dbraw/zinc/31/13/81/1054311381.db2.gz BYVDLPHUWAJOIW-OAHLLOKOSA-N 2 0 333.907 4.488 20 0 EIADRP CC(C)[C@H](C[NH2+][C@@H]1CCCc2ccccc2C1)[NH+]1CCCCCC1 ZINC001199161237 1054354372 /nfs/dbraw/zinc/35/43/72/1054354372.db2.gz IQAZKFGQPGSSJO-YADHBBJMSA-N 2 0 328.544 4.424 20 0 EIADRP CCO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)C1 ZINC001199265852 1054376174 /nfs/dbraw/zinc/37/61/74/1054376174.db2.gz FANKTOINVGYHLA-BVYCBKJFSA-N 2 0 344.543 4.498 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]C[C@H]1CCCC[C@@H]1C ZINC001199329504 1054392953 /nfs/dbraw/zinc/39/29/53/1054392953.db2.gz UFZNKQAFFSCIME-RBUKOAKNSA-N 2 0 332.532 4.323 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]C2CCC3(COC(C)(C)C3)CC2)CC1 ZINC001199328725 1054393297 /nfs/dbraw/zinc/39/32/97/1054393297.db2.gz GAPOWWDLCGINOM-UHFFFAOYSA-N 2 0 336.564 4.216 20 0 EIADRP Cc1nc(C[N@H+](C)CCCCCC[NH3+])oc1-c1ccc(Cl)cc1 ZINC000872155588 1054412608 /nfs/dbraw/zinc/41/26/08/1054412608.db2.gz RTCGPHPMLYHAHJ-UHFFFAOYSA-N 2 0 335.879 4.254 20 0 EIADRP C[C@H](C[NH2+]Cc1ccc2c(c1)CCC(C)(C)O2)C[NH+]1CCCCC1 ZINC001199582516 1054425791 /nfs/dbraw/zinc/42/57/91/1054425791.db2.gz OJTZICRQCAUFNI-QGZVFWFLSA-N 2 0 330.516 4.002 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CCO1 ZINC001199629670 1054435779 /nfs/dbraw/zinc/43/57/79/1054435779.db2.gz LRCRXIZUNPPZKK-PXNSSMCTSA-N 2 0 330.516 4.108 20 0 EIADRP C[C@]1(CN[C@@H]2CCCc3scnc32)CC[N@H+](Cc2ccccc2)C1 ZINC000858414667 1054485047 /nfs/dbraw/zinc/48/50/47/1054485047.db2.gz FWWSCRMYXDMFKV-YLJYHZDGSA-N 2 0 341.524 4.022 20 0 EIADRP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc(SC(F)F)cc1 ZINC000873236771 1054513119 /nfs/dbraw/zinc/51/31/19/1054513119.db2.gz DIQKNCWDXITDBS-ZDUSSCGKSA-N 2 0 348.462 4.498 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873255440 1054517823 /nfs/dbraw/zinc/51/78/23/1054517823.db2.gz GXVSPYBEHLZRHW-IXPVHAAZSA-N 2 0 335.904 4.160 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001201609251 1054863953 /nfs/dbraw/zinc/86/39/53/1054863953.db2.gz FEKULCPALOKNJL-XZOQPEGZSA-N 2 0 334.507 4.073 20 0 EIADRP C[N@H+]1CC=C(C[NH2+]Cc2cccc(-c3ccc(Cl)cc3)c2)CC1 ZINC001201665210 1054879847 /nfs/dbraw/zinc/87/98/47/1054879847.db2.gz XLIACCLNLGVJPJ-UHFFFAOYSA-N 2 0 326.871 4.359 20 0 EIADRP CC[NH+](CC)CCCN1CC[NH+](CC[C@@H](C)CCC=C(C)C)CC1 ZINC001201981379 1054957707 /nfs/dbraw/zinc/95/77/07/1054957707.db2.gz MYWYCUBFJFZBOQ-NRFANRHFSA-N 2 0 337.596 4.109 20 0 EIADRP CC(C)=CCC[C@@H](C)CC[NH+]1CCC([N@H+](C)C2CCOCC2)CC1 ZINC001201983086 1054959406 /nfs/dbraw/zinc/95/94/06/1054959406.db2.gz XGZRTKXPADXZSJ-LJQANCHMSA-N 2 0 336.564 4.334 20 0 EIADRP CCO[P@@](C)(=O)CC[C@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000877080459 1055013030 /nfs/dbraw/zinc/01/30/30/1055013030.db2.gz JELFOUXMNBLHJC-QMHKHESXSA-N 2 0 344.480 4.096 20 0 EIADRP FC(F)C1(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000671762703 1055053981 /nfs/dbraw/zinc/05/39/81/1055053981.db2.gz GYPRWQFEIDKXDS-CEXWTWQISA-N 2 0 348.481 4.312 20 0 EIADRP COCC(C)(C)CC[NH2+][C@H]1CCN(C2CC2)[C@H](c2ccccc2)C1 ZINC000877803737 1055123619 /nfs/dbraw/zinc/12/36/19/1055123619.db2.gz JDMAKYZATZYEAT-ICSRJNTNSA-N 2 0 330.516 4.007 20 0 EIADRP FC(F)(F)CCC[NH+]1CCC2(CC[N@H+](Cc3cccs3)C2)CC1 ZINC001202397177 1055169984 /nfs/dbraw/zinc/16/99/84/1055169984.db2.gz YVBIIFYCNGVMIJ-UHFFFAOYSA-N 2 0 346.462 4.379 20 0 EIADRP FC(F)(F)CCC[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@H]2C1 ZINC001202444051 1055176674 /nfs/dbraw/zinc/17/66/74/1055176674.db2.gz COAPXRUNKSPPMH-ZWKOTPCHSA-N 2 0 340.433 4.173 20 0 EIADRP C[C@H]([NH2+]CCCCCCC[NH+]1CCCC1)c1ccc2c(c1)COC2 ZINC000765776515 1055214709 /nfs/dbraw/zinc/21/47/09/1055214709.db2.gz QWWYPAPTYHYWDM-SFHVURJKSA-N 2 0 330.516 4.414 20 0 EIADRP c1cc(OC2CCCCC2)ccc1C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000166421086 1055572418 /nfs/dbraw/zinc/57/24/18/1055572418.db2.gz BOSRNQNHHAITAX-RBUKOAKNSA-N 2 0 328.500 4.115 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C2CCC2)CC1)C1CCC(C(F)(F)F)CC1 ZINC000474600228 1055923424 /nfs/dbraw/zinc/92/34/24/1055923424.db2.gz GWIKZVMTOBZFPB-NFOMZHRRSA-N 2 0 332.454 4.350 20 0 EIADRP Clc1cccc2c1C[C@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)C2 ZINC001168675130 1056633633 /nfs/dbraw/zinc/63/36/33/1056633633.db2.gz DEWDCDIPJFWSIK-LJQANCHMSA-N 2 0 340.898 4.193 20 0 EIADRP CC(=O)Nc1ccc([C@@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)cc1 ZINC000182111107 1059748518 /nfs/dbraw/zinc/74/85/18/1059748518.db2.gz FONPMZYCCWEDQW-QGZVFWFLSA-N 2 0 345.531 4.054 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)cc1F ZINC000766511720 1060482718 /nfs/dbraw/zinc/48/27/18/1060482718.db2.gz GIMJSJPVKSPKQR-FAEJEUNOSA-N 2 0 334.479 4.282 20 0 EIADRP C[C@H]1C[N@H+](Cc2cccc(C(F)(F)F)c2Cl)CCC[C@H]1C[NH3+] ZINC001205995741 1060512570 /nfs/dbraw/zinc/51/25/70/1060512570.db2.gz PTMFGELENJHKPF-RYUDHWBXSA-N 2 0 334.813 4.166 20 0 EIADRP CC(C)C[C@H](Cc1ccccc1)[NH+]1CC2(C1)CC[N@H+](CC1CC1)C2 ZINC001169071045 1060629281 /nfs/dbraw/zinc/62/92/81/1060629281.db2.gz UCQVXYPOOQFBRT-OAQYLSRUSA-N 2 0 326.528 4.062 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CC1c3ccccc3CCc3ccccc31)C2 ZINC001169108363 1060657994 /nfs/dbraw/zinc/65/79/94/1060657994.db2.gz SABCGTXHFLBFIK-MZADTFQBSA-N 2 0 346.518 4.132 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCc3ccccc3[C@@H]1c1ccccc1)C2 ZINC001169143233 1060663466 /nfs/dbraw/zinc/66/34/66/1060663466.db2.gz ZCLCIAGQCXTXRG-KGSLCBSSSA-N 2 0 332.491 4.259 20 0 EIADRP C[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]CCc1c[nH]c2ccccc12 ZINC000532188302 1032078158 /nfs/dbraw/zinc/07/81/58/1032078158.db2.gz CTDPQNUXXFUXKW-PGRDOPGGSA-N 2 0 347.506 4.211 20 0 EIADRP COc1ccc(OC)c([C@H](C)[NH2+]CCCCC[NH+]2CCCCC2)c1 ZINC000532228799 1032105670 /nfs/dbraw/zinc/10/56/70/1032105670.db2.gz QKHUANIVBRKWKA-KRWDZBQOSA-N 2 0 334.504 4.011 20 0 EIADRP CC[N@H+](C1CCN(c2cc(C)nc(C(C)C)n2)CC1)[C@H]1C=CCCC1 ZINC000532734533 1032272473 /nfs/dbraw/zinc/27/24/73/1032272473.db2.gz LOYUILTYVDQOFO-SFHVURJKSA-N 2 0 342.531 4.308 20 0 EIADRP CCC1(C[NH2+]Cc2cccc(O)c2)CC[NH+](Cc2ccccc2)CC1 ZINC000532805395 1032323317 /nfs/dbraw/zinc/32/33/17/1032323317.db2.gz UZIFVJKRVYIVPQ-UHFFFAOYSA-N 2 0 338.495 4.174 20 0 EIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](C)c2ccccc2C(C)(C)C)CC1 ZINC000532845863 1032357232 /nfs/dbraw/zinc/35/72/32/1032357232.db2.gz XGMPUVZVEXOWIW-IBGZPJMESA-N 2 0 345.575 4.052 20 0 EIADRP C[C@@H]([NH2+]C[C@H](C)COCc1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000389899378 1032427328 /nfs/dbraw/zinc/42/73/28/1032427328.db2.gz ARXSPZCSYSOHDD-RBUKOAKNSA-N 2 0 349.478 4.376 20 0 EIADRP C[N@@H+](Cc1ccc2cc[nH]c2c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000529535980 1032442476 /nfs/dbraw/zinc/44/24/76/1032442476.db2.gz VHLRMZPUHIRLBJ-HXUWFJFHSA-N 2 0 333.479 4.122 20 0 EIADRP CC[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccncc1 ZINC000245750723 1032459624 /nfs/dbraw/zinc/45/96/24/1032459624.db2.gz TZBIKJDSJZDLTG-KJJMTIBFSA-N 2 0 335.495 4.318 20 0 EIADRP FC1(F)CC(C[N@@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)C1 ZINC000450451539 1032508426 /nfs/dbraw/zinc/50/84/26/1032508426.db2.gz HWCBVUCYSLUPBZ-LJQANCHMSA-N 2 0 334.454 4.020 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccccc1F ZINC000180152271 1032594925 /nfs/dbraw/zinc/59/49/25/1032594925.db2.gz QQDWEMJSOVSERL-HXUWFJFHSA-N 2 0 330.447 4.007 20 0 EIADRP C[N@H+](CC1CCN(c2cc[nH+]cc2)CC1)C[C@H]1CCCCC1(F)F ZINC000450638616 1032608648 /nfs/dbraw/zinc/60/86/48/1032608648.db2.gz JDSGJXDHLPXBLI-QGZVFWFLSA-N 2 0 337.458 4.055 20 0 EIADRP COc1cc(-c2ccccc2)ccc1C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000512396735 1032664990 /nfs/dbraw/zinc/66/49/90/1032664990.db2.gz SPBYTKTXWNYRCZ-UHFFFAOYSA-N 2 0 338.495 4.184 20 0 EIADRP CCC[N@@H+]1CC[C@H](CNCc2ccc(-c3ccccc3)cc2OC)C1 ZINC000512421913 1032730033 /nfs/dbraw/zinc/73/00/33/1032730033.db2.gz NDYXPASSZAGEPV-GOSISDBHSA-N 2 0 338.495 4.184 20 0 EIADRP CC[N@H+](C)C[C@H]1CCN(Cc2c(OC(C)C)ccc3ccccc32)C1 ZINC000533469883 1032787860 /nfs/dbraw/zinc/78/78/60/1032787860.db2.gz MPIVYTSXCKPHGO-GOSISDBHSA-N 2 0 340.511 4.401 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000579726811 1018828261 /nfs/dbraw/zinc/82/82/61/1018828261.db2.gz WKMAUYIJQFCDTL-ROUUACIJSA-N 2 0 340.433 4.273 20 0 EIADRP CCOc1ccc([C@H](CC)[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1OCC ZINC000643546044 1018898112 /nfs/dbraw/zinc/89/81/12/1018898112.db2.gz HITQEUCZHHHWOL-MSOLQXFVSA-N 2 0 346.515 4.199 20 0 EIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000432814817 1032860921 /nfs/dbraw/zinc/86/09/21/1032860921.db2.gz BIRCCNUGZUCPAJ-HXUWFJFHSA-N 2 0 338.495 4.278 20 0 EIADRP C[C@@H](c1ccc(Br)cc1)[N@H+](C)CCC[NH+]1CCCCC1 ZINC001209452977 1020362380 /nfs/dbraw/zinc/36/23/80/1020362380.db2.gz AYZNUSNDZWHYMC-HNNXBMFYSA-N 2 0 339.321 4.318 20 0 EIADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547831561 1020779559 /nfs/dbraw/zinc/77/95/59/1020779559.db2.gz ACPRCCVYUZNZTO-GBAJDQEWSA-N 2 0 344.543 4.080 20 0 EIADRP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805297 1020972599 /nfs/dbraw/zinc/97/25/99/1020972599.db2.gz FPFMXIXGGWLJFC-CWRNSKLLSA-N 2 0 326.937 4.141 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000655805842 1020972752 /nfs/dbraw/zinc/97/27/52/1020972752.db2.gz LZAKWTACRMFALA-HYVNUMGLSA-N 2 0 341.524 4.117 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](Cc2ccccc2F)c2ccccc2)C1 ZINC000655803639 1020974759 /nfs/dbraw/zinc/97/47/59/1020974759.db2.gz ARPAYLFJSREOSE-SCWSEQNSSA-N 2 0 326.459 4.039 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655806114 1020975887 /nfs/dbraw/zinc/97/58/87/1020975887.db2.gz PKFRQSJMWFXTAR-KYJSFNMBSA-N 2 0 343.540 4.418 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCCc3c(O)cccc32)c1 ZINC000340476169 1021098534 /nfs/dbraw/zinc/09/85/34/1021098534.db2.gz UVZXZCXPLIWCKH-OAQYLSRUSA-N 2 0 338.495 4.401 20 0 EIADRP CCN1CCC[C@H]1C[NH2+]C(CCC(F)(F)F)CCC(F)(F)F ZINC000924561873 1021564605 /nfs/dbraw/zinc/56/46/05/1021564605.db2.gz YHFOLWIKRNNGRN-LBPRGKRZSA-N 2 0 334.348 4.114 20 0 EIADRP Cc1nc(C)c([C@H](C)[NH2+]C[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)s1 ZINC000376165592 1021638934 /nfs/dbraw/zinc/63/89/34/1021638934.db2.gz ZQUICPWTRUDVGG-MORSLUCNSA-N 2 0 329.513 4.104 20 0 EIADRP c1cc(-c2ccccc2)sc1C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000613266532 1021839049 /nfs/dbraw/zinc/83/90/49/1021839049.db2.gz GKLHDPGYVRHOON-UHFFFAOYSA-N 2 0 326.509 4.379 20 0 EIADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1csc(-c2ccccc2)n1 ZINC000414127753 1021894246 /nfs/dbraw/zinc/89/42/46/1021894246.db2.gz SOWDUZGBMRLIIU-HNNXBMFYSA-N 2 0 329.513 4.193 20 0 EIADRP C[NH+](C/C=C/C[N@@H+](C)Cc1cccc(F)c1)Cc1cccc(F)c1 ZINC000613366037 1021895539 /nfs/dbraw/zinc/89/55/39/1021895539.db2.gz SQGKZNXQACHGGP-ONEGZZNKSA-N 2 0 330.422 4.085 20 0 EIADRP Fc1cc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)ccc1Cl ZINC000379769107 1021944148 /nfs/dbraw/zinc/94/41/48/1021944148.db2.gz NTLLKXVKSFFIDG-SFHVURJKSA-N 2 0 346.877 4.481 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1csc(-c2ccccc2)n1 ZINC000414148373 1021976391 /nfs/dbraw/zinc/97/63/91/1021976391.db2.gz NUNNHUQTWIIMJJ-HNNXBMFYSA-N 2 0 341.524 4.335 20 0 EIADRP COc1ccc2cc([C@H](C)[NH2+]CC[C@@H]3CCC[N@H+](C)C3)ccc2c1 ZINC000414171312 1022022869 /nfs/dbraw/zinc/02/28/69/1022022869.db2.gz DFFQWXZJZKMYHY-IRXDYDNUSA-N 2 0 326.484 4.231 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCCc2nc(C)sc21 ZINC000163785918 1022029443 /nfs/dbraw/zinc/02/94/43/1022029443.db2.gz HTFDMNFYMLUHEZ-GOSISDBHSA-N 2 0 343.540 4.461 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c[nH+]cn3c1)CCCS2 ZINC000414178406 1022037115 /nfs/dbraw/zinc/03/71/15/1022037115.db2.gz JNCCHJNGRJJUSA-GOSISDBHSA-N 2 0 339.464 4.060 20 0 EIADRP CC[C@@H]([NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000414219479 1022190257 /nfs/dbraw/zinc/19/02/57/1022190257.db2.gz HLPYLPSYNBSXTF-DYESRHJHSA-N 2 0 326.484 4.429 20 0 EIADRP COC1CC([NH2+][C@@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC000580576412 1022223412 /nfs/dbraw/zinc/22/34/12/1022223412.db2.gz SQKFVRYYMULQCH-AGONQYTISA-N 2 0 348.918 4.021 20 0 EIADRP COc1ccsc1[C@H](C)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000471602659 1022308164 /nfs/dbraw/zinc/30/81/64/1022308164.db2.gz CTHLLGUDIXOTHK-BQFCYCMXSA-N 2 0 344.524 4.318 20 0 EIADRP CCCn1ccnc1CCC[N@H+](C)Cc1cccc(SCC)c1 ZINC000564611457 1022314407 /nfs/dbraw/zinc/31/44/07/1022314407.db2.gz CJZJKAZLJJHQGX-UHFFFAOYSA-N 2 0 331.529 4.470 20 0 EIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3cnc(-c4cccs4)s3)C2)CC1 ZINC000580636672 1022332017 /nfs/dbraw/zinc/33/20/17/1022332017.db2.gz ZNZWOZQUOSBSNF-HNNXBMFYSA-N 2 0 347.553 4.035 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2c(C)nn(C(C)C)c2C)c1 ZINC000892613539 1022537002 /nfs/dbraw/zinc/53/70/02/1022537002.db2.gz VUAFTPIDOFIWEQ-UHFFFAOYSA-N 2 0 342.531 4.212 20 0 EIADRP C[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Br)s1 ZINC000088163908 1022550553 /nfs/dbraw/zinc/55/05/53/1022550553.db2.gz XDUHJBGCTDZDSX-WODVXLOZSA-N 2 0 343.334 4.177 20 0 EIADRP c1nc(C2CCCC2)sc1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647544381 1022786026 /nfs/dbraw/zinc/78/60/26/1022786026.db2.gz ZQMGYVMKVYWLFK-DLBZAZTESA-N 2 0 333.545 4.012 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H](C)CSC)cc1C[NH+]1CCCCC1 ZINC000182995955 1022838592 /nfs/dbraw/zinc/83/85/92/1022838592.db2.gz RIBHBZONMAPQAY-CVEARBPZSA-N 2 0 336.545 4.083 20 0 EIADRP C[C@@H](Cc1ccccc1F)[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000311193164 1022875023 /nfs/dbraw/zinc/87/50/23/1022875023.db2.gz GPZLAMUKBSTGMA-AZUAARDMSA-N 2 0 340.486 4.259 20 0 EIADRP CC(C)c1ccc(-c2ncc(C[N@@H+]3CCC[C@H]([C@H](C)[NH3+])C3)s2)cc1 ZINC000430556799 1023006400 /nfs/dbraw/zinc/00/64/00/1023006400.db2.gz VKDCODRWJDXUEO-YJBOKZPZSA-N 2 0 343.540 4.493 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)nc2)c1 ZINC000181399666 1023040035 /nfs/dbraw/zinc/04/00/35/1023040035.db2.gz OKPAPOVVOXVWKK-HNNXBMFYSA-N 2 0 331.891 4.426 20 0 EIADRP Cc1nc(C)c([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000178635271 1023163149 /nfs/dbraw/zinc/16/31/49/1023163149.db2.gz HAAZKNGDAIXBOH-OAHLLOKOSA-N 2 0 343.540 4.323 20 0 EIADRP Cc1cccc(N2CCC([NH2+][C@@H](C)[C@@H]3C[C@H]3c3cccs3)CC2)n1 ZINC000417300771 1023249262 /nfs/dbraw/zinc/24/92/62/1023249262.db2.gz AYPNLCNLYVHTGB-RYQLBKOJSA-N 2 0 341.524 4.202 20 0 EIADRP CN(C)Cc1cnc(C[N@H+](C)[C@@H]2CCCC[C@@H]2c2ccccc2)s1 ZINC000414535013 1023252557 /nfs/dbraw/zinc/25/25/57/1023252557.db2.gz VYRZTDZVOQIZBP-RTBURBONSA-N 2 0 343.540 4.363 20 0 EIADRP C[C@@H](NCc1nsc2ccccc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000660258046 1023394841 /nfs/dbraw/zinc/39/48/41/1023394841.db2.gz YVVYQIVNLLVQSE-CABCVRRESA-N 2 0 329.513 4.039 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@H]2CC2(Cl)Cl)CC1 ZINC000728688751 1023395433 /nfs/dbraw/zinc/39/54/33/1023395433.db2.gz TZHBVXBJPKFBRT-QGZVFWFLSA-N 2 0 341.326 4.024 20 0 EIADRP Cc1ccc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)c(Br)c1 ZINC000415052384 1023409163 /nfs/dbraw/zinc/40/91/63/1023409163.db2.gz KXGRMFGAOXARMN-GOSISDBHSA-N 2 0 347.300 4.327 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1csc(-c2cccs2)n1)c1ccccc1 ZINC000415052348 1023409591 /nfs/dbraw/zinc/40/95/91/1023409591.db2.gz KSKKQSGJNRYGAS-MRXNPFEDSA-N 2 0 343.521 4.441 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1sccc1Br)c1ccccc1 ZINC000415049575 1023409733 /nfs/dbraw/zinc/40/97/33/1023409733.db2.gz HVPKEHRJAQFQBX-AWEZNQCLSA-N 2 0 339.302 4.080 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H](CCC[NH3+])c2ccccc2)CC1 ZINC000415052865 1023410127 /nfs/dbraw/zinc/41/01/27/1023410127.db2.gz LVQOOQNRRYKSRT-QIJUGHKUSA-N 3 0 343.559 4.099 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1csc(-c2ccccc2)n1)c1ccccc1 ZINC000415057572 1023410611 /nfs/dbraw/zinc/41/06/11/1023410611.db2.gz RQYKRNXDMUZVAL-LJQANCHMSA-N 2 0 337.492 4.380 20 0 EIADRP COc1cc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)ccc1OC(C)C ZINC000415065491 1023412392 /nfs/dbraw/zinc/41/23/92/1023412392.db2.gz MXRDBFCJWFZGAT-IBGZPJMESA-N 2 0 342.483 4.052 20 0 EIADRP CC(C)c1ccc(-c2nc(C[NH+]3CCC(C[NH3+])CC3)cs2)cc1 ZINC000430618544 1023443351 /nfs/dbraw/zinc/44/33/51/1023443351.db2.gz VFAXYJQAYOJBHQ-UHFFFAOYSA-N 2 0 329.513 4.104 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1cccc2c1NCC2 ZINC000415129052 1023454295 /nfs/dbraw/zinc/45/42/95/1023454295.db2.gz YHUFKBVNEHGCSG-SFHVURJKSA-N 2 0 349.522 4.319 20 0 EIADRP C[C@H](C[N@H+](C)C[C@H]1CCC[NH+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500078107 1023491434 /nfs/dbraw/zinc/49/14/34/1023491434.db2.gz ZUTLUDNOUHBORZ-CABCVRRESA-N 2 0 328.422 4.083 20 0 EIADRP Cc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(C)c1 ZINC000341278052 1023497879 /nfs/dbraw/zinc/49/78/79/1023497879.db2.gz UDDFLZUSGZZLJW-UHFFFAOYSA-N 2 0 338.495 4.066 20 0 EIADRP Cc1ccccc1[C@H](C(C)C)[N@H+](C)CCCN1CC[NH+](C(C)C)CC1 ZINC000500099868 1023500843 /nfs/dbraw/zinc/50/08/43/1023500843.db2.gz VPSMDBVCALKHLV-QFIPXVFZSA-N 2 0 345.575 4.040 20 0 EIADRP C[C@@H](C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000500106264 1023505002 /nfs/dbraw/zinc/50/50/02/1023505002.db2.gz ZLIHJQSZQXBZLJ-JKSUJKDBSA-N 2 0 340.433 4.227 20 0 EIADRP C[C@H](C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000500106263 1023505112 /nfs/dbraw/zinc/50/51/12/1023505112.db2.gz ZLIHJQSZQXBZLJ-HZPDHXFCSA-N 2 0 340.433 4.227 20 0 EIADRP c1cc(-c2nc(C[NH+]3CCC([C@H]4CCC[NH2+]C4)CC3)cs2)cs1 ZINC000656785546 1023530777 /nfs/dbraw/zinc/53/07/77/1023530777.db2.gz LUWULKAZFBIFEG-HNNXBMFYSA-N 2 0 347.553 4.083 20 0 EIADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CCCC1 ZINC000656789499 1023535949 /nfs/dbraw/zinc/53/59/49/1023535949.db2.gz OYNDRTFMDQLHBX-HOTGVXAUSA-N 2 0 326.406 4.203 20 0 EIADRP CCc1ccc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)cn1 ZINC000581693910 1023616119 /nfs/dbraw/zinc/61/61/19/1023616119.db2.gz VAGZZFNXVJSKFU-GOSISDBHSA-N 2 0 329.532 4.121 20 0 EIADRP CC[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(OC)c(OC)c1 ZINC000120548220 1023625937 /nfs/dbraw/zinc/62/59/37/1023625937.db2.gz QHDSPDZUONDORA-INIZCTEOSA-N 2 0 334.504 4.054 20 0 EIADRP CC[C@@H](Cc1cccs1)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000684410402 1023661037 /nfs/dbraw/zinc/66/10/37/1023661037.db2.gz XPGGXCXUAWJJDX-OALUTQOASA-N 2 0 328.525 4.181 20 0 EIADRP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000581847179 1023762422 /nfs/dbraw/zinc/76/24/22/1023762422.db2.gz XUMGTXUDNDRSLE-SCZPIIQISA-N 2 0 326.406 4.040 20 0 EIADRP Fc1ccc(/C=C/C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000511784738 1023881782 /nfs/dbraw/zinc/88/17/82/1023881782.db2.gz HTRSVHHRMMMBJK-QTWIXLPOSA-N 2 0 342.433 4.090 20 0 EIADRP FC1(F)CC[C@H](C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000430750925 1024010451 /nfs/dbraw/zinc/01/04/51/1024010451.db2.gz QOJRTGZZCGJBAI-VNTMZGSJSA-N 2 0 348.481 4.312 20 0 EIADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000510699585 1024251997 /nfs/dbraw/zinc/25/19/97/1024251997.db2.gz CDTQHSACKKRAJB-HKUYNNGSSA-N 2 0 338.536 4.468 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2cccc(-c3ccncc3)c2)CC1 ZINC000093688584 1024842301 /nfs/dbraw/zinc/84/23/01/1024842301.db2.gz WNRCMBIBRORXAZ-UHFFFAOYSA-N 2 0 337.511 4.302 20 0 EIADRP COCC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)(C)C ZINC000510959287 1024866611 /nfs/dbraw/zinc/86/66/11/1024866611.db2.gz GEZQVOSMCFXMIE-VTHDOGFWSA-N 2 0 344.543 4.223 20 0 EIADRP c1ccc(C[N@H+]2CCC[C@@H](C[NH2+][C@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000684611410 1025055967 /nfs/dbraw/zinc/05/59/67/1025055967.db2.gz GLMNPPYBBXFDNC-REWPJTCUSA-N 2 0 349.522 4.425 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2csc(-c3ccccc3F)n2)[C@@H]1CCC[NH3+] ZINC000662314539 1025067595 /nfs/dbraw/zinc/06/75/95/1025067595.db2.gz FGXLNKQFKYGFDO-RDTXWAMCSA-N 2 0 347.503 4.289 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2Oc2cccnc2)[C@@H]1CCC[NH3+] ZINC000662317204 1025072341 /nfs/dbraw/zinc/07/23/41/1025072341.db2.gz PBWKHETXHFCFNJ-YLJYHZDGSA-N 2 0 339.483 4.213 20 0 EIADRP C[C@H](c1nc2ccccc2o1)[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000181188340 1025121829 /nfs/dbraw/zinc/12/18/29/1025121829.db2.gz BOJAGAPLYNNUAI-QGZVFWFLSA-N 2 0 341.499 4.477 20 0 EIADRP FC(F)(F)C1CCC(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)CC1 ZINC000663346949 1025142002 /nfs/dbraw/zinc/14/20/02/1025142002.db2.gz YKKGRYCBZUZCRM-WIHSUSGWSA-N 2 0 332.454 4.067 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccnc(Cl)c1 ZINC000162923891 1025212984 /nfs/dbraw/zinc/21/29/84/1025212984.db2.gz PGXKXIVGMGZWFK-OAHLLOKOSA-N 2 0 329.875 4.182 20 0 EIADRP CC[C@H](c1ccc(F)cc1)[NH+]1CCC(OCC[NH+](CC)CC)CC1 ZINC000342107576 1025265902 /nfs/dbraw/zinc/26/59/02/1025265902.db2.gz CPQCOSJWYFPZRQ-HXUWFJFHSA-N 2 0 336.495 4.100 20 0 EIADRP COCCC[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc(F)cc1 ZINC000663465251 1025388219 /nfs/dbraw/zinc/38/82/19/1025388219.db2.gz IUTILJYPQAACOD-RXVVDRJESA-N 2 0 348.506 4.005 20 0 EIADRP Clc1cccc(C2CC([NH2+]C[C@@H]3CCC[N@H+](CC4CC4)C3)C2)c1 ZINC000663466629 1025397027 /nfs/dbraw/zinc/39/70/27/1025397027.db2.gz WDABFGAASSKFTG-VQSBYGRUSA-N 2 0 332.919 4.298 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cccc(OC(F)F)c1 ZINC000663468249 1025408220 /nfs/dbraw/zinc/40/82/20/1025408220.db2.gz KXTMEOYPHLOFCH-ZBFHGGJFSA-N 2 0 338.442 4.061 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cccc(OCC3CCCCC3)c2)C1 ZINC000518796442 1025489722 /nfs/dbraw/zinc/48/97/22/1025489722.db2.gz HKWZKMVMXDMGBN-HXUWFJFHSA-N 2 0 330.516 4.077 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000519138846 1025524743 /nfs/dbraw/zinc/52/47/43/1025524743.db2.gz CQRACFAFEZBJSZ-WQVCFCJDSA-N 2 0 345.487 4.044 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000519138845 1025525900 /nfs/dbraw/zinc/52/59/00/1025525900.db2.gz CQRACFAFEZBJSZ-UHOFOFEASA-N 2 0 345.487 4.044 20 0 EIADRP CC[NH+]1CCC(C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)CC1 ZINC000519198578 1025594951 /nfs/dbraw/zinc/59/49/51/1025594951.db2.gz MYHFZSYWPKYEAU-UHFFFAOYSA-N 2 0 332.875 4.422 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC001167833349 1025782181 /nfs/dbraw/zinc/78/21/81/1025782181.db2.gz APSSOASVHKWFRF-IFMALSPDSA-N 2 0 345.575 4.093 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@@H]1c1cccc(C(=O)OC)c1 ZINC001167834082 1025811368 /nfs/dbraw/zinc/81/13/68/1025811368.db2.gz HLINSFRWUMWWCZ-FXAWDEMLSA-N 2 0 346.515 4.121 20 0 EIADRP C[N@H+](CC[C@H]1CCCC[NH+]1C)CCn1ccc2cc(Cl)ccc21 ZINC001167510002 1025826594 /nfs/dbraw/zinc/82/65/94/1025826594.db2.gz SHRLLUWZYMIDFP-GOSISDBHSA-N 2 0 333.907 4.101 20 0 EIADRP C[N@H+](CC[C@@H]1CCCC[NH+]1C)CCn1ccc2cc(Cl)ccc21 ZINC001167510003 1025827252 /nfs/dbraw/zinc/82/72/52/1025827252.db2.gz SHRLLUWZYMIDFP-SFHVURJKSA-N 2 0 333.907 4.101 20 0 EIADRP C[C@H]([NH2+][C@H](c1cccc(Cl)c1)c1ccccn1)C1CC[NH+](C)CC1 ZINC000124640348 1025830382 /nfs/dbraw/zinc/83/03/82/1025830382.db2.gz UMSWXEJLZLHECM-MGPUTAFESA-N 2 0 343.902 4.144 20 0 EIADRP CCCOc1ccccc1[C@H](CC(C)C)[NH2+]CCn1ccnc1C ZINC000342318644 1025845596 /nfs/dbraw/zinc/84/55/96/1025845596.db2.gz FDKPAACXIQYMDI-IBGZPJMESA-N 2 0 329.488 4.357 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](CC)[C@H]1CCN(Cc2ccccc2)C1 ZINC001167838965 1025851681 /nfs/dbraw/zinc/85/16/81/1025851681.db2.gz XGONZEJYRFVWEM-IRLDBZIGSA-N 2 0 345.575 4.093 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@@H](Cc2ccc(OC)cc2)C1 ZINC001167839903 1025855438 /nfs/dbraw/zinc/85/54/38/1025855438.db2.gz COTPULONLFKIGA-FPOVZHCZSA-N 2 0 346.559 4.460 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@@H](Cc2ccc(OC)cc2)C1 ZINC001167839901 1025855625 /nfs/dbraw/zinc/85/56/25/1025855625.db2.gz COTPULONLFKIGA-CTNGQTDRSA-N 2 0 346.559 4.460 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCc2nccn2C1)c1ccc(SC(F)F)cc1 ZINC000278943183 1025856131 /nfs/dbraw/zinc/85/61/31/1025856131.db2.gz KJZVIACXTKNKGS-OLZOCXBDSA-N 2 0 337.439 4.111 20 0 EIADRP [NH3+]Cc1cn(C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c2ccc(Cl)cc12 ZINC001167967109 1025865092 /nfs/dbraw/zinc/86/50/92/1025865092.db2.gz BVNJVSJWTSRULH-JWTNVVGKSA-N 2 0 343.902 4.331 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)n1nc(C2CC[NH2+]CC2)c2ccccc21 ZINC001167840732 1025871317 /nfs/dbraw/zinc/87/13/17/1025871317.db2.gz IAJGMYMIVKSMMC-KRWDZBQOSA-N 2 0 342.531 4.186 20 0 EIADRP [NH3+][C@H]1CCc2c(c3ccccc3n2C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C1 ZINC001167968902 1025934770 /nfs/dbraw/zinc/93/47/70/1025934770.db2.gz WMPMNLASEJZUPL-HTUJPFKRSA-N 2 0 349.522 4.035 20 0 EIADRP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]CCC1CC[NH+](C)CC1 ZINC000431335523 1025941751 /nfs/dbraw/zinc/94/17/51/1025941751.db2.gz ZXGUIYFHCWFNFE-SFHVURJKSA-N 2 0 336.907 4.184 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H](CC(C)(C)C)c2ccccc2)CC1 ZINC000344081306 1025985365 /nfs/dbraw/zinc/98/53/65/1025985365.db2.gz XFXFIQCKNNAUKM-HXUWFJFHSA-N 2 0 332.532 4.254 20 0 EIADRP [NH3+][C@@H]1CCc2c3ccccc3n(C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)c2C1 ZINC001167969834 1026031091 /nfs/dbraw/zinc/03/10/91/1026031091.db2.gz FRZCUZAOTXHITM-KAKFPZCNSA-N 2 0 349.522 4.035 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2cc(C)c(Br)s2)C1 ZINC000512130020 1026079313 /nfs/dbraw/zinc/07/93/13/1026079313.db2.gz MNMSTUIGANKHDT-CHWSQXEVSA-N 2 0 345.350 4.202 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000431353862 1026149809 /nfs/dbraw/zinc/14/98/09/1026149809.db2.gz XCSHWZKNYSTUFS-HLIPFELVSA-N 2 0 328.500 4.240 20 0 EIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3cccc4cc[nH]c43)C2)CC1 ZINC000512164658 1026193272 /nfs/dbraw/zinc/19/32/72/1026193272.db2.gz DBUNJRVFSADZPT-GOSISDBHSA-N 2 0 325.500 4.112 20 0 EIADRP C[C@@H](c1ncc(-c2ccccc2)o1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000158057611 1026207877 /nfs/dbraw/zinc/20/78/77/1026207877.db2.gz JGKCGLLWVOUMNO-INIZCTEOSA-N 2 0 327.472 4.066 20 0 EIADRP Fc1cccc2c1CCC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167975191 1026217742 /nfs/dbraw/zinc/21/77/42/1026217742.db2.gz LGPDVTPZXAAVKM-IMOOIFFWSA-N 2 0 328.475 4.198 20 0 EIADRP Fc1ccc2c(c1)CCC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167975120 1026221265 /nfs/dbraw/zinc/22/12/65/1026221265.db2.gz HWAZKHWRQNKKDQ-QYYYHEGRSA-N 2 0 328.475 4.198 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C3CCC3)cc2)[C@@H](C)C1 ZINC000550138372 1026224378 /nfs/dbraw/zinc/22/43/78/1026224378.db2.gz DKRAVRWHUSBTAN-AVRDEDQJSA-N 2 0 344.543 4.181 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCCc3c(Cl)sc(Cl)c32)CC1 ZINC000344306329 1026236994 /nfs/dbraw/zinc/23/69/94/1026236994.db2.gz WHYZKULLOBYBJN-LBPRGKRZSA-N 2 0 331.312 4.284 20 0 EIADRP CCCn1c2ccccc2nc1C[NH+]1CCC(C[NH+](CC)CC)CC1 ZINC000506852616 1026267428 /nfs/dbraw/zinc/26/74/28/1026267428.db2.gz YCGKRDAAZHRZSM-UHFFFAOYSA-N 2 0 342.531 4.000 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)C[C@H](C)O1 ZINC000582281734 1026406512 /nfs/dbraw/zinc/40/65/12/1026406512.db2.gz ARHVBKQPPZOFOG-WGMWDUQUSA-N 2 0 330.516 4.108 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cccc3[nH]ccc32)C1 ZINC000512210342 1026471545 /nfs/dbraw/zinc/47/15/45/1026471545.db2.gz CRSIVWJQOHJUJC-QZTJIDSGSA-N 2 0 325.500 4.254 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cccc3[nH]ccc32)C1 ZINC000512210344 1026472643 /nfs/dbraw/zinc/47/26/43/1026472643.db2.gz CRSIVWJQOHJUJC-ROUUACIJSA-N 2 0 325.500 4.254 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cccc3cc[nH]c32)C1 ZINC000512214518 1026475949 /nfs/dbraw/zinc/47/59/49/1026475949.db2.gz WOIPRMWVYADPDZ-ZWKOTPCHSA-N 2 0 325.500 4.254 20 0 EIADRP CC(C)Oc1ccc2ccccc2c1C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000506877388 1026482405 /nfs/dbraw/zinc/48/24/05/1026482405.db2.gz VFMXVYHZRGWLEW-UHFFFAOYSA-N 2 0 340.511 4.401 20 0 EIADRP COc1ccc(-c2ccccc2)cc1C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000506880285 1026483455 /nfs/dbraw/zinc/48/34/55/1026483455.db2.gz HGJVIPXXISVXIZ-UHFFFAOYSA-N 2 0 338.495 4.136 20 0 EIADRP C[N@@H+]1C[C@@H](C[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)[C@H](c2ccccc2)C1 ZINC000647249291 1026495823 /nfs/dbraw/zinc/49/58/23/1026495823.db2.gz PRQVQXNUXQPPBY-MALNDZBISA-N 2 0 349.522 4.043 20 0 EIADRP CC(C)n1cc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)cn1 ZINC000112383556 1026665037 /nfs/dbraw/zinc/66/50/37/1026665037.db2.gz VRGVKPDSEUOAPW-SFHVURJKSA-N 2 0 340.515 4.301 20 0 EIADRP Fc1ccc(C[N@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)cc1 ZINC000432666729 1026699327 /nfs/dbraw/zinc/69/93/27/1026699327.db2.gz FOYNEZMQYYHLQA-GOSISDBHSA-N 2 0 330.472 4.032 20 0 EIADRP Fc1ccc(C[N@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)cc1F ZINC000432671161 1026713462 /nfs/dbraw/zinc/71/34/62/1026713462.db2.gz PQQIMJPZIOOJHG-GOSISDBHSA-N 2 0 348.462 4.171 20 0 EIADRP C[C@H](NC1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512333833 1026725297 /nfs/dbraw/zinc/72/52/97/1026725297.db2.gz XOSKDQZJOVRKRN-RBUKOAKNSA-N 2 0 347.591 4.026 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1)c1cncs1 ZINC000159013286 1026730543 /nfs/dbraw/zinc/73/05/43/1026730543.db2.gz PSIDJEGWTZRNMK-ULQDDVLXSA-N 2 0 343.540 4.472 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2cscc2C(F)(F)F)CC1 ZINC000582517927 1026745222 /nfs/dbraw/zinc/74/52/22/1026745222.db2.gz BZFQHVURCKPZCW-UHFFFAOYSA-N 2 0 334.451 4.321 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccccn1 ZINC000159053546 1026745527 /nfs/dbraw/zinc/74/55/27/1026745527.db2.gz VVRJBFBJFZSCPO-MRXNPFEDSA-N 2 0 343.902 4.298 20 0 EIADRP Cc1ccc2cc(C[NH2+]C[C@@H]3CC[N@H+](Cc4ccccc4)C3)[nH]c2c1 ZINC000657452858 1026769668 /nfs/dbraw/zinc/76/96/68/1026769668.db2.gz LPDQIEBPXQPAID-IBGZPJMESA-N 2 0 333.479 4.088 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+]C(c2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000507449364 1026797172 /nfs/dbraw/zinc/79/71/72/1026797172.db2.gz NFJNZEHFQSTQLV-UHFFFAOYSA-N 2 0 344.449 4.376 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)c2ccccc12 ZINC000507445089 1026798063 /nfs/dbraw/zinc/79/80/63/1026798063.db2.gz BAYYOCLSXLBIEZ-MRXNPFEDSA-N 2 0 326.484 4.231 20 0 EIADRP CCc1ccc(C[NH+]2CCC(c3ncc4n3CCCC4)CC2)s1 ZINC000582584284 1026833049 /nfs/dbraw/zinc/83/30/49/1026833049.db2.gz RZMIOGGIFKMXKX-UHFFFAOYSA-N 2 0 329.513 4.223 20 0 EIADRP C[C@@H](Cc1ccsc1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000582586269 1026834098 /nfs/dbraw/zinc/83/40/98/1026834098.db2.gz LHWAMJVGWAAZDD-LRGNLBRXSA-N 2 0 340.536 4.464 20 0 EIADRP C[C@@H](CC1CCCC1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000519651124 1026940321 /nfs/dbraw/zinc/94/03/21/1026940321.db2.gz DIHWLNVPMGGXMW-KRWDZBQOSA-N 2 0 330.516 4.218 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC000474483092 1027120751 /nfs/dbraw/zinc/12/07/51/1027120751.db2.gz SBSIELAPTJGYQV-SJORKVTESA-N 2 0 345.556 4.500 20 0 EIADRP C[C@H]([NH2+]CCC[NH+]1CCC(C)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000474483091 1027121205 /nfs/dbraw/zinc/12/12/05/1027121205.db2.gz SBSIELAPTJGYQV-IRXDYDNUSA-N 2 0 345.556 4.500 20 0 EIADRP C[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C)c1ccc(C(F)(F)F)cc1 ZINC000188148761 1027164262 /nfs/dbraw/zinc/16/42/62/1027164262.db2.gz SEHWPXBTUMHCPE-VMUDFCTBSA-N 2 0 328.422 4.127 20 0 EIADRP C[C@H](C[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)C[NH+]1CCCC1 ZINC000474600109 1027287419 /nfs/dbraw/zinc/28/74/19/1027287419.db2.gz UIQPZCKZDSNJLO-APIJFGDWSA-N 2 0 326.937 4.215 20 0 EIADRP c1cc(C[NH+]2CCC(C[NH2+]C3CCC(C4CCC4)CC3)CC2)ccn1 ZINC000657613839 1027305810 /nfs/dbraw/zinc/30/58/10/1027305810.db2.gz SOFKYLZHTRJWNL-UHFFFAOYSA-N 2 0 341.543 4.242 20 0 EIADRP Cc1cc(N[C@H]2CC[N@H+](Cc3ccc(C(F)(F)F)cc3)C2)cc[nH+]1 ZINC000302570441 1027336380 /nfs/dbraw/zinc/33/63/80/1027336380.db2.gz PHNBPSQXZSXLTL-KRWDZBQOSA-N 2 0 335.373 4.095 20 0 EIADRP CC1([NH+]2CCCC2)CCC([NH2+]Cc2cc3c(ccnc3Cl)o2)CC1 ZINC000896387291 1027448521 /nfs/dbraw/zinc/44/85/21/1027448521.db2.gz AWFVCCPCJDYKHJ-UHFFFAOYSA-N 2 0 347.890 4.368 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)c1ccc(OC(F)F)cc1)C[NH+]1CCCCC1 ZINC000320904061 1027544692 /nfs/dbraw/zinc/54/46/92/1027544692.db2.gz CLRMOYYJAYHBIG-CABCVRRESA-N 2 0 326.431 4.061 20 0 EIADRP COc1ccc(C2CCC([NH2+]C3CC([NH+]4CCCCC4)C3)CC2)cc1 ZINC000475556159 1027599138 /nfs/dbraw/zinc/59/91/38/1027599138.db2.gz OUCGJIFRIDTVQS-UHFFFAOYSA-N 2 0 342.527 4.328 20 0 EIADRP C[C@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000154106898 1027729453 /nfs/dbraw/zinc/72/94/53/1027729453.db2.gz JRGNRMXETCOHGW-KBPBESRZSA-N 2 0 344.421 4.009 20 0 EIADRP COc1ccc([C@H](C)[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167995135 1027739862 /nfs/dbraw/zinc/73/98/62/1027739862.db2.gz XJSCPQUYZLSESJ-LATSOQNDSA-N 2 0 328.500 4.093 20 0 EIADRP C[C@H](C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000249124405 1027790688 /nfs/dbraw/zinc/79/06/88/1027790688.db2.gz UNCDKBBRJUTRME-COXVUDFISA-N 2 0 326.406 4.025 20 0 EIADRP Fc1ccccc1[C@H]1CC[N@@H+](C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)C1 ZINC001167995639 1027792425 /nfs/dbraw/zinc/79/24/25/1027792425.db2.gz MCOPMQVTBIFADW-HTUJPFKRSA-N 2 0 328.475 4.020 20 0 EIADRP CC(F)(F)CCC[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001167648722 1027851578 /nfs/dbraw/zinc/85/15/78/1027851578.db2.gz XLXFZCVLFLCJPK-RTBURBONSA-N 2 0 336.470 4.408 20 0 EIADRP Cc1nccn1-c1ccc(C[NH2+][C@H]2CCc3c2cccc3C)cc1F ZINC000153692800 1027872823 /nfs/dbraw/zinc/87/28/23/1027872823.db2.gz MUUBPXHVNIWXAB-FQEVSTJZSA-N 2 0 335.426 4.405 20 0 EIADRP C[C@@H]1CC([N@H+]2C[C@H]3[C@H](CC3(F)F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168044900 1027888385 /nfs/dbraw/zinc/88/83/85/1027888385.db2.gz HLNMXZKLZJFLDL-LFEHRJTNSA-N 2 0 334.454 4.015 20 0 EIADRP FC(F)(F)c1cccc([C@H]2C[C@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)c1 ZINC000280803822 1027894158 /nfs/dbraw/zinc/89/41/58/1027894158.db2.gz LBRWSLUVFNRDMD-LEUOFYLZSA-N 2 0 338.417 4.168 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168045844 1027965025 /nfs/dbraw/zinc/96/50/25/1027965025.db2.gz LGSLDZACRGQSPI-IRCVMFFPSA-N 2 0 348.481 4.405 20 0 EIADRP Cn1cc(CC[NH2+]C2CC[NH+](C(C)(C)C)CC2)c2ccc(Cl)cc21 ZINC000188558620 1027979750 /nfs/dbraw/zinc/97/97/50/1027979750.db2.gz SLBARQREZDNVMG-UHFFFAOYSA-N 2 0 347.934 4.227 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000520460117 1028044645 /nfs/dbraw/zinc/04/46/45/1028044645.db2.gz XUCYOUUHUYTUOZ-CBBWQLFWSA-N 2 0 326.937 4.213 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](Cc1ccco1)C1CCCC1 ZINC000346158408 1028289483 /nfs/dbraw/zinc/28/94/83/1028289483.db2.gz BPGBVVUZILURNG-UHFFFAOYSA-N 2 0 336.439 4.114 20 0 EIADRP CCC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)Cc1ccc(F)cc1 ZINC000346189716 1028296717 /nfs/dbraw/zinc/29/67/17/1028296717.db2.gz ZBWTUPSAZDUOCN-UHFFFAOYSA-N 2 0 338.430 4.127 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@]3(C2)CCCCO3)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168048484 1028301093 /nfs/dbraw/zinc/30/10/93/1028301093.db2.gz VXDAOMLZXPHMNN-MXNKGDRCSA-N 2 0 342.527 4.073 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCCC[C@H]1Cc1ccccc1 ZINC000346174696 1028305270 /nfs/dbraw/zinc/30/52/70/1028305270.db2.gz MQOJYBRFZAWBAL-QFIPXVFZSA-N 2 0 346.478 4.173 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CCC1CC[NH+](C)CC1 ZINC000125381427 1028396715 /nfs/dbraw/zinc/39/67/15/1028396715.db2.gz NJQBDWSPFYNULO-CABCVRRESA-N 2 0 331.529 4.110 20 0 EIADRP C[NH+](C)CC1CC[NH+](CCSc2cc(Cl)ccc2Cl)CC1 ZINC000524112387 1028667741 /nfs/dbraw/zinc/66/77/41/1028667741.db2.gz XSXUACOQIUPLAS-UHFFFAOYSA-N 2 0 347.355 4.359 20 0 EIADRP C[NH+]1CCC(C[NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)CC1 ZINC000443981192 1028682932 /nfs/dbraw/zinc/68/29/32/1028682932.db2.gz SKYMIDCZXINBCC-UHFFFAOYSA-N 2 0 328.431 4.049 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000650713037 1028862472 /nfs/dbraw/zinc/86/24/72/1028862472.db2.gz CEAHRGYAPRYJKS-HOTGVXAUSA-N 2 0 326.406 4.060 20 0 EIADRP C[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc(OC(F)F)cc1 ZINC000522973583 1029139876 /nfs/dbraw/zinc/13/98/76/1029139876.db2.gz BRQKXHXEUKHIBU-BBRMVZONSA-N 2 0 328.447 4.305 20 0 EIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)CCCO2 ZINC000650755026 1029185400 /nfs/dbraw/zinc/18/54/00/1029185400.db2.gz WZWDESSYMMUYIX-HXUWFJFHSA-N 2 0 342.458 4.411 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1cccc(OC(F)(F)F)c1 ZINC000650758654 1029215181 /nfs/dbraw/zinc/21/51/81/1029215181.db2.gz UYIQNVRYUWZZJF-CYBMUJFWSA-N 2 0 338.373 4.155 20 0 EIADRP Cc1nc(F)ccc1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000278441986 1029230594 /nfs/dbraw/zinc/23/05/94/1029230594.db2.gz UTDHKWXRNOPOOX-MRXNPFEDSA-N 2 0 341.474 4.193 20 0 EIADRP C[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000650763501 1029274708 /nfs/dbraw/zinc/27/47/08/1029274708.db2.gz BZTGIUMODCYJLJ-CYBMUJFWSA-N 2 0 346.462 4.381 20 0 EIADRP CC(C)CCOc1ccc(C[N@@H+]2CCCC23CC[NH+](C)CC3)cc1 ZINC000475126178 1029280688 /nfs/dbraw/zinc/28/06/88/1029280688.db2.gz AYOHPSMPGBRSSM-UHFFFAOYSA-N 2 0 330.516 4.172 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(Cl)c(N)c(Cl)c1 ZINC000278468795 1029293875 /nfs/dbraw/zinc/29/38/75/1029293875.db2.gz NLSPASUCDHZKAA-NSHDSACASA-N 2 0 342.314 4.101 20 0 EIADRP CCCN(CCC[NH+](C)C)C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168056817 1029311325 /nfs/dbraw/zinc/31/13/25/1029311325.db2.gz ITDSZQIWIRWWHC-PMACEKPBSA-N 2 0 345.575 4.092 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc(-n2ccnc2)cc1 ZINC000158191521 1029389452 /nfs/dbraw/zinc/38/94/52/1029389452.db2.gz KKFYVVSBUCAJKF-LJQANCHMSA-N 2 0 340.515 4.035 20 0 EIADRP Clc1ccc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)c2ncccc12 ZINC000657813614 1029457286 /nfs/dbraw/zinc/45/72/86/1029457286.db2.gz UILYJWBVFDWATF-UHFFFAOYSA-N 2 0 343.902 4.100 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC000475281266 1029497213 /nfs/dbraw/zinc/49/72/13/1029497213.db2.gz PWKAYWQMCYOSJW-SJLPKXTDSA-N 2 0 336.470 4.312 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c[nH+]cn2c1)C1CCC(C(F)(F)F)CC1 ZINC000459656247 1029508340 /nfs/dbraw/zinc/50/83/40/1029508340.db2.gz GIIYHVJUTFMDHR-LRVUVFPRSA-N 2 0 325.378 4.181 20 0 EIADRP CC(C)[C@H](COCc1ccccc1)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000446756403 1029562671 /nfs/dbraw/zinc/56/26/71/1029562671.db2.gz HZAKQOQWTSKGJO-QFIPXVFZSA-N 2 0 340.511 4.079 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H](c2ccc(C)cc2)C2CCCC2)CC1 ZINC000446822071 1029588974 /nfs/dbraw/zinc/58/89/74/1029588974.db2.gz USDUXDNRBBXGGX-QFIPXVFZSA-N 2 0 344.543 4.317 20 0 EIADRP CC(C)[N@@H+](Cc1ccccc1N(C)C1CC[NH+](C)CC1)CC1CCC1 ZINC000446923457 1029640453 /nfs/dbraw/zinc/64/04/53/1029640453.db2.gz VQRMQQULZCLXIU-UHFFFAOYSA-N 2 0 343.559 4.228 20 0 EIADRP Fc1ccc2c(NC[C@H](c3ccco3)[NH+]3CCCC3)cc[nH+]c2c1 ZINC000301240674 1029691652 /nfs/dbraw/zinc/69/16/52/1029691652.db2.gz FYQWADYWZKRXLM-GOSISDBHSA-N 2 0 325.387 4.216 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cc2ccncc2s1 ZINC000657837990 1029732529 /nfs/dbraw/zinc/73/25/29/1029732529.db2.gz LTXXPTONJRQIOW-HZPDHXFCSA-N 2 0 331.529 4.459 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1cc2cnccc2o1 ZINC000657839675 1029733475 /nfs/dbraw/zinc/73/34/75/1029733475.db2.gz YJQALDRHKRUTQW-IXDOHACOSA-N 2 0 329.488 4.237 20 0 EIADRP C[C@H]([NH2+][C@@H]1c2ccccc2C[C@H]1C)c1cccc(OCC[NH+](C)C)c1 ZINC000089613816 1029850939 /nfs/dbraw/zinc/85/09/39/1029850939.db2.gz LMCCYFPHDGVMMT-JLHGSKIFSA-N 2 0 338.495 4.211 20 0 EIADRP C[C@@H]([NH2+][C@H]1CCc2ccc(F)cc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000089552506 1029854770 /nfs/dbraw/zinc/85/47/70/1029854770.db2.gz BKFSJGVMIRCNBW-VFNWGFHPSA-N 2 0 342.458 4.104 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCc2ccc(F)cc21)c1cccc(OCC[NH+](C)C)c1 ZINC000089552527 1029854812 /nfs/dbraw/zinc/85/48/12/1029854812.db2.gz YXQGNGKSKOBELW-YCRPNKLZSA-N 2 0 342.458 4.104 20 0 EIADRP C[C@H]([NH2+][C@H]1CCc2ccc(F)cc21)c1cccc(OCC[NH+](C)C)c1 ZINC000089552529 1029854982 /nfs/dbraw/zinc/85/49/82/1029854982.db2.gz YXQGNGKSKOBELW-BTYIYWSLSA-N 2 0 342.458 4.104 20 0 EIADRP CC(C)C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccccc1 ZINC000090522556 1029866884 /nfs/dbraw/zinc/86/68/84/1029866884.db2.gz JFXVAURZBMYVNH-BDTNDASRSA-N 2 0 344.543 4.131 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)C1 ZINC000090586602 1029867776 /nfs/dbraw/zinc/86/77/76/1029867776.db2.gz XSWBVFZLUNSTIJ-VWPQPMDRSA-N 2 0 344.543 4.112 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](c2cccnc2)C(C)C)c1 ZINC000091287806 1029883399 /nfs/dbraw/zinc/88/33/99/1029883399.db2.gz VPZVMLOQTJAYCD-NRFANRHFSA-N 2 0 325.500 4.410 20 0 EIADRP Cc1ccc(-c2ncc(C[N@@H+]3CCC[C@@H](c4ncc[nH]4)C3)s2)cc1 ZINC000092073921 1029899341 /nfs/dbraw/zinc/89/93/41/1029899341.db2.gz UZXRSIDLULWDBM-MRXNPFEDSA-N 2 0 338.480 4.221 20 0 EIADRP FC(F)Oc1ccc(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)cc1Cl ZINC000092073916 1029899848 /nfs/dbraw/zinc/89/98/48/1029899848.db2.gz NMLJQVHCWHLZHB-LBPRGKRZSA-N 2 0 341.789 4.044 20 0 EIADRP COc1cc(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)ccc1Cl ZINC000450728076 1029932773 /nfs/dbraw/zinc/93/27/73/1029932773.db2.gz NYJVSADYNSVNNL-ZBFHGGJFSA-N 2 0 336.907 4.091 20 0 EIADRP CC(C)[NH+]1CCC([N@H+](C)CCc2cc(Cl)cc(Cl)c2)CC1 ZINC000447345097 1030024351 /nfs/dbraw/zinc/02/43/51/1030024351.db2.gz IADUTGDUIORBST-UHFFFAOYSA-N 2 0 329.315 4.341 20 0 EIADRP Cc1ccc(C)c([C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)c1 ZINC000392266637 1030079661 /nfs/dbraw/zinc/07/96/61/1030079661.db2.gz OQQNUZCYDRYQMX-AUSIDOKSSA-N 2 0 334.507 4.467 20 0 EIADRP C[C@@H](CCc1ccco1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447522310 1030117758 /nfs/dbraw/zinc/11/77/58/1030117758.db2.gz QDISWBXQPROLSE-ZIBCJSCZSA-N 2 0 338.495 4.386 20 0 EIADRP COc1cccc([C@@H](C)[NH2+]CCC[NH2+][C@H](C)c2cccc(OC)c2)c1 ZINC000201024441 1030127271 /nfs/dbraw/zinc/12/72/71/1030127271.db2.gz SDRXFDAAZFCZBP-IAGOWNOFSA-N 2 0 342.483 4.095 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447574076 1030154571 /nfs/dbraw/zinc/15/45/71/1030154571.db2.gz UMGXUDXZUWEHMC-NRFANRHFSA-N 2 0 342.527 4.488 20 0 EIADRP FC1(F)CC[C@@H](C[N@@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC000450981559 1030158166 /nfs/dbraw/zinc/15/81/66/1030158166.db2.gz IYLQQWYUBYFUKN-MOPGFXCFSA-N 2 0 334.454 4.020 20 0 EIADRP Clc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CCS2 ZINC000447556755 1030165329 /nfs/dbraw/zinc/16/53/29/1030165329.db2.gz HNUPOQDPCTUGSC-KRWDZBQOSA-N 2 0 336.932 4.341 20 0 EIADRP Clc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CCS2 ZINC000447556756 1030165752 /nfs/dbraw/zinc/16/57/52/1030165752.db2.gz HNUPOQDPCTUGSC-QGZVFWFLSA-N 2 0 336.932 4.341 20 0 EIADRP FC(F)c1ccc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000525991160 1030180411 /nfs/dbraw/zinc/18/04/11/1030180411.db2.gz YQDRLQSJKGHQQQ-UHFFFAOYSA-N 2 0 331.410 4.025 20 0 EIADRP FC1(F)CCC[C@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000447578778 1030206249 /nfs/dbraw/zinc/20/62/49/1030206249.db2.gz HHPZPIHSPBNQDP-OKYOBFRVSA-N 2 0 334.454 4.350 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@H]2CCCCS2)C3)cc1 ZINC000447601366 1030223648 /nfs/dbraw/zinc/22/36/48/1030223648.db2.gz PKMPQMPGHGZDEZ-YSTOQKLRSA-N 2 0 330.541 4.057 20 0 EIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000685455210 1030338651 /nfs/dbraw/zinc/33/86/51/1030338651.db2.gz JCNOLGUBXHZBKJ-LSDHHAIUSA-N 2 0 328.422 4.129 20 0 EIADRP C[C@@H]([NH2+]CCc1cncn1C)c1ccc(-c2ccccc2F)s1 ZINC000530407357 1030377983 /nfs/dbraw/zinc/37/79/83/1030377983.db2.gz SJBSNLNYMMUZMF-CYBMUJFWSA-N 2 0 329.444 4.181 20 0 EIADRP C([C@H]1CCC2(CCCC2)O1)[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000530410445 1030380622 /nfs/dbraw/zinc/38/06/22/1030380622.db2.gz SOSOOMKJSPFJDI-WOJBJXKFSA-N 2 0 334.548 4.066 20 0 EIADRP CSCC1CCC([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000708573364 1030398287 /nfs/dbraw/zinc/39/82/87/1030398287.db2.gz IWENDDZNZUOBEN-PPXMBRMGSA-N 2 0 346.584 4.266 20 0 EIADRP C[C@H]([NH2+][C@H]1CCN(Cc2ccccn2)C[C@H]1C)c1csc(Cl)c1 ZINC000191293562 1030614322 /nfs/dbraw/zinc/61/43/22/1030614322.db2.gz LHOQCNUIDXFBKL-KEYYUXOJSA-N 2 0 349.931 4.358 20 0 EIADRP CC(C)CC[C@@H]1CCC[C@H]1[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658066589 1030812119 /nfs/dbraw/zinc/81/21/19/1030812119.db2.gz CCHCYMFHMSNLIH-PZJWPPBQSA-N 2 0 336.564 4.072 20 0 EIADRP CC(C)CC[C@@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658066588 1030812770 /nfs/dbraw/zinc/81/27/70/1030812770.db2.gz CCHCYMFHMSNLIH-FPOVZHCZSA-N 2 0 336.564 4.072 20 0 EIADRP Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658067901 1030813504 /nfs/dbraw/zinc/81/35/04/1030813504.db2.gz RJMRUUGYJIPIMG-UWJYYQICSA-N 2 0 342.527 4.024 20 0 EIADRP C[C@@H](CCCC(F)(F)F)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658164959 1030860125 /nfs/dbraw/zinc/86/01/25/1030860125.db2.gz GVYHIXSUFORPFT-HNNXBMFYSA-N 2 0 343.437 4.004 20 0 EIADRP Cc1cccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1C ZINC000658167402 1030863948 /nfs/dbraw/zinc/86/39/48/1030863948.db2.gz RVVGYRVZEPLCCK-LJQANCHMSA-N 2 0 337.511 4.261 20 0 EIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]CC(C1CCC1)C1CCC1 ZINC000527925280 1030920546 /nfs/dbraw/zinc/92/05/46/1030920546.db2.gz MDNBYPWATRRAJK-VGSWGCGISA-N 2 0 341.543 4.098 20 0 EIADRP C[C@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CC(C1CCC1)C1CCC1 ZINC000527925274 1030921681 /nfs/dbraw/zinc/92/16/81/1030921681.db2.gz MDNBYPWATRRAJK-HTAPYJJXSA-N 2 0 341.543 4.098 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2C(C)(C)C2(F)F)CC1 ZINC000658281057 1030935971 /nfs/dbraw/zinc/93/59/71/1030935971.db2.gz NJQMTKPCXKYHON-DAWZGUTISA-N 2 0 336.470 4.311 20 0 EIADRP CC1(C)[C@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1(F)F ZINC000658280751 1030936721 /nfs/dbraw/zinc/93/67/21/1030936721.db2.gz LCKZLVROWVDLOO-MHORFTMASA-N 2 0 334.454 4.063 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CC[C@H]2CCCOC2)ccc1OC ZINC000527930122 1030970093 /nfs/dbraw/zinc/97/00/93/1030970093.db2.gz PVHNLVVAKDDYHW-QZTJIDSGSA-N 2 0 348.531 4.004 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccncc1 ZINC000658319485 1030980403 /nfs/dbraw/zinc/98/04/03/1030980403.db2.gz CHDFHURGPJGCHJ-RXVVDRJESA-N 2 0 335.495 4.035 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cnc2ccsc2c1 ZINC000658354933 1031023676 /nfs/dbraw/zinc/02/36/76/1031023676.db2.gz GIOHRGBWKZJKFK-CQSZACIVSA-N 2 0 329.513 4.069 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1cccc(Br)n1 ZINC000924528617 1031036035 /nfs/dbraw/zinc/03/60/35/1031036035.db2.gz ONVNJQBHOXMDOW-KBPBESRZSA-N 2 0 342.325 4.005 20 0 EIADRP C[C@H](c1ccccc1)N1CCC([NH2+][C@@H]2CCc3cccnc3CC2)CC1 ZINC000421830398 1031036477 /nfs/dbraw/zinc/03/64/77/1031036477.db2.gz JUUDDVRAZPSZLW-WIYYLYMNSA-N 2 0 349.522 4.144 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)C1CCOCC1 ZINC000532454070 1031090248 /nfs/dbraw/zinc/09/02/48/1031090248.db2.gz LGTDYIHBCZLAKJ-JOCHJYFZSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@@H]1CSCCc2ccccc21 ZINC000532459798 1031101154 /nfs/dbraw/zinc/10/11/54/1031101154.db2.gz MGUXAHSFRAMYGF-YLJYHZDGSA-N 2 0 332.557 4.261 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(OCc3ccccc3)cc2)[C@H](C)C1 ZINC000532459608 1031111822 /nfs/dbraw/zinc/11/18/22/1031111822.db2.gz MDFXGJZBQIDVMJ-XMSQKQJNSA-N 2 0 338.495 4.086 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(OCc3ccccc3)cc2)[C@@H](C)C1 ZINC000532459605 1031112121 /nfs/dbraw/zinc/11/21/21/1031112121.db2.gz MDFXGJZBQIDVMJ-AVRDEDQJSA-N 2 0 338.495 4.086 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccccc1OCc1ccccc1 ZINC000532507297 1031230205 /nfs/dbraw/zinc/23/02/05/1031230205.db2.gz RGQQYFDMWJSTCR-AZUAARDMSA-N 2 0 338.495 4.258 20 0 EIADRP COc1cc(C[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc2ccccc21 ZINC000449065539 1031392575 /nfs/dbraw/zinc/39/25/75/1031392575.db2.gz ZTRNDUYUZCLKNY-UHFFFAOYSA-N 2 0 334.463 4.200 20 0 EIADRP C[C@@H](Cc1cccs1)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449078527 1031433102 /nfs/dbraw/zinc/43/31/02/1031433102.db2.gz YGZSEDMFURFVGN-ROUUACIJSA-N 2 0 342.552 4.364 20 0 EIADRP COc1ccc2c(c1)C[C@H]([NH2+]CCCCCCCCCCC[NH3+])C2 ZINC001168242960 1031436788 /nfs/dbraw/zinc/43/67/88/1031436788.db2.gz FRAHMRDKTXKUKL-HXUWFJFHSA-N 2 0 332.532 4.222 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCOC3(CCC3)C2)C1 ZINC000449082170 1031436928 /nfs/dbraw/zinc/43/69/28/1031436928.db2.gz LFFHJTMAZISQNL-WIYYLYMNSA-N 2 0 342.527 4.110 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCCOC2CCCC2)CC1 ZINC000449108149 1031447133 /nfs/dbraw/zinc/44/71/33/1031447133.db2.gz SHYXACNIBQFHLU-IBGZPJMESA-N 2 0 344.543 4.021 20 0 EIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+]C[C@@H]3CC=CCC3)CC2)cc1 ZINC000124300250 1031519435 /nfs/dbraw/zinc/51/94/35/1031519435.db2.gz WJQXPXYHXLXDGB-HXUWFJFHSA-N 2 0 342.527 4.004 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ncc(-c2ccccc2)n1C ZINC000453065782 1031530239 /nfs/dbraw/zinc/53/02/39/1031530239.db2.gz XTHVYVBKSVMXIM-MSOLQXFVSA-N 2 0 342.531 4.248 20 0 EIADRP C[C@H]1CC[C@@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c2sccc21 ZINC000453069631 1031535519 /nfs/dbraw/zinc/53/55/19/1031535519.db2.gz UCNYCIYMNYWZKH-HNAYVOBHSA-N 2 0 344.524 4.417 20 0 EIADRP CCOCCC1(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CC1 ZINC000449213894 1031540666 /nfs/dbraw/zinc/54/06/66/1031540666.db2.gz XQKFXMWXMLKLOJ-UHFFFAOYSA-N 2 0 338.580 4.462 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)c2sccc21 ZINC000453061643 1031552322 /nfs/dbraw/zinc/55/23/22/1031552322.db2.gz LEHIGAGFPFVRLD-BEFAXECRSA-N 2 0 344.524 4.417 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1cc(-c2ccccc2)nn1C ZINC000453213451 1031730817 /nfs/dbraw/zinc/73/08/17/1031730817.db2.gz AGVLRGZENDJWBW-SFHVURJKSA-N 2 0 340.515 4.004 20 0 EIADRP FC(F)C1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)CC1 ZINC000453228682 1031747480 /nfs/dbraw/zinc/74/74/80/1031747480.db2.gz UTBGRQFFYXVERG-RCCFBDPRSA-N 2 0 334.454 4.065 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C2CC2)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000188733751 1031763170 /nfs/dbraw/zinc/76/31/70/1031763170.db2.gz SBMNVBHJNMXTMC-QGZVFWFLSA-N 2 0 338.495 4.355 20 0 EIADRP C/C=C/COc1ccc(CC[C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000449560319 1031848101 /nfs/dbraw/zinc/84/81/01/1031848101.db2.gz JJJMNEODENUPIH-BLBKINPUSA-N 2 0 342.527 4.177 20 0 EIADRP CC[C@H]1CCC[C@H]1[NH2+]CC1CC[NH+](Cc2ccc(OC)cc2)CC1 ZINC000531950170 1031864193 /nfs/dbraw/zinc/86/41/93/1031864193.db2.gz CZBJDUFKVKEWEB-PZJWPPBQSA-N 2 0 330.516 4.076 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(F)c(Br)c1 ZINC000453408199 1031943898 /nfs/dbraw/zinc/94/38/98/1031943898.db2.gz SMWSMUIIWFMGFK-GFCCVEGCSA-N 2 0 343.284 4.113 20 0 EIADRP Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)c1 ZINC000453408960 1031943955 /nfs/dbraw/zinc/94/39/55/1031943955.db2.gz WDWORXQOQJFWLT-MSOLQXFVSA-N 2 0 326.484 4.347 20 0 EIADRP COc1ccc2cc([C@H](C)[NH2+]CCCC[N@H+](C)C3CC3)ccc2c1 ZINC000453443330 1031969554 /nfs/dbraw/zinc/96/95/54/1031969554.db2.gz YRUODZHKAHDMOQ-INIZCTEOSA-N 2 0 326.484 4.373 20 0 EIADRP Clc1ccc([C@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)C2CC2)cc1 ZINC000459369485 1031976222 /nfs/dbraw/zinc/97/62/22/1031976222.db2.gz OFAVIWQEQBGSTK-HXUWFJFHSA-N 2 0 341.886 4.445 20 0 EIADRP Cc1nc(CN2CCC(C[NH2+]C[C@H]3C(C)=CCC[C@@H]3C)CC2)oc1C ZINC000134186515 1031994879 /nfs/dbraw/zinc/99/48/79/1031994879.db2.gz RDOAYLQZCNPGCZ-JXFKEZNVSA-N 2 0 345.531 4.085 20 0 EIADRP Cc1cnc([C@@H](C)[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)o1 ZINC000433048674 1033725730 /nfs/dbraw/zinc/72/57/30/1033725730.db2.gz YCHJZLPQAAVRTO-GOSISDBHSA-N 2 0 339.483 4.032 20 0 EIADRP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC([C@@H]2CCC[NH2+]2)CC1 ZINC000261722899 1034080802 /nfs/dbraw/zinc/08/08/02/1034080802.db2.gz LYXUBZKTVBOUGR-GUYCJALGSA-N 2 0 326.406 4.230 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1nccc2ccccc21 ZINC000894158455 1034399551 /nfs/dbraw/zinc/39/95/51/1034399551.db2.gz QUBTURCVBGBRON-UHFFFAOYSA-N 2 0 333.479 4.366 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2)sc1Br ZINC000576465959 1034619195 /nfs/dbraw/zinc/61/91/95/1034619195.db2.gz PKKICDYUQDVISQ-LLVKDONJSA-N 2 0 339.302 4.129 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC000509921702 1034850461 /nfs/dbraw/zinc/85/04/61/1034850461.db2.gz BBCLHUXFOWCZPX-XWMMGPHDSA-N 2 0 344.543 4.481 20 0 EIADRP COc1ccsc1C[NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000513495371 1034987050 /nfs/dbraw/zinc/98/70/50/1034987050.db2.gz OWKUOZIHKDCVIU-SJLPKXTDSA-N 2 0 344.524 4.147 20 0 EIADRP COc1ccc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000513513011 1035007359 /nfs/dbraw/zinc/00/73/59/1035007359.db2.gz QZNFYGCYPMSIMR-RXVVDRJESA-N 2 0 338.495 4.086 20 0 EIADRP c1cncc([C@@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)C2CCC2)c1 ZINC000280295044 1035223982 /nfs/dbraw/zinc/22/39/82/1035223982.db2.gz NBSVAMHENMDHQJ-QFIPXVFZSA-N 2 0 335.495 4.308 20 0 EIADRP C[N@H+](CCSc1ccccc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501070073 1035368025 /nfs/dbraw/zinc/36/80/25/1035368025.db2.gz QWSRTQCWTLOMCP-UHFFFAOYSA-N 2 0 341.524 4.022 20 0 EIADRP C[N@H+](CC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCCc2ccccc21 ZINC000501077849 1035373547 /nfs/dbraw/zinc/37/35/47/1035373547.db2.gz PELMWVMJUJJIEK-QFIPXVFZSA-N 2 0 335.495 4.307 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+]C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000501423741 1035443157 /nfs/dbraw/zinc/44/31/57/1035443157.db2.gz OJDHFAZUHJSFJS-UVQBRAAOSA-N 2 0 340.433 4.430 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]CCC[NH+]1CCCC1 ZINC000501476050 1035453060 /nfs/dbraw/zinc/45/30/60/1035453060.db2.gz USKNBQXDSXDTGZ-FYWRMAATSA-N 2 0 326.406 4.184 20 0 EIADRP Cc1nc([C@@H](C)[NH+]2CCC([C@H](C)[NH3+])CC2)oc1-c1ccc(Cl)cc1 ZINC000420281962 1035497206 /nfs/dbraw/zinc/49/72/06/1035497206.db2.gz AUTLEKLMWYDFRQ-GXTWGEPZSA-N 2 0 347.890 4.424 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000420327451 1035532852 /nfs/dbraw/zinc/53/28/52/1035532852.db2.gz LDPLGFBKDPYTHZ-KBMXLJTQSA-N 2 0 326.406 4.088 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]C[C@@H]1CC[NH2+]C1 ZINC000420396460 1035567825 /nfs/dbraw/zinc/56/78/25/1035567825.db2.gz FHHSTOMFRSSHQP-DGCLKSJQSA-N 2 0 335.904 4.032 20 0 EIADRP C[C@H](c1ccc2ccccc2c1)[NH+]1CCC([C@@H]2OCCC[C@H]2[NH3+])CC1 ZINC000420374241 1035571879 /nfs/dbraw/zinc/57/18/79/1035571879.db2.gz HFQMHERVDBIPSN-HVETUWLQSA-N 2 0 338.495 4.119 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000501778733 1035588378 /nfs/dbraw/zinc/58/83/78/1035588378.db2.gz VPEJPXJINVKUGQ-UHFFFAOYSA-N 2 0 328.422 4.259 20 0 EIADRP c1ccc(CCC2CC[NH+](C3CC[NH+](CC4CC4)CC3)CC2)cc1 ZINC001168379653 1036138556 /nfs/dbraw/zinc/13/85/56/1036138556.db2.gz NCRIIYNQASUDBT-UHFFFAOYSA-N 2 0 326.528 4.206 20 0 EIADRP C[NH+](C)Cc1ccc(NC2CC[NH+](C3CCCCC3)CC2)c(F)c1 ZINC000414504925 1036171843 /nfs/dbraw/zinc/17/18/43/1036171843.db2.gz YWWLPWHPHVCMDE-UHFFFAOYSA-N 2 0 333.495 4.096 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000502432052 1036196816 /nfs/dbraw/zinc/19/68/16/1036196816.db2.gz CKJFUFNZIRTMAG-UGKGYDQZSA-N 2 0 344.543 4.213 20 0 EIADRP COc1ccccc1/C=C\C[NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000588177758 1036285592 /nfs/dbraw/zinc/28/55/92/1036285592.db2.gz FPBIHGYKSGUNJN-IMMRNYSZSA-N 2 0 330.516 4.056 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)cc1 ZINC000421376593 1036327293 /nfs/dbraw/zinc/32/72/93/1036327293.db2.gz RPAYSNPFMCXDCK-UHFFFAOYSA-N 2 0 338.495 4.325 20 0 EIADRP c1nc(C2CCCCC2)sc1C[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000572243020 1036470982 /nfs/dbraw/zinc/47/09/82/1036470982.db2.gz HHUBFJPLNPPRPW-IRXDYDNUSA-N 2 0 333.545 4.012 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502688542 1036484841 /nfs/dbraw/zinc/48/48/41/1036484841.db2.gz WYVSZTGKEQXXIC-OTWHNJEPSA-N 2 0 346.563 4.407 20 0 EIADRP CSC1(C[NH2+][C@@H]2C[C@H](C(C)C)c3ccccc32)CC[NH+](C)CC1 ZINC000589348094 1036758932 /nfs/dbraw/zinc/75/89/32/1036758932.db2.gz QNGZZNSJIIDBBD-RTBURBONSA-N 2 0 332.557 4.288 20 0 EIADRP CSC1(C[NH2+][C@H](c2cccs2)C2CCCC2)CC[NH+](C)CC1 ZINC000589349650 1036759598 /nfs/dbraw/zinc/75/95/98/1036759598.db2.gz RGOSPMUKDHEGAJ-KRWDZBQOSA-N 2 0 338.586 4.396 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccncc2Cl)c1 ZINC000421826865 1036785062 /nfs/dbraw/zinc/78/50/62/1036785062.db2.gz VBFGOHGIJQYWTR-HNNXBMFYSA-N 2 0 331.891 4.426 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1csc(-c2ccccc2)n1 ZINC000421867112 1036817030 /nfs/dbraw/zinc/81/70/30/1036817030.db2.gz AWGPZYPEHPDNNF-ODIFPOPNSA-N 2 0 329.513 4.334 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C2CCC([NH+](C)C)CC2)c2ccccc12 ZINC000421871994 1036840587 /nfs/dbraw/zinc/84/05/87/1036840587.db2.gz GKJBWJJRGFFOFS-KLAILNCOSA-N 2 0 326.484 4.372 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2[nH]nc3ccccc32)cc1 ZINC000589640197 1036855365 /nfs/dbraw/zinc/85/53/65/1036855365.db2.gz FXIFMWHWMVAOQQ-KRWDZBQOSA-N 2 0 348.494 4.227 20 0 EIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]C[C@H]2CCSC2)cc1 ZINC000486933944 1036896411 /nfs/dbraw/zinc/89/64/11/1036896411.db2.gz XPKSAGJLBHZSJT-GOSISDBHSA-N 2 0 340.536 4.258 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]C/C=C/c1ccncc1 ZINC000486944398 1036898957 /nfs/dbraw/zinc/89/89/57/1036898957.db2.gz PMNQBJUKCOWGFW-ZLQZBKBYSA-N 2 0 335.495 4.259 20 0 EIADRP CCOc1ccc(C[NH2+]Cc2ccccc2C[NH+](CC)CC)cc1F ZINC000486947166 1036898976 /nfs/dbraw/zinc/89/89/76/1036898976.db2.gz UERJDMFHOPDLJF-UHFFFAOYSA-N 2 0 344.474 4.356 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C/C=C/c2ccncc2)cc1 ZINC000486965475 1036904872 /nfs/dbraw/zinc/90/48/72/1036904872.db2.gz JGTXQNGCAIFUJG-OQBYNLHGSA-N 2 0 335.495 4.259 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C/C=C\c2ccncc2)cc1 ZINC000486965472 1036906050 /nfs/dbraw/zinc/90/60/50/1036906050.db2.gz JGTXQNGCAIFUJG-GJEJWFRCSA-N 2 0 335.495 4.259 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2cccc3[nH]ccc32)CC1 ZINC000503121267 1036917676 /nfs/dbraw/zinc/91/76/76/1036917676.db2.gz NTWFWTFDXFEFGK-VGOFRKELSA-N 2 0 339.527 4.343 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1sccc1Br ZINC000572950949 1037095199 /nfs/dbraw/zinc/09/51/99/1037095199.db2.gz HOQOEAKWXANOSE-VOMCLLRMSA-N 2 0 331.323 4.034 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(Cl)nc1 ZINC000272265921 1037149254 /nfs/dbraw/zinc/14/92/54/1037149254.db2.gz AKVPTBQQKHUFBX-TXPKVOOTSA-N 2 0 343.902 4.296 20 0 EIADRP Cc1ccc(OCCC[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)cc1C ZINC000590786218 1037167028 /nfs/dbraw/zinc/16/70/28/1037167028.db2.gz IPEHDEPUUONODP-UHFFFAOYSA-N 2 0 332.532 4.125 20 0 EIADRP Cc1nc(C)c(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)s1 ZINC000272419342 1037184579 /nfs/dbraw/zinc/18/45/79/1037184579.db2.gz NATYPDVVJZRJFA-REPLKXPHSA-N 2 0 341.524 4.045 20 0 EIADRP CC1CC[NH+](Cc2ccc(CNC(=[NH2+])Nc3ccccc3)cc2)CC1 ZINC000057887492 1037290539 /nfs/dbraw/zinc/29/05/39/1037290539.db2.gz CXQCBBAYJDVPEQ-UHFFFAOYSA-N 2 0 336.483 4.055 20 0 EIADRP C[C@@H]([NH2+]CCCCCC[NH2+][C@@H](C)c1ccccn1)c1ccccn1 ZINC000272805852 1037300204 /nfs/dbraw/zinc/30/02/04/1037300204.db2.gz FSTMHKPPVDQEPB-HDICACEKSA-N 2 0 326.488 4.038 20 0 EIADRP Cc1cnc([C@H](C)C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)s1 ZINC000273508584 1037486458 /nfs/dbraw/zinc/48/64/58/1037486458.db2.gz ZZDNCGACKAIKLA-MDZRGWNJSA-N 2 0 343.540 4.055 20 0 EIADRP CC1CC[NH+](Cc2cccc(C[NH2+]Cc3[nH]nc4ccccc43)c2)CC1 ZINC000591712863 1037543430 /nfs/dbraw/zinc/54/34/30/1037543430.db2.gz XQNGTJYGTKIVEP-UHFFFAOYSA-N 2 0 348.494 4.085 20 0 EIADRP CC(C)[C@H]1C[C@H]([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CS1 ZINC000488414667 1037580637 /nfs/dbraw/zinc/58/06/37/1037580637.db2.gz HIDZUXGLTYWYRB-VQTJNVASSA-N 2 0 332.557 4.018 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccccc1OC1CCCC1 ZINC000422693566 1037806715 /nfs/dbraw/zinc/80/67/15/1037806715.db2.gz MHQJNHHBTINMFF-OAHLLOKOSA-N 2 0 339.483 4.021 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1Cl ZINC000422689320 1037807278 /nfs/dbraw/zinc/80/72/78/1037807278.db2.gz FENXJWULJPDBFY-ADLFWFRXSA-N 2 0 342.870 4.247 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@@H](C)C[C@@H](C)[NH3+])ccc1OCc1ccccc1 ZINC000422717331 1037813423 /nfs/dbraw/zinc/81/34/23/1037813423.db2.gz KQLDEQYVZVUOHS-IKGGRYGDSA-N 2 0 342.483 4.051 20 0 EIADRP CCc1ccc([C@@H]([NH2+][C@H](C)c2ccc(C[NH3+])nc2C)C(C)C)cc1 ZINC000422759205 1037817676 /nfs/dbraw/zinc/81/76/76/1037817676.db2.gz FPXNKDCIYIGWQN-IERDGZPVSA-N 2 0 325.500 4.459 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(Cl)cc1 ZINC000422745358 1037823779 /nfs/dbraw/zinc/82/37/79/1037823779.db2.gz MDZNLDSIVONFDC-QMIHWGKISA-N 2 0 342.870 4.247 20 0 EIADRP Cc1cccc([C@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1C ZINC000422747211 1037824565 /nfs/dbraw/zinc/82/45/65/1037824565.db2.gz PMTVXJZNPUUBNG-RBDMOPTHSA-N 2 0 336.479 4.210 20 0 EIADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CCCCSc1ccccc1Br ZINC000422750230 1037825191 /nfs/dbraw/zinc/82/51/91/1037825191.db2.gz CLQMNMQXPMHHBC-STQMWFEESA-N 2 0 345.350 4.037 20 0 EIADRP CCCOc1ccc([C@@H](C)[NH2+][C@@H]2CCC[NH2+]CC2)cc1OCCC ZINC000422766505 1037827347 /nfs/dbraw/zinc/82/73/47/1037827347.db2.gz QDXPOICHKFEDPS-SJLPKXTDSA-N 2 0 334.504 4.057 20 0 EIADRP [NH3+]CC1CCC([NH2+][C@@H](COCc2ccccc2)c2ccccc2)CC1 ZINC000422777459 1037830289 /nfs/dbraw/zinc/83/02/89/1037830289.db2.gz GAJZASHZKRVYHI-UDJZJCJKSA-N 2 0 338.495 4.052 20 0 EIADRP COc1ccccc1[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1ccccc1Cl ZINC000422778033 1037830661 /nfs/dbraw/zinc/83/06/61/1037830661.db2.gz GWVQZBJYDDAKDO-LIRRHRJNSA-N 2 0 332.875 4.155 20 0 EIADRP c1cc(-c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)cc2)ccn1 ZINC000422774372 1037831207 /nfs/dbraw/zinc/83/12/07/1037831207.db2.gz WTDWXIWTGZPSAA-BHDDXSALSA-N 2 0 335.495 4.149 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000422764187 1037834548 /nfs/dbraw/zinc/83/45/48/1037834548.db2.gz UUXQOXLWFMQHJN-KRWDZBQOSA-N 2 0 345.490 4.331 20 0 EIADRP CCC(CC)(C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C)c1ccccc1 ZINC000422797467 1037836075 /nfs/dbraw/zinc/83/60/75/1037836075.db2.gz MQAHSVQSAWJGIZ-MRXNPFEDSA-N 2 0 325.500 4.257 20 0 EIADRP COc1ccc([C@H](C)CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000422791206 1037839522 /nfs/dbraw/zinc/83/95/22/1037839522.db2.gz YIAXPBMXMQFHRH-MBPVOVBZSA-N 2 0 330.516 4.089 20 0 EIADRP FC(F)(F)[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000422820206 1037842090 /nfs/dbraw/zinc/84/20/90/1037842090.db2.gz PLLDBVLUUZSIPD-BPKGMFCQSA-N 2 0 332.454 4.256 20 0 EIADRP CC[C@H](C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)Oc1ccccc1Cl ZINC000422838309 1037843313 /nfs/dbraw/zinc/84/33/13/1037843313.db2.gz ODKPFABYASNVQU-XJKSGUPXSA-N 2 0 347.890 4.010 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCc1cccc(-c2ccccc2)c1 ZINC000422882154 1037851726 /nfs/dbraw/zinc/85/17/26/1037851726.db2.gz AIEACCXUAHPHTI-QGZVFWFLSA-N 2 0 345.490 4.409 20 0 EIADRP c1ccc(SC2(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)CC2)cc1 ZINC000422910676 1037865844 /nfs/dbraw/zinc/86/58/44/1037865844.db2.gz RGTGEYDEPNSMEX-IPMKNSEASA-N 2 0 330.541 4.212 20 0 EIADRP c1ccc2c(c1)C1C[C@H](C[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)C2c2ccccc21 ZINC000422939131 1037875821 /nfs/dbraw/zinc/87/58/21/1037875821.db2.gz HULRKNHKSUBHCE-JTQQOJGLSA-N 2 0 344.502 4.156 20 0 EIADRP CC1CC[NH+](Cc2ccccc2CN[C@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000422967256 1037883004 /nfs/dbraw/zinc/88/30/04/1037883004.db2.gz OTCKRCNGMFAORR-GOTSBHOMSA-N 2 0 349.522 4.153 20 0 EIADRP CC[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cccs1 ZINC000422949948 1037887873 /nfs/dbraw/zinc/88/78/73/1037887873.db2.gz VBLGWQYNYIYOFX-FCEWJHQRSA-N 2 0 328.481 4.045 20 0 EIADRP CC(C)[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(C(F)(F)F)cc1 ZINC000422995127 1037891186 /nfs/dbraw/zinc/89/11/86/1037891186.db2.gz JLDWZMBHFUTJCY-FCLJQHQZSA-N 2 0 326.406 4.275 20 0 EIADRP C[C@H]1Cc2cc(-c3ccc(C[NH2+]C4C[C@H]5CC[C@@H](C4)[NH2+]5)cc3)ccc2O1 ZINC000423012748 1037899568 /nfs/dbraw/zinc/89/95/68/1037899568.db2.gz LHMNXEGMMFDXON-VZZYARLZSA-N 2 0 348.490 4.050 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]CCc1csc(-c2ccc(Cl)cc2)n1 ZINC000423008379 1037899618 /nfs/dbraw/zinc/89/96/18/1037899618.db2.gz ABJLOMOBCSAQEC-CYBMUJFWSA-N 2 0 337.920 4.113 20 0 EIADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]CCc1csc(-c2ccc(Cl)cc2)n1 ZINC000423017590 1037901697 /nfs/dbraw/zinc/90/16/97/1037901697.db2.gz WSUGXIOHQFMPCH-IAGOWNOFSA-N 2 0 349.931 4.256 20 0 EIADRP FC(F)(F)c1ccccc1[C@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423023319 1037906608 /nfs/dbraw/zinc/90/66/08/1037906608.db2.gz JMLQYNVXSFFPOS-CCGHFKHRSA-N 2 0 338.417 4.214 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000423027919 1037909688 /nfs/dbraw/zinc/90/96/88/1037909688.db2.gz RWASDEKHCUODHC-KXBFYZLASA-N 2 0 331.891 4.126 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000423027917 1037910896 /nfs/dbraw/zinc/91/08/96/1037910896.db2.gz RWASDEKHCUODHC-DNVCBOLYSA-N 2 0 331.891 4.126 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000423063695 1037928182 /nfs/dbraw/zinc/92/81/82/1037928182.db2.gz XGUHLNUAGUTHKL-BRWVUGGUSA-N 2 0 326.406 4.024 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000423063296 1037929674 /nfs/dbraw/zinc/92/96/74/1037929674.db2.gz OPBKZGOSZIAIAN-MFKMUULPSA-N 2 0 342.327 4.416 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000423057838 1037930589 /nfs/dbraw/zinc/93/05/89/1037930589.db2.gz AYOWQYPJSQOIPL-ZBEGNZNMSA-N 2 0 343.284 4.146 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1Cl ZINC000423069868 1037934646 /nfs/dbraw/zinc/93/46/46/1037934646.db2.gz FENXJWULJPDBFY-WNYOCNMUSA-N 2 0 342.870 4.247 20 0 EIADRP [NH3+][C@H]1C[C@@H]([NH2+]CC2(CCOCc3ccccc3)CC2)c2ccccc21 ZINC000423054524 1037940540 /nfs/dbraw/zinc/94/05/40/1037940540.db2.gz USCMEPFRRCXFHK-LEWJYISDSA-N 2 0 336.479 4.108 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@@H](Cc1ccccc1)C(C)C ZINC000423076753 1037942349 /nfs/dbraw/zinc/94/23/49/1037942349.db2.gz ZPWIFXYKNHDVQF-QFBILLFUSA-N 2 0 325.500 4.014 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1CCC(F)(F)CC1 ZINC000503864814 1037948848 /nfs/dbraw/zinc/94/88/48/1037948848.db2.gz WHCQLJBKTOXWRK-VQIMIIECSA-N 2 0 336.470 4.312 20 0 EIADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000423087597 1037950013 /nfs/dbraw/zinc/95/00/13/1037950013.db2.gz PYDOCJKNCVBRGD-MEGFKASBSA-N 2 0 326.459 4.010 20 0 EIADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000423096959 1037955181 /nfs/dbraw/zinc/95/51/81/1037955181.db2.gz QDTZSZYOXGDCBO-OTRWWLKZSA-N 2 0 326.406 4.059 20 0 EIADRP Fc1ccc(C2CC([NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)C2)cc1Cl ZINC000423099235 1037956196 /nfs/dbraw/zinc/95/61/96/1037956196.db2.gz LUFAADCATFSCJY-HLJPGJHGSA-N 2 0 336.882 4.235 20 0 EIADRP Fc1cc(F)cc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)C2)c1 ZINC000423098300 1037956665 /nfs/dbraw/zinc/95/66/65/1037956665.db2.gz SALGPRMYZOHUGD-SQWSIXGCSA-N 2 0 334.454 4.111 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCCCc1ccc(Cl)s1 ZINC000423100191 1037956868 /nfs/dbraw/zinc/95/68/68/1037956868.db2.gz GPGVPIKTWOBHQS-LBPRGKRZSA-N 2 0 337.920 4.237 20 0 EIADRP FC(F)(F)[C@H](CC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1)c1ccccc1 ZINC000423127239 1037974966 /nfs/dbraw/zinc/97/49/66/1037974966.db2.gz BRDAWSJFZUXFKW-TVFCKZIOSA-N 2 0 340.433 4.233 20 0 EIADRP C[C@@H]([NH2+]CC1CCC(F)(F)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000503906432 1038004681 /nfs/dbraw/zinc/00/46/81/1038004681.db2.gz ZKOOACSSMHPGAJ-VQIMIIECSA-N 2 0 336.470 4.312 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423132907 1038011063 /nfs/dbraw/zinc/01/10/63/1038011063.db2.gz PSHKXABLJGFXBU-XPNTWCBSSA-N 2 0 348.490 4.218 20 0 EIADRP C[C@@]1(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C[C@H]1c1ccccc1 ZINC000423140658 1038013409 /nfs/dbraw/zinc/01/34/09/1038013409.db2.gz ZAXCJVBHTYSIHL-BAMDZGJYSA-N 2 0 348.490 4.026 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCCC[C@H]2OC(F)F)CC1 ZINC000503950151 1038042444 /nfs/dbraw/zinc/04/24/44/1038042444.db2.gz BIMNTVCRROYLHN-VDHUWJSZSA-N 2 0 344.490 4.170 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc2ccccc2c1OC(F)F ZINC000423218177 1038063596 /nfs/dbraw/zinc/06/35/96/1038063596.db2.gz VHGJKGMAGBFVBQ-KGLIPLIRSA-N 2 0 334.410 4.091 20 0 EIADRP Fc1ccc(C([NH2+]CC[C@H]2CCC[NH2+]C2)c2ccc(F)cc2)cc1 ZINC000423260992 1038071682 /nfs/dbraw/zinc/07/16/82/1038071682.db2.gz RCXUBRGSMZMHGK-OAHLLOKOSA-N 2 0 330.422 4.034 20 0 EIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423282386 1038088426 /nfs/dbraw/zinc/08/84/26/1038088426.db2.gz WMDHTQXCOISYEY-HOCLYGCPSA-N 2 0 328.422 4.006 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@H]1CCCC[C@H]1C[NH3+] ZINC000423283851 1038092429 /nfs/dbraw/zinc/09/24/29/1038092429.db2.gz WKSUOUXPACOURO-WBAXXEDZSA-N 2 0 343.540 4.210 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCc3ccc(Br)cc32)cc1 ZINC000423294178 1038122405 /nfs/dbraw/zinc/12/24/05/1038122405.db2.gz TXPDVMMRUVWUKO-KPZWWZAWSA-N 2 0 345.284 4.246 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCCOc3c(Cl)cccc32)cc1 ZINC000423293959 1038123077 /nfs/dbraw/zinc/12/30/77/1038123077.db2.gz SPKNJKCPDDHNKB-SCLBCKFNSA-N 2 0 330.859 4.363 20 0 EIADRP Cc1ccsc1[C@H]([NH2+]CCCC[NH3+])c1ccc(Cl)cc1F ZINC000423327448 1038139438 /nfs/dbraw/zinc/13/94/38/1038139438.db2.gz NDVAKCBMLABWTO-OAHLLOKOSA-N 2 0 326.868 4.267 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423327557 1038142459 /nfs/dbraw/zinc/14/24/59/1038142459.db2.gz LKHAEOBCMTYFJT-BFUOFWGJSA-N 2 0 347.503 4.298 20 0 EIADRP CCOc1ccc([C@H]([NH2+]CCCC[NH3+])c2ccccc2Cl)cc1 ZINC000423331328 1038144718 /nfs/dbraw/zinc/14/47/18/1038144718.db2.gz PXFJPROMFOICMO-IBGZPJMESA-N 2 0 332.875 4.157 20 0 EIADRP COc1ccccc1[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)C1CCCC1 ZINC000423373570 1038153410 /nfs/dbraw/zinc/15/34/10/1038153410.db2.gz HRFYEBNQLPZAQV-QFIPXVFZSA-N 2 0 336.479 4.320 20 0 EIADRP Fc1ccccc1-c1nc2c(s1)[C@H]([NH2+]CC[C@H]1CCC[NH2+]1)CCC2 ZINC000423358315 1038172138 /nfs/dbraw/zinc/17/21/38/1038172138.db2.gz JIUGKSGEZWARGV-CZUORRHYSA-N 2 0 345.487 4.058 20 0 EIADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@@H](Cc1ccccc1Cl)c1cccs1 ZINC000423362617 1038178005 /nfs/dbraw/zinc/17/80/05/1038178005.db2.gz BIWMMTFTMIXDKU-XYPHTWIQSA-N 2 0 334.916 4.273 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)C1 ZINC000423366075 1038183958 /nfs/dbraw/zinc/18/39/58/1038183958.db2.gz LFPLJONJPXSVOB-QZWWFDLISA-N 2 0 326.406 4.201 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)[C@H](C)c1nc2ccccc2s1 ZINC000423375957 1038190394 /nfs/dbraw/zinc/19/03/94/1038190394.db2.gz IZBIUUGIOWINMV-KBPBESRZSA-N 2 0 337.492 4.181 20 0 EIADRP COCC1(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)cc2)CC[NH2+]CC1 ZINC000423388698 1038199387 /nfs/dbraw/zinc/19/93/87/1038199387.db2.gz KWMGIMHAUXVPCI-SFHVURJKSA-N 2 0 338.495 4.020 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423396362 1038201190 /nfs/dbraw/zinc/20/11/90/1038201190.db2.gz NSSWVROZIWJJNO-QYWGDWMGSA-N 2 0 342.458 4.053 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)CC[NH2+]1 ZINC000423376770 1038206364 /nfs/dbraw/zinc/20/63/64/1038206364.db2.gz LDSICDYJOQAHAL-XJKCOSOUSA-N 2 0 345.487 4.057 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](c1ccc(Br)s1)C1CC1 ZINC000423425095 1038213307 /nfs/dbraw/zinc/21/33/07/1038213307.db2.gz GODIAHARTIIRBH-YGRLFVJLSA-N 2 0 331.323 4.069 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)[C@H](C)c1nc2ccccc2s1 ZINC000423417240 1038223451 /nfs/dbraw/zinc/22/34/51/1038223451.db2.gz FFEQNABUUIITAP-VGWMRTNUSA-N 2 0 331.529 4.143 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](c1ccc(Br)cc1F)C1CC1 ZINC000423447661 1038227920 /nfs/dbraw/zinc/22/79/20/1038227920.db2.gz ZWKPXWXFQOHHDB-BZNIZROVSA-N 2 0 343.284 4.146 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000423431916 1038233794 /nfs/dbraw/zinc/23/37/94/1038233794.db2.gz MBVILGUOVOMXGI-UNEWFSDZSA-N 2 0 328.422 4.449 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+][C@@H](C)CCCC[NH3+] ZINC000423432583 1038233883 /nfs/dbraw/zinc/23/38/83/1038233883.db2.gz MLZIULCKWYWRIX-LSDHHAIUSA-N 2 0 331.529 4.210 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000423456917 1038239463 /nfs/dbraw/zinc/23/94/63/1038239463.db2.gz HNXHYODJLZNPCH-JLJPHGGASA-N 2 0 329.513 4.287 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1cccc(Br)c1 ZINC000423458981 1038240340 /nfs/dbraw/zinc/24/03/40/1038240340.db2.gz QTLSNIILDKDVMH-KSSFIOAISA-N 2 0 347.300 4.256 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1cccc(Br)c1 ZINC000423458980 1038241379 /nfs/dbraw/zinc/24/13/79/1038241379.db2.gz QTLSNIILDKDVMH-KDOFPFPSSA-N 2 0 347.300 4.256 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1ccc(SCC(F)F)cc1 ZINC000423460338 1038241396 /nfs/dbraw/zinc/24/13/96/1038241396.db2.gz ASMONBFCGCOFHJ-GUTXKFCHSA-N 2 0 328.472 4.212 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[C@H]([NH3+])C2)c2cccc(Br)c21 ZINC000423469710 1038244054 /nfs/dbraw/zinc/24/40/54/1038244054.db2.gz VPAQAOGINBUYOS-DVZHBHJUSA-N 2 0 337.305 4.105 20 0 EIADRP Clc1ccc([C@H](Cc2cccnc2)[NH2+]CCC[C@H]2CCC[NH2+]2)cc1 ZINC000423469153 1038244107 /nfs/dbraw/zinc/24/41/07/1038244107.db2.gz CKSLIMMYOBPEBR-UXHICEINSA-N 2 0 343.902 4.141 20 0 EIADRP Clc1ccc([C@@H](Cc2cccnc2)[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1 ZINC000423469154 1038244445 /nfs/dbraw/zinc/24/44/45/1038244445.db2.gz CKSLIMMYOBPEBR-VQTJNVASSA-N 2 0 343.902 4.141 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cs1 ZINC000423482451 1038251900 /nfs/dbraw/zinc/25/19/00/1038251900.db2.gz XSXJVGBZEOYDQW-DKSSEZFCSA-N 2 0 332.488 4.240 20 0 EIADRP Cc1cc(N)cc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)c1 ZINC000423480786 1038252613 /nfs/dbraw/zinc/25/26/13/1038252613.db2.gz PRHLTSJRNIXMSO-UHFFFAOYSA-N 2 0 337.511 4.110 20 0 EIADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1csc(-c2ccccc2F)n1 ZINC000423484313 1038259115 /nfs/dbraw/zinc/25/91/15/1038259115.db2.gz QQUFETQSNUWWRW-ZIAGYGMSSA-N 2 0 333.476 4.132 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423495234 1038263459 /nfs/dbraw/zinc/26/34/59/1038263459.db2.gz UDXAKRRLLCATNQ-RIFZZMRRSA-N 2 0 342.458 4.183 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H](Cc2ccccc2Cl)c2cccs2)C1 ZINC000423512211 1038270246 /nfs/dbraw/zinc/27/02/46/1038270246.db2.gz QSOCQEBIQYRCOA-UKPHBRMFSA-N 2 0 334.916 4.402 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H](c2cccc(F)c2)c2cccc(Cl)c2)C1 ZINC000423517978 1038276029 /nfs/dbraw/zinc/27/60/29/1038276029.db2.gz UVBVTYVXQAMWRD-UPRAQXHNSA-N 2 0 332.850 4.286 20 0 EIADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000423545577 1038288385 /nfs/dbraw/zinc/28/83/85/1038288385.db2.gz XZQQIMIGGBBYNX-CYBMUJFWSA-N 2 0 344.446 4.301 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423543675 1038290358 /nfs/dbraw/zinc/29/03/58/1038290358.db2.gz VGZDIPVEOSEZSO-OAHLLOKOSA-N 2 0 341.524 4.003 20 0 EIADRP Cc1cccc([C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)c2cccc(F)c2)c1 ZINC000423548838 1038291874 /nfs/dbraw/zinc/29/18/74/1038291874.db2.gz MYNQAIGNCXJWNG-CZAYHTPWSA-N 2 0 338.470 4.201 20 0 EIADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(OCc2ccccc2)cc1 ZINC000423564718 1038294924 /nfs/dbraw/zinc/29/49/24/1038294924.db2.gz SBLYUBZRZOTSQE-SFHVURJKSA-N 2 0 336.479 4.226 20 0 EIADRP CC[N@@H+]1CC[C@@H](CN[C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000490168567 1038366957 /nfs/dbraw/zinc/36/69/57/1038366957.db2.gz XJWDOVWJSQMGBJ-YWZLYKJASA-N 2 0 346.877 4.500 20 0 EIADRP C[C@@H](c1ccccc1Br)[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000490296179 1038453694 /nfs/dbraw/zinc/45/36/94/1038453694.db2.gz DAIDTGWHCNMIOH-STQMWFEESA-N 2 0 334.261 4.113 20 0 EIADRP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+][C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC000608064841 1038470483 /nfs/dbraw/zinc/47/04/83/1038470483.db2.gz WPEXXMIUKUWHKG-PWRODBHTSA-N 2 0 342.527 4.220 20 0 EIADRP CC[N@H+](CCC1CC[NH+]([C@@H](C)c2ccc(F)nc2)CC1)CC1CC1 ZINC001168423920 1038609936 /nfs/dbraw/zinc/60/99/36/1038609936.db2.gz RWADSDUYNXPVRS-INIZCTEOSA-N 2 0 333.495 4.116 20 0 EIADRP Cc1ccc(NC(=O)CC[C@@H]([NH3+])CC2CCCCC2)c(C[NH+](C)C)c1 ZINC000424146066 1038642090 /nfs/dbraw/zinc/64/20/90/1038642090.db2.gz OWSYOHWNEIGEGT-LJQANCHMSA-N 2 0 345.531 4.073 20 0 EIADRP Cc1ccc(C[NH+](C)C)cc1NC(=O)CC[C@H]([NH3+])CC1CCCCC1 ZINC000424148644 1038647945 /nfs/dbraw/zinc/64/79/45/1038647945.db2.gz USSNMGOHKBCTME-IBGZPJMESA-N 2 0 345.531 4.073 20 0 EIADRP CC1CC[NH+](CCC[NH2+][C@@H](Cc2ccncc2)c2cccs2)CC1 ZINC000424268172 1038763303 /nfs/dbraw/zinc/76/33/03/1038763303.db2.gz ZKXJDEUQELHLJQ-IBGZPJMESA-N 2 0 343.540 4.139 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cccc(OC(F)F)c2)C1 ZINC000539050700 1038798366 /nfs/dbraw/zinc/79/83/66/1038798366.db2.gz QBZXBNXLVIXRNG-HOTGVXAUSA-N 2 0 340.458 4.307 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CCO[C@@H](C(C)(C)C)C3)CC2)C1 ZINC000539064333 1038809513 /nfs/dbraw/zinc/80/95/13/1038809513.db2.gz AJXYNXNAEJYTCX-RSPOEFSDSA-N 2 0 336.564 4.213 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(Cl)c(F)c1 ZINC000539072303 1038821661 /nfs/dbraw/zinc/82/16/61/1038821661.db2.gz PJLGDIXAFNPVBJ-ZNMIVQPWSA-N 2 0 342.886 4.019 20 0 EIADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000504895220 1038841806 /nfs/dbraw/zinc/84/18/06/1038841806.db2.gz RPSWJSRATSZUBD-UTKZUKDTSA-N 2 0 338.495 4.274 20 0 EIADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)[C@H](C)c1ccccc1C(F)(F)F ZINC000504905725 1038846500 /nfs/dbraw/zinc/84/65/00/1038846500.db2.gz MWZUXDMIQYEOHG-LSDHHAIUSA-N 2 0 328.422 4.273 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2ncc(-c3cccc(Cl)c3)o2)CC1 ZINC000056522712 1038849407 /nfs/dbraw/zinc/84/94/07/1038849407.db2.gz CXVIHQRXSVUGCH-UHFFFAOYSA-N 2 0 347.890 4.159 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(C)cc2C)[C@H](C)C1 ZINC000480887605 1038854250 /nfs/dbraw/zinc/85/42/50/1038854250.db2.gz FMIFRNMICOYHPG-SBHAEUEKSA-N 2 0 332.532 4.091 20 0 EIADRP CC(C)[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000539163211 1038865196 /nfs/dbraw/zinc/86/51/96/1038865196.db2.gz ONUNWJJIMVWOOT-KBXCAEBGSA-N 2 0 340.433 4.476 20 0 EIADRP COc1ccc([C@H]([NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)C2CC2)cc1 ZINC000539215680 1038886614 /nfs/dbraw/zinc/88/66/14/1038886614.db2.gz BZBQSDINQUHZDR-LAUBAEHRSA-N 2 0 330.516 4.104 20 0 EIADRP C[NH+](C)C1CCC([N@@H+]2CCC[C@@H](Oc3ccc(Cl)cc3)C2)CC1 ZINC001168327414 1038915110 /nfs/dbraw/zinc/91/51/10/1038915110.db2.gz NFAUTDHWRGNZDU-FAFZWHIHSA-N 2 0 336.907 4.056 20 0 EIADRP C[NH+](C)CC1CC[NH+](CCCSc2ccccc2Cl)CC1 ZINC000481001021 1038915711 /nfs/dbraw/zinc/91/57/11/1038915711.db2.gz BDPSEHVKEFQDCU-UHFFFAOYSA-N 2 0 326.937 4.096 20 0 EIADRP c1ccc(CCN2CCC([NH2+][C@@H]3CC[C@@H]4CCC[C@@H]4C3)CC2)cc1 ZINC000462120573 1038939353 /nfs/dbraw/zinc/93/93/53/1038939353.db2.gz UKPSHLOKUJQFIP-TUNNFDKTSA-N 2 0 326.528 4.252 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](CC)c2ccc(Br)cc2)C1 ZINC000481027712 1038970934 /nfs/dbraw/zinc/97/09/34/1038970934.db2.gz WRTCKLVHDILORN-WMLDXEAASA-N 2 0 339.321 4.222 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)C1 ZINC000481037769 1038989651 /nfs/dbraw/zinc/98/96/51/1038989651.db2.gz MXZOEKCCSCVWBB-WBMJQRKESA-N 2 0 327.299 4.302 20 0 EIADRP C[C@@H](c1ccc(Br)cc1)[N@H+](C)C1CCC([NH+](C)C)CC1 ZINC001168333695 1039033554 /nfs/dbraw/zinc/03/35/54/1039033554.db2.gz BVRUGMCKUZGQHZ-IGEOTXOUSA-N 2 0 339.321 4.315 20 0 EIADRP CCOc1cccc(CN(C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000552059528 1039079889 /nfs/dbraw/zinc/07/98/89/1039079889.db2.gz IQRPXOKIBSBCEU-NRFANRHFSA-N 2 0 338.495 4.039 20 0 EIADRP C[C@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)C(F)(F)F ZINC000552067022 1039091590 /nfs/dbraw/zinc/09/15/90/1039091590.db2.gz YUJLUOJZLYMZBV-ODIFPOPNSA-N 2 0 328.422 4.218 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1ccc(OC(F)F)cc1 ZINC000477915572 1039194869 /nfs/dbraw/zinc/19/48/69/1039194869.db2.gz LBUHRGQZMZESMC-CQSZACIVSA-N 2 0 326.431 4.061 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cccc(OCc3ccccc3)c2)C1 ZINC000481294925 1039232233 /nfs/dbraw/zinc/23/22/33/1039232233.db2.gz MZQGGPMAXWLLAT-ICSRJNTNSA-N 2 0 338.495 4.258 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc3ccccc3c2OC(F)F)C1 ZINC000481296914 1039233371 /nfs/dbraw/zinc/23/33/71/1039233371.db2.gz BDIMYOLMVBQDEG-HUUCEWRRSA-N 2 0 348.437 4.434 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1cc2c(s1)CCC2 ZINC000120917597 1039234201 /nfs/dbraw/zinc/23/42/01/1039234201.db2.gz GZYYRUVWGXIILV-CYBMUJFWSA-N 2 0 332.488 4.288 20 0 EIADRP CCc1ccc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1 ZINC000481307050 1039255623 /nfs/dbraw/zinc/25/56/23/1039255623.db2.gz IRMZIKCEIWKOPR-KRWDZBQOSA-N 2 0 326.484 4.040 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)[C@@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000481322922 1039288935 /nfs/dbraw/zinc/28/89/35/1039288935.db2.gz NYEMHFXCEYJGSL-BFHYXJOUSA-N 2 0 345.314 4.081 20 0 EIADRP CCC[C@@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1cccc(C(F)(F)F)c1 ZINC000481325248 1039296691 /nfs/dbraw/zinc/29/66/91/1039296691.db2.gz VBJJTDJWJMBBMT-WMLDXEAASA-N 2 0 328.422 4.478 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1)C[NH+]1CCCC1 ZINC000481330924 1039307626 /nfs/dbraw/zinc/30/76/26/1039307626.db2.gz FBFBXJPYSBFVSZ-CABCVRRESA-N 2 0 344.421 4.010 20 0 EIADRP CC(C)CCOCC[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000552251204 1039312808 /nfs/dbraw/zinc/31/28/08/1039312808.db2.gz NSNLZRCUKCTMNX-UHFFFAOYSA-N 2 0 332.532 4.082 20 0 EIADRP C[NH+](C)CC1CC[NH+](Cc2cccc(OCc3ccccc3)c2)CC1 ZINC000534332378 1039329757 /nfs/dbraw/zinc/32/97/57/1039329757.db2.gz FHOCZVSNYZGKNX-UHFFFAOYSA-N 2 0 338.495 4.039 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cccc(-c3ccncc3)c2)CC1 ZINC000534347267 1039335096 /nfs/dbraw/zinc/33/50/96/1039335096.db2.gz MFUADOYCWQICTQ-UHFFFAOYSA-N 2 0 337.511 4.301 20 0 EIADRP Clc1ccccc1CC1(C[NH2+]C2CC[NH+](CC3CC3)CC2)CC1 ZINC001168365814 1039344856 /nfs/dbraw/zinc/34/48/56/1039344856.db2.gz XJYXODPVMGFSNY-UHFFFAOYSA-N 2 0 332.919 4.127 20 0 EIADRP Cc1nccn1-c1ccc(C[NH2+][C@H](c2ccc(C)cc2)C2CC2)cn1 ZINC000091288580 1039357842 /nfs/dbraw/zinc/35/78/42/1039357842.db2.gz KSTGWVMFHXGJSC-OAQYLSRUSA-N 2 0 332.451 4.125 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1cc(C)ccc1OC ZINC000091725137 1039387783 /nfs/dbraw/zinc/38/77/83/1039387783.db2.gz XEPCZIWJAUXXFM-HXUWFJFHSA-N 2 0 344.474 4.445 20 0 EIADRP Fc1ccc(-c2nc(C[NH2+]CCCCC[NH+]3CCCC3)cs2)cc1 ZINC000555615026 1039429209 /nfs/dbraw/zinc/42/92/09/1039429209.db2.gz AIMZMUAEJSXSAF-UHFFFAOYSA-N 2 0 347.503 4.305 20 0 EIADRP C[C@H](NC1CC[NH+](C2CCC2)CC1)c1ccccc1OC(F)(F)F ZINC000481446547 1039442560 /nfs/dbraw/zinc/44/25/60/1039442560.db2.gz RECMBMKOQGYLBS-ZDUSSCGKSA-N 2 0 342.405 4.253 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ccc(Cl)c(F)c2)C1 ZINC000065931958 1039596472 /nfs/dbraw/zinc/59/64/72/1039596472.db2.gz OKRCHJVIQMWFRP-GASCZTMLSA-N 2 0 326.887 4.327 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)[C@H](C)c2nc3ccccc3s2)CC1 ZINC000122730972 1039783279 /nfs/dbraw/zinc/78/32/79/1039783279.db2.gz HALOPFXHFUSDES-JKSUJKDBSA-N 2 0 345.556 4.500 20 0 EIADRP c1ccc(CSCCC[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000534869024 1039821345 /nfs/dbraw/zinc/82/13/45/1039821345.db2.gz QJCYXANTBLRFNH-FQEVSTJZSA-N 2 0 332.557 4.260 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccccc1-c1ccc(Cl)cc1 ZINC000481923493 1039898123 /nfs/dbraw/zinc/89/81/23/1039898123.db2.gz OQOFGLIBMMFBKR-FOIQADDNSA-N 2 0 328.887 4.437 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H](C)CC[NH+](C)C)CCC3)cc1 ZINC000481960126 1039912081 /nfs/dbraw/zinc/91/20/81/1039912081.db2.gz LQTKPVAXOWDTCH-DOTOQJQBSA-N 2 0 343.540 4.426 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000481976520 1039924755 /nfs/dbraw/zinc/92/47/55/1039924755.db2.gz ZKVNESKRTDIRKC-CJNGLKHVSA-N 2 0 347.503 4.256 20 0 EIADRP CC(C)OC1CC[NH+](CC(C)(C)C[N@H+](C)Cc2ccccc2)CC1 ZINC000535078867 1039950222 /nfs/dbraw/zinc/95/02/22/1039950222.db2.gz KWPWAHPQDZMNHC-UHFFFAOYSA-N 2 0 332.532 4.034 20 0 EIADRP C(=C\c1ccccc1)\C[NH2+]CC1(N2CCSCC2)CCCCC1 ZINC000482082848 1040001745 /nfs/dbraw/zinc/00/17/45/1040001745.db2.gz YWTUXGGQTBTSOY-YFHOEESVSA-N 2 0 330.541 4.041 20 0 EIADRP CCO[C@H](C[NH2+][C@@H]1CCN(C)[C@H](c2ccccc2)C1)c1ccccc1 ZINC000551174995 1040018516 /nfs/dbraw/zinc/01/85/16/1040018516.db2.gz DXBBAXBMINPPBH-BHIFYINESA-N 2 0 338.495 4.189 20 0 EIADRP C[C@H]([NH2+]CCc1ccc2[nH]ccc2c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000514633506 1040067388 /nfs/dbraw/zinc/06/73/88/1040067388.db2.gz GARKPRQOZDCAPG-AVRDEDQJSA-N 2 0 347.506 4.211 20 0 EIADRP Fc1cccc(Cl)c1CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167958016 1040124348 /nfs/dbraw/zinc/12/43/48/1040124348.db2.gz ATOJIIGSGWWZDV-MQVJKMGUSA-N 2 0 336.882 4.017 20 0 EIADRP COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000162916067 1040228870 /nfs/dbraw/zinc/22/88/70/1040228870.db2.gz SSMKBHOENKEKMH-GOSISDBHSA-N 2 0 338.495 4.450 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(F)cc1 ZINC000482434324 1040242435 /nfs/dbraw/zinc/24/24/35/1040242435.db2.gz FNKLMMJLDYXELO-IEBWSBKVSA-N 2 0 326.459 4.041 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc3ccccc3)C1)CC2 ZINC000482436772 1040244355 /nfs/dbraw/zinc/24/43/55/1040244355.db2.gz JKFZVVXQHNJRHN-NZQKXSOJSA-N 2 0 334.507 4.137 20 0 EIADRP C[C@H](NC[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000482441685 1040249422 /nfs/dbraw/zinc/24/94/22/1040249422.db2.gz VPIMHNQDQPTRNK-FUHWJXTLSA-N 2 0 344.449 4.180 20 0 EIADRP CCc1ccc([C@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)s1 ZINC000482454127 1040264489 /nfs/dbraw/zinc/26/44/89/1040264489.db2.gz WNSXEGKEYIWYGR-INIZCTEOSA-N 2 0 346.540 4.492 20 0 EIADRP Clc1cccc(Cl)c1CCC[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000482459204 1040269327 /nfs/dbraw/zinc/26/93/27/1040269327.db2.gz NFSPSDARMYQPFQ-UHFFFAOYSA-N 2 0 341.326 4.390 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1cccc(OCc2ccccc2)c1 ZINC000482559584 1040350014 /nfs/dbraw/zinc/35/00/14/1040350014.db2.gz YAHJWUFSMGVTBR-SFHVURJKSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000482562921 1040352768 /nfs/dbraw/zinc/35/27/68/1040352768.db2.gz DYWFPQPKUIAJQF-CHWSQXEVSA-N 2 0 345.314 4.081 20 0 EIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000482562924 1040353409 /nfs/dbraw/zinc/35/34/09/1040353409.db2.gz DYWFPQPKUIAJQF-QWHCGFSZSA-N 2 0 345.314 4.081 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cccc(Br)c2C)C[C@H]1C ZINC000535585291 1040387358 /nfs/dbraw/zinc/38/73/58/1040387358.db2.gz LMYGJAYGHLZJDU-CJNGLKHVSA-N 2 0 339.321 4.062 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc2c(s1)CCC2 ZINC000479467133 1040389907 /nfs/dbraw/zinc/38/99/07/1040389907.db2.gz VDPXLYFPHNQKBN-SJLPKXTDSA-N 2 0 340.536 4.410 20 0 EIADRP C[C@@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(C2CCCCC2)cc1 ZINC000482630967 1040398071 /nfs/dbraw/zinc/39/80/71/1040398071.db2.gz QZTUAYIBYVYIDI-OALUTQOASA-N 2 0 343.559 4.021 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@H]2[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000666995162 1040407154 /nfs/dbraw/zinc/40/71/54/1040407154.db2.gz FABOVAMCWQDFGN-SESVDKBCSA-N 2 0 342.527 4.374 20 0 EIADRP CCN(Cc1nc(C)c(-c2ccc(Cl)cc2)o1)[C@H]1CCC[NH2+]CC1 ZINC000435630134 1040512395 /nfs/dbraw/zinc/51/23/95/1040512395.db2.gz ZSQVKUNXUAKUAX-KRWDZBQOSA-N 2 0 347.890 4.267 20 0 EIADRP C[N@H+]1CC=C(C[NH2+]Cc2cc(Cl)ccc2OC2CCCC2)CC1 ZINC000539546792 1040534739 /nfs/dbraw/zinc/53/47/39/1040534739.db2.gz JIJSPFSDDNZYNO-UHFFFAOYSA-N 2 0 334.891 4.013 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000482894188 1040555115 /nfs/dbraw/zinc/55/51/15/1040555115.db2.gz RVKYCRROCPPJAX-XLIONFOSSA-N 2 0 338.495 4.008 20 0 EIADRP CC(C)[C@H]1CCC[C@H]1[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551811867 1040624231 /nfs/dbraw/zinc/62/42/31/1040624231.db2.gz IHMORPFLQLZPOW-NHCUHLMSSA-N 2 0 330.516 4.074 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)CCO1 ZINC000284934435 1040723947 /nfs/dbraw/zinc/72/39/47/1040723947.db2.gz DOZKVIXVQAPUHK-ONZKCSKKSA-N 2 0 344.543 4.224 20 0 EIADRP C[C@@H]([NH2+]CCSc1ccccc1)c1cccc(OCC[NH+](C)C)c1 ZINC000479875865 1040741129 /nfs/dbraw/zinc/74/11/29/1040741129.db2.gz MNCZPFLZGUIUCK-QGZVFWFLSA-N 2 0 344.524 4.070 20 0 EIADRP C[C@@H]([NH2+][C@H]1CSc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000483177808 1040746039 /nfs/dbraw/zinc/74/60/39/1040746039.db2.gz QDATVOINPSXIJF-BEFAXECRSA-N 2 0 342.508 4.125 20 0 EIADRP C[N@H+](Cc1ccnn1-c1cc[nH+]cc1)[C@H]1CCC[C@@H]1c1ccccc1 ZINC000668235279 1040819594 /nfs/dbraw/zinc/81/95/94/1040819594.db2.gz HRDSXDUIDXKPBP-RTWAWAEBSA-N 2 0 332.451 4.035 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cnc(-c3ccc(C)cc3)s2)[C@@H](C)C1 ZINC000539835704 1040828164 /nfs/dbraw/zinc/82/81/64/1040828164.db2.gz PAMZFRRVIUKVTQ-LPHOPBHVSA-N 2 0 343.540 4.281 20 0 EIADRP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1 ZINC000483472228 1040870368 /nfs/dbraw/zinc/87/03/68/1040870368.db2.gz JXRLRQRQQOEODL-UKPHBRMFSA-N 2 0 342.405 4.062 20 0 EIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1Cl ZINC000537935034 1040900731 /nfs/dbraw/zinc/90/07/31/1040900731.db2.gz QZIMZHMRIPCGNO-AWEZNQCLSA-N 2 0 347.865 4.441 20 0 EIADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000537938480 1040904119 /nfs/dbraw/zinc/90/41/19/1040904119.db2.gz BAICTLKMIXXNBH-JTSKRJEESA-N 2 0 338.495 4.274 20 0 EIADRP CC[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)C1CCOCC1 ZINC000537940135 1040906494 /nfs/dbraw/zinc/90/64/94/1040906494.db2.gz VNUXUOXSFYICHU-VCOUNFBDSA-N 2 0 344.543 4.082 20 0 EIADRP COc1cc(C)cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000537952086 1040919437 /nfs/dbraw/zinc/91/94/37/1040919437.db2.gz PJKBCEQAMVFONV-PGRDOPGGSA-N 2 0 338.495 4.004 20 0 EIADRP Cc1ccccc1O[C@@H](C)C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000483634874 1040938478 /nfs/dbraw/zinc/93/84/78/1040938478.db2.gz IENNLRMXUJTBMF-SFHVURJKSA-N 2 0 330.516 4.149 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@H]3C)cc2)cc1 ZINC000537988487 1040966044 /nfs/dbraw/zinc/96/60/44/1040966044.db2.gz VGGQQABYWYUOLS-HYFFOGBASA-N 2 0 338.495 4.181 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccc(Cl)s1 ZINC000537991008 1040967514 /nfs/dbraw/zinc/96/75/14/1040967514.db2.gz QBXCBWGKXUQIKK-QAPCUYQASA-N 2 0 348.943 4.444 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc(Cl)s1 ZINC000537991007 1040970375 /nfs/dbraw/zinc/97/03/75/1040970375.db2.gz QBXCBWGKXUQIKK-MAUKXSAKSA-N 2 0 348.943 4.444 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000483737430 1040991979 /nfs/dbraw/zinc/99/19/79/1040991979.db2.gz VDDUFOJCKWMKQL-WMLDXEAASA-N 2 0 340.433 4.057 20 0 EIADRP CC[N@H+](Cc1ccccc1N(C)C1CC[NH+](C)CC1)CC(C)(C)C ZINC000462834339 1041016095 /nfs/dbraw/zinc/01/60/95/1041016095.db2.gz PHBXBRBPPCZPAP-UHFFFAOYSA-N 2 0 331.548 4.085 20 0 EIADRP c1ccc2c(c1)C[C@H]1CC[C@@H](C2)C1[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000554373530 1041058786 /nfs/dbraw/zinc/05/87/86/1041058786.db2.gz IBRLNWOXCKKDKT-DETIRCLXSA-N 2 0 338.539 4.177 20 0 EIADRP C[N@@H+]1CCC[C@@H](CNc2cc[nH+]c3ccccc23)[C@H]1c1cccs1 ZINC000462880168 1041062601 /nfs/dbraw/zinc/06/26/01/1041062601.db2.gz AYCYIJGZNYDHIW-YWZLYKJASA-N 2 0 337.492 4.213 20 0 EIADRP C[N@H+](CCCNC1CC[NH+](C2CCCCC2)CC1)C1CCCCC1 ZINC000480256007 1041123367 /nfs/dbraw/zinc/12/33/67/1041123367.db2.gz YCWTTYMTDXPNMB-UHFFFAOYSA-N 2 0 335.580 4.028 20 0 EIADRP C[C@H](CCCC(F)(F)F)[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000480253196 1041136084 /nfs/dbraw/zinc/13/60/84/1041136084.db2.gz WOSGGUXKBRVXJV-SJLPKXTDSA-N 2 0 342.449 4.262 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cccc(NC(C)=O)c1 ZINC000484293018 1041195870 /nfs/dbraw/zinc/19/58/70/1041195870.db2.gz PWYHZOVNGHSYEW-NBHGPNQESA-N 2 0 345.531 4.196 20 0 EIADRP C[C@@H]([NH2+]Cc1cc2c(cccc2F)[nH]1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000436399884 1041203048 /nfs/dbraw/zinc/20/30/48/1041203048.db2.gz GUVWAWGODCBOAG-HUUCEWRRSA-N 2 0 329.463 4.050 20 0 EIADRP CCCOc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000540170826 1041213819 /nfs/dbraw/zinc/21/38/19/1041213819.db2.gz PQQFQAZQSDWNND-CEXWTWQISA-N 2 0 348.531 4.015 20 0 EIADRP CC[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(Cl)s1 ZINC000540172347 1041215697 /nfs/dbraw/zinc/21/56/97/1041215697.db2.gz AHHVLYODOODIHU-ZNMIVQPWSA-N 2 0 344.952 4.332 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)cc1OCC ZINC000484469884 1041246161 /nfs/dbraw/zinc/24/61/61/1041246161.db2.gz FPPONKIHJMIQTJ-RYQLBKOJSA-N 2 0 334.504 4.007 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)cc1OCC ZINC000484469876 1041247673 /nfs/dbraw/zinc/24/76/73/1041247673.db2.gz FPPONKIHJMIQTJ-CGTJXYLNSA-N 2 0 334.504 4.007 20 0 EIADRP CC[C@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)Oc1ccccc1F ZINC000484489360 1041263935 /nfs/dbraw/zinc/26/39/35/1041263935.db2.gz GKCQKUSUICKMGG-LJQANCHMSA-N 2 0 348.506 4.370 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@@H]1CC2c3ccccc3C1c1ccccc12 ZINC000540194448 1041268597 /nfs/dbraw/zinc/26/85/97/1041268597.db2.gz ITZWRVHOUMJDPF-CGHMBIMXSA-N 2 0 346.518 4.214 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(OC(F)(F)F)cc1 ZINC000484476811 1041269627 /nfs/dbraw/zinc/26/96/27/1041269627.db2.gz WPKQSXCAKRUKGY-AEGPPILISA-N 2 0 330.394 4.109 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(F)c(Br)c1 ZINC000484481750 1041273587 /nfs/dbraw/zinc/27/35/87/1041273587.db2.gz AEMUEQBZBVNVCM-IACUBPJLSA-N 2 0 343.284 4.112 20 0 EIADRP C[C@@H]1CCN(c2cc[nH+]c3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC000463062554 1041296988 /nfs/dbraw/zinc/29/69/88/1041296988.db2.gz ADRYIGWLBKLRMO-GOSISDBHSA-N 2 0 331.463 4.336 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000538408257 1041324711 /nfs/dbraw/zinc/32/47/11/1041324711.db2.gz DDYMHXRTPVSPTJ-QGZVFWFLSA-N 2 0 325.283 4.296 20 0 EIADRP COc1ccccc1[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)C1CCCC1 ZINC000540262656 1041328942 /nfs/dbraw/zinc/32/89/42/1041328942.db2.gz DXQNLZNTRCMWPY-QFIPXVFZSA-N 2 0 342.527 4.391 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H](c2ccc(Cl)cc2)C(C)C)CC1 ZINC000540300729 1041353100 /nfs/dbraw/zinc/35/31/00/1041353100.db2.gz DJGITIQOFVTPBD-IBGZPJMESA-N 2 0 338.923 4.128 20 0 EIADRP COC[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)C(C)C ZINC000480540863 1041375163 /nfs/dbraw/zinc/37/51/63/1041375163.db2.gz YIDJVPKPZJFOKS-QFIPXVFZSA-N 2 0 340.511 4.176 20 0 EIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1ccsc1 ZINC000540394994 1041428405 /nfs/dbraw/zinc/42/84/05/1041428405.db2.gz MMXBJTXQNOWBIG-KRWDZBQOSA-N 2 0 344.524 4.116 20 0 EIADRP CCc1nc2c(s1)[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)CCC2 ZINC000480635082 1041449072 /nfs/dbraw/zinc/44/90/72/1041449072.db2.gz VNQCFUSMPGBVKH-HOTGVXAUSA-N 2 0 335.561 4.327 20 0 EIADRP c1ccc(N2CCC([NH2+]C[C@@H]3CCC[N@@H+]3C3CCCCC3)CC2)cc1 ZINC000463247977 1041452660 /nfs/dbraw/zinc/45/26/60/1041452660.db2.gz LIAWPQJVVYILDE-QFIPXVFZSA-N 2 0 341.543 4.042 20 0 EIADRP Cc1sc([C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)nc1-c1ccc(Cl)cc1 ZINC000904364637 1041459248 /nfs/dbraw/zinc/45/92/48/1041459248.db2.gz ZWFQDZZVCQTNKY-HCKVZZMMSA-N 2 0 335.904 4.160 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc(C(C)C)c2)[C@H](C)C1 ZINC000480674044 1041464769 /nfs/dbraw/zinc/46/47/69/1041464769.db2.gz WPLMDACGDOAROX-NQIIRXRSSA-N 2 0 332.532 4.037 20 0 EIADRP CN(c1ccccc1C[NH2+]C/C=C/c1ccccc1)C1CC[NH+](C)CC1 ZINC000538671624 1041471328 /nfs/dbraw/zinc/47/13/28/1041471328.db2.gz JGNAFFMSVTULKK-DHZHZOJOSA-N 2 0 349.522 4.020 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)[C@@H]1CCOC1 ZINC000480703454 1041480395 /nfs/dbraw/zinc/48/03/95/1041480395.db2.gz YPRHDNPTZCZWAM-YHBROIRLSA-N 2 0 344.543 4.069 20 0 EIADRP COc1cc([C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1F ZINC000195133233 1041484075 /nfs/dbraw/zinc/48/40/75/1041484075.db2.gz KOGIPFUHFQOKQY-FUHWJXTLSA-N 2 0 342.458 4.007 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Br)cc2C)C[C@@H]1C ZINC000538718058 1041487480 /nfs/dbraw/zinc/48/74/80/1041487480.db2.gz RUEVPYXSJWBQJQ-YOEHRIQHSA-N 2 0 339.321 4.062 20 0 EIADRP Cc1cccc(COc2ccc(C[NH2+][C@@H]3CC[N@@H+](C)C[C@@H]3C)cc2)c1 ZINC000480753975 1041508668 /nfs/dbraw/zinc/50/86/68/1041508668.db2.gz COSKOHGXJMVQEU-PGRDOPGGSA-N 2 0 338.495 4.004 20 0 EIADRP Cc1cccc(COc2ccc(C[NH2+][C@H]3CC[N@@H+](C)C[C@H]3C)cc2)c1 ZINC000480753974 1041509522 /nfs/dbraw/zinc/50/95/22/1041509522.db2.gz COSKOHGXJMVQEU-GCJKJVERSA-N 2 0 338.495 4.004 20 0 EIADRP CC(C)c1ccc(-c2nc(CN3CC[C@@H]([C@H](C)[NH3+])C3)cs2)cc1 ZINC000484908983 1041514478 /nfs/dbraw/zinc/51/44/78/1041514478.db2.gz SCZGAYAXZZWWMF-WMLDXEAASA-N 2 0 329.513 4.103 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc(-c4ccccc4F)o3)CC[C@H]21 ZINC000538799166 1041540017 /nfs/dbraw/zinc/54/00/17/1041540017.db2.gz RRENVKHCEKAYTI-HNAYVOBHSA-N 2 0 328.431 4.002 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000540708623 1041606656 /nfs/dbraw/zinc/60/66/56/1041606656.db2.gz ZMGCHYBLRFFWJO-MSOLQXFVSA-N 2 0 338.417 4.193 20 0 EIADRP CC(C)[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000437101886 1041661085 /nfs/dbraw/zinc/66/10/85/1041661085.db2.gz FDFOUSWFXFQUTM-WMLDXEAASA-N 2 0 346.437 4.255 20 0 EIADRP CSC1(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CCC1 ZINC000516822417 1041773882 /nfs/dbraw/zinc/77/38/82/1041773882.db2.gz RHMOIXYPNLBTRD-MJGOQNOKSA-N 2 0 332.557 4.162 20 0 EIADRP CC(C)c1ccc([C@@H](C)[NH+]2CCC(OCC[NH+]3CCCC3)CC2)cc1 ZINC000541350880 1041899668 /nfs/dbraw/zinc/89/96/68/1041899668.db2.gz HZXWSIYJEJPONY-LJQANCHMSA-N 2 0 344.543 4.448 20 0 EIADRP C[C@H]([NH2+]CCCCCOc1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000437784864 1041908591 /nfs/dbraw/zinc/90/85/91/1041908591.db2.gz KZZOXKLAYQHDDO-VQTJNVASSA-N 2 0 344.543 4.478 20 0 EIADRP Cn1ccnc1C[C@@H]1CCC[N@@H+]([C@@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000437791852 1041913211 /nfs/dbraw/zinc/91/32/11/1041913211.db2.gz HTYPVOCBVOQNKU-DWLFOUALSA-N 2 0 337.511 4.185 20 0 EIADRP CC[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)CC(F)(F)F ZINC000402688691 1041947225 /nfs/dbraw/zinc/94/72/25/1041947225.db2.gz HENLUERVXJSJIO-BQFCYCMXSA-N 2 0 342.449 4.465 20 0 EIADRP c1ccc(COCCC[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cc1 ZINC000541582269 1042015534 /nfs/dbraw/zinc/01/55/34/1042015534.db2.gz JMEWGZJHDRDGTA-UHFFFAOYSA-N 2 0 344.543 4.181 20 0 EIADRP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000467365301 1042021766 /nfs/dbraw/zinc/02/17/66/1042021766.db2.gz PDSUALYQBJGFJS-XOKHGSTOSA-N 2 0 328.422 4.099 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000425945129 1042033425 /nfs/dbraw/zinc/03/34/25/1042033425.db2.gz JOLZMWAQPTXENL-OLZOCXBDSA-N 2 0 335.492 4.106 20 0 EIADRP Fc1ccc2c(c1)CC[C@@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001168438771 1042065702 /nfs/dbraw/zinc/06/57/02/1042065702.db2.gz ODZJDEQHKCYARD-LEWJYISDSA-N 2 0 330.491 4.023 20 0 EIADRP C[N@H+](CCOC1CCCCCC1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464831477 1042189160 /nfs/dbraw/zinc/18/91/60/1042189160.db2.gz AINANSGXTQPSSA-OAQYLSRUSA-N 2 0 344.543 4.180 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000414933630 1042217766 /nfs/dbraw/zinc/21/77/66/1042217766.db2.gz XBKXOFQCQSQPPW-TWMKSMIVSA-N 2 0 326.406 4.201 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CC[NH2+]1 ZINC000414948184 1042335561 /nfs/dbraw/zinc/33/55/61/1042335561.db2.gz LSSXKIUVIMZOES-VZEFYGNVSA-N 2 0 326.406 4.072 20 0 EIADRP CC(C)[NH+]1CCC([N@H+](C)Cc2ccc3c(c2)CCC(C)(C)O3)CC1 ZINC000506371283 1042354728 /nfs/dbraw/zinc/35/47/28/1042354728.db2.gz UEQINKRUGAZMCQ-UHFFFAOYSA-N 2 0 330.516 4.095 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccc(F)cc2)CC1 ZINC000438826975 1042371399 /nfs/dbraw/zinc/37/13/99/1042371399.db2.gz AELYBQSMEMKCFG-UHFFFAOYSA-N 2 0 326.459 4.359 20 0 EIADRP c1cncc(-c2cccc(CN3CCC([NH+]4CCCCC4)CC3)c2)c1 ZINC000506383067 1042371497 /nfs/dbraw/zinc/37/14/97/1042371497.db2.gz FNZPYIDMYBWFOU-UHFFFAOYSA-N 2 0 335.495 4.199 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]CCC1CC[NH+](C)CC1 ZINC000438831612 1042373791 /nfs/dbraw/zinc/37/37/91/1042373791.db2.gz SEXWXDZVGZZFDU-FQEVSTJZSA-N 2 0 325.500 4.175 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@@H]2CCC[C@@H](c3ncccc3C)C2)CC1 ZINC000467377157 1042385197 /nfs/dbraw/zinc/38/51/97/1042385197.db2.gz MIPXJGPWFSKJLX-UYAOXDASSA-N 2 0 329.532 4.270 20 0 EIADRP COc1ccc(Oc2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@H](C)C3)cc2)cc1 ZINC000542322936 1042387943 /nfs/dbraw/zinc/38/79/43/1042387943.db2.gz NGRSGYTZFYGJTN-SJLPKXTDSA-N 2 0 340.467 4.060 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)CC3 ZINC000491399278 1042440171 /nfs/dbraw/zinc/44/01/71/1042440171.db2.gz WEIYQJGBMJOZBP-LJQANCHMSA-N 2 0 347.506 4.185 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]CC2=Cc3ccccc3OC2)c1 ZINC000518272079 1042446087 /nfs/dbraw/zinc/44/60/87/1042446087.db2.gz OFJHWPPDZQDRII-UHFFFAOYSA-N 2 0 336.479 4.094 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCCOc2ccccc2)C1 ZINC000303657678 1042492745 /nfs/dbraw/zinc/49/27/45/1042492745.db2.gz VEFNWMSIQKHOGN-WOJBJXKFSA-N 2 0 330.516 4.042 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C2Cc3ccccc3C2)CC1 ZINC000518412751 1042509958 /nfs/dbraw/zinc/50/99/58/1042509958.db2.gz PEMIEEVCGXZFTC-UHFFFAOYSA-N 2 0 334.507 4.187 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cccc(Br)c1 ZINC000173307029 1042563417 /nfs/dbraw/zinc/56/34/17/1042563417.db2.gz UAYWQWZNJMXBNN-AWEZNQCLSA-N 2 0 347.300 4.362 20 0 EIADRP CSc1ccc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1 ZINC000173329627 1042565629 /nfs/dbraw/zinc/56/56/29/1042565629.db2.gz FKUICXMXWLSOQH-INIZCTEOSA-N 2 0 344.524 4.200 20 0 EIADRP c1cc(C[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc(OCC2CCCCC2)c1 ZINC000518767822 1042676966 /nfs/dbraw/zinc/67/69/66/1042676966.db2.gz TUSZRKVKSBEVFJ-HXUWFJFHSA-N 2 0 342.527 4.220 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)C1 ZINC000518793744 1042695676 /nfs/dbraw/zinc/69/56/76/1042695676.db2.gz ARLAMMNGYNLRBK-MRXNPFEDSA-N 2 0 346.421 4.189 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C[C@H](C)C[NH+]2CCCCC2)C1 ZINC000467388696 1042716374 /nfs/dbraw/zinc/71/63/74/1042716374.db2.gz IFNWEZXRBMULOV-SXLOBPIMSA-N 2 0 329.532 4.128 20 0 EIADRP CC[C@H]1C[C@H](C[NH+]2CCC(CC[N@H+](CC)CC3CC3)CC2)CCO1 ZINC000507774389 1042876106 /nfs/dbraw/zinc/87/61/06/1042876106.db2.gz KAIQIBJWPBKJSN-RTWAWAEBSA-N 2 0 336.564 4.026 20 0 EIADRP C[N@H+](C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1)C(C)(C)Cc1ccccc1 ZINC001168004618 1042932084 /nfs/dbraw/zinc/93/20/84/1042932084.db2.gz WQOMWQFIJILJGL-WCRBZPEASA-N 2 0 326.528 4.345 20 0 EIADRP Fc1ccc(C[C@@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001168005139 1042957748 /nfs/dbraw/zinc/95/77/48/1042957748.db2.gz GPWLLWTUNYLQMQ-CCDCCJRHSA-N 2 0 342.502 4.238 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc2cc(OC)ccc2c1 ZINC000152418195 1043005963 /nfs/dbraw/zinc/00/59/63/1043005963.db2.gz ANTQRRABYMDJEE-ZHRRBRCNSA-N 2 0 338.495 4.373 20 0 EIADRP Cc1nc2ccc(C[NH2+][C@@H](C)[C@@H]3CCC[N@@H+](C4CCC4)C3)cc2s1 ZINC000494196803 1043032130 /nfs/dbraw/zinc/03/21/30/1043032130.db2.gz ZQWZDBXORQQKLX-WMLDXEAASA-N 2 0 343.540 4.347 20 0 EIADRP CSc1ccc(CN(c2ccccn2)[C@H]2CC[C@H]([NH3+])CC2)s1 ZINC000895113888 1043033779 /nfs/dbraw/zinc/03/37/79/1043033779.db2.gz YSSGSJVDTYNIKH-HDJSIYSDSA-N 2 0 333.526 4.142 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(OC)cc1 ZINC000183192849 1043039900 /nfs/dbraw/zinc/03/99/00/1043039900.db2.gz KIMIAYUJTQNZJD-CDXJDZJCSA-N 2 0 330.516 4.389 20 0 EIADRP C[C@@H]1CC([NH2+]CCC2(O)CCCCC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168008562 1043073713 /nfs/dbraw/zinc/07/37/13/1043073713.db2.gz FMBLGEWCNWKJBB-RTBURBONSA-N 2 0 344.543 4.103 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1cnn(-c2ccccc2)c1 ZINC000765954551 1043080681 /nfs/dbraw/zinc/08/06/81/1043080681.db2.gz SKFJRYQTQXTNJM-IBGZPJMESA-N 2 0 340.515 4.179 20 0 EIADRP COc1cccc(C[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001168009153 1043091627 /nfs/dbraw/zinc/09/16/27/1043091627.db2.gz YWFYCMQZUMKAHG-QZTJIDSGSA-N 2 0 338.495 4.226 20 0 EIADRP Clc1ccccc1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000008731169 1043163898 /nfs/dbraw/zinc/16/38/98/1043163898.db2.gz QLZNRYMKILYLIH-UHFFFAOYSA-N 2 0 328.887 4.342 20 0 EIADRP COCCC[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(F)cc1 ZINC000282320338 1043180953 /nfs/dbraw/zinc/18/09/53/1043180953.db2.gz NOHNIVVNHBYFOS-IBGZPJMESA-N 2 0 336.495 4.146 20 0 EIADRP CCSc1cccc(C[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c1 ZINC000185471018 1043187663 /nfs/dbraw/zinc/18/76/63/1043187663.db2.gz BBMTXTCHDHKDTF-UHFFFAOYSA-N 2 0 344.524 4.029 20 0 EIADRP FC(F)(F)C1CCC(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)CC1 ZINC000185515750 1043193512 /nfs/dbraw/zinc/19/35/12/1043193512.db2.gz JDCMIQWOELRJOT-JCYILVPMSA-N 2 0 332.454 4.305 20 0 EIADRP C[C@@H]([NH2+]CC1([NH3+])CCCC1)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000665249774 1043262884 /nfs/dbraw/zinc/26/28/84/1043262884.db2.gz YVAJOTAPZUHDQC-VXGBXAGGSA-N 2 0 331.287 4.010 20 0 EIADRP CC(C)Oc1ccc(CC[C@H](C)[NH2+][C@H](C)C2CC[NH+](C)CC2)cc1 ZINC000166012577 1043267305 /nfs/dbraw/zinc/26/73/05/1043267305.db2.gz RKZXZLUUSNSDPO-ZWKOTPCHSA-N 2 0 332.532 4.115 20 0 EIADRP COc1ccc(-c2csc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)c2)cc1 ZINC000166764568 1043312188 /nfs/dbraw/zinc/31/21/88/1043312188.db2.gz FLTLUMNUFXXGPQ-QZTJIDSGSA-N 2 0 342.508 4.140 20 0 EIADRP Cc1nc2ccc(C[NH2+]CCCC[N@H+]3CCC[C@@H](C)C3)cc2s1 ZINC000494385261 1043459674 /nfs/dbraw/zinc/45/96/74/1043459674.db2.gz LYCJIMWAPQCUQV-OAHLLOKOSA-N 2 0 331.529 4.206 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1cc(Br)cs1 ZINC000494470598 1043506654 /nfs/dbraw/zinc/50/66/54/1043506654.db2.gz VZOXOUVDRKRHPT-LBPRGKRZSA-N 2 0 345.350 4.283 20 0 EIADRP C[C@H]([NH2+]Cc1cc2ccccc2[nH]1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000681390517 1043731578 /nfs/dbraw/zinc/73/15/78/1043731578.db2.gz NDKONQWKLCBASK-PXNSSMCTSA-N 2 0 333.479 4.168 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2Cc3[nH]c4ccccc4c3C2)cc1 ZINC000442659439 1043788100 /nfs/dbraw/zinc/78/81/00/1043788100.db2.gz YCDNPEDEDJZNRM-LJQANCHMSA-N 2 0 347.506 4.267 20 0 EIADRP COCCC[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000442660220 1043789771 /nfs/dbraw/zinc/78/97/71/1043789771.db2.gz YOWDLCQKDGNSHI-NRFANRHFSA-N 2 0 344.474 4.145 20 0 EIADRP CCC(CC)[NH+]1CCC(C[NH2+][C@H]2Cc3cccc(Cl)c3C2)CC1 ZINC001168704060 1043798195 /nfs/dbraw/zinc/79/81/95/1043798195.db2.gz DDMLEJOOEYGSAG-KRWDZBQOSA-N 2 0 334.935 4.297 20 0 EIADRP C[C@H]([NH2+]C1[C@@H](C)C[NH+](Cc2ccccc2)C[C@@H]1C)c1cccc(O)c1 ZINC000442779923 1043831801 /nfs/dbraw/zinc/83/18/01/1043831801.db2.gz MEMAFWKKJBGKGW-BZSNNMDCSA-N 2 0 338.495 4.199 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCc4ccccc4OC3)CC2)CC1 ZINC000494593809 1043837632 /nfs/dbraw/zinc/83/76/32/1043837632.db2.gz ZYZWPLOWFHCOGQ-KBWCOIMZSA-N 2 0 342.527 4.013 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000442793259 1043842523 /nfs/dbraw/zinc/84/25/23/1043842523.db2.gz OAJRERATAJCWEN-WBVHZDCISA-N 2 0 328.422 4.273 20 0 EIADRP CCc1ccc(C(C)(C)[NH2+]Cc2cn(-c3cc[nH+]cc3)nc2C)cc1 ZINC000543173464 1044051540 /nfs/dbraw/zinc/05/15/40/1044051540.db2.gz VQHIFPYDGXOUJI-UHFFFAOYSA-N 2 0 334.467 4.163 20 0 EIADRP C[C@H]1CC(n2nc(C[NH3+])c3ccccc32)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168015208 1044077178 /nfs/dbraw/zinc/07/71/78/1044077178.db2.gz PNWDVTXTZZQDQT-IRXDYDNUSA-N 2 0 348.494 4.109 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@@H](C)c2ccc(Br)cc2)CC1 ZINC000226313298 1044120945 /nfs/dbraw/zinc/12/09/45/1044120945.db2.gz GMPIIBFRLPIIPQ-AWEZNQCLSA-N 2 0 339.321 4.220 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)oc1C ZINC000282341144 1044171217 /nfs/dbraw/zinc/17/12/17/1044171217.db2.gz VHEFVEDZCRTDAE-MRXNPFEDSA-N 2 0 330.472 4.078 20 0 EIADRP CS[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)C(C)(C)C ZINC000542499935 1044229151 /nfs/dbraw/zinc/22/91/51/1044229151.db2.gz RTNWSLRFRBTEIY-QXAKKESOSA-N 2 0 334.573 4.264 20 0 EIADRP CCCCOCCC[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168016924 1044284776 /nfs/dbraw/zinc/28/47/76/1044284776.db2.gz WJBFZLJRFFXOEE-CEQLMSFQSA-N 2 0 332.532 4.224 20 0 EIADRP COc1ccc2cc([C@H](C)[NH2+]CC3(C)CC[NH+](C)CC3)ccc2c1 ZINC000326841752 1044309580 /nfs/dbraw/zinc/30/95/80/1044309580.db2.gz ORPYRWIDPGZBBQ-INIZCTEOSA-N 2 0 326.484 4.231 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]CC2CCC(C(F)(F)F)CC2)C1 ZINC000466360375 1044319920 /nfs/dbraw/zinc/31/99/20/1044319920.db2.gz CNDICPVHFOECHL-GTPINHCMSA-N 2 0 334.470 4.457 20 0 EIADRP CCC[NH+]1CCC(N[C@@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000675733626 1044450269 /nfs/dbraw/zinc/45/02/69/1044450269.db2.gz HWGOLUNWCYZEGI-MRXNPFEDSA-N 2 0 327.299 4.445 20 0 EIADRP C[C@@H]1C[C@@H](n2ncc3c2cccc3C[NH3+])C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168021938 1044460001 /nfs/dbraw/zinc/46/00/01/1044460001.db2.gz RINSYHCZVPXDHM-XEMDLRDOSA-N 2 0 348.494 4.109 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCC(C)(C)c2ccccc2)[C@H](C)C1 ZINC000675770734 1044485545 /nfs/dbraw/zinc/48/55/45/1044485545.db2.gz YLVAVAKSBPVVMV-TZIWHRDSSA-N 2 0 346.559 4.081 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+][C@H](C)C2CC[NH+](C)CC2)cc1OC ZINC000675777145 1044490334 /nfs/dbraw/zinc/49/03/34/1044490334.db2.gz MEDLMWGLMUVRAL-SJORKVTESA-N 2 0 348.531 4.255 20 0 EIADRP C[C@H]([NH2+]CCOc1ccccc1-c1ccccc1)C1CC[NH+](C)CC1 ZINC000675777348 1044490757 /nfs/dbraw/zinc/49/07/57/1044490757.db2.gz CLSBHOHFRAJJDE-SFHVURJKSA-N 2 0 338.495 4.052 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cc2ccccc2[nH]1 ZINC000675790081 1044501648 /nfs/dbraw/zinc/50/16/48/1044501648.db2.gz RCMADJNBHUDIDA-UWJYYQICSA-N 2 0 333.479 4.168 20 0 EIADRP C[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000675801091 1044503984 /nfs/dbraw/zinc/50/39/84/1044503984.db2.gz UTSPSUZQINMYEE-STQMWFEESA-N 2 0 329.315 4.244 20 0 EIADRP CCOc1ccc([C@H](CC)[NH2+]CC2CC[NH+](CC)CC2)cc1OCC ZINC000675818487 1044514961 /nfs/dbraw/zinc/51/49/61/1044514961.db2.gz GCWCNWQZGQGFGM-IBGZPJMESA-N 2 0 348.531 4.257 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]CC2CC[NH+](CC)CC2)cc1OC ZINC000675819127 1044516680 /nfs/dbraw/zinc/51/66/80/1044516680.db2.gz SVAFIPYDSUDTPZ-QGZVFWFLSA-N 2 0 348.531 4.257 20 0 EIADRP c1ccc(C[C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)C2CCCCC2)cc1 ZINC000480753801 1044581689 /nfs/dbraw/zinc/58/16/89/1044581689.db2.gz BUMSKTPRWUPYRM-KNQAVFIVSA-N 2 0 326.528 4.252 20 0 EIADRP C[C@@H]1CC([NH2+]Cc2ccc3ocnc3c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168024328 1044607316 /nfs/dbraw/zinc/60/73/16/1044607316.db2.gz FDDAYYRGGPFLSR-IAGOWNOFSA-N 2 0 349.478 4.359 20 0 EIADRP CSCC1CCC([NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000395169778 1044617866 /nfs/dbraw/zinc/61/78/66/1044617866.db2.gz WCQVFJCAZZTGCA-IOJLRTSASA-N 2 0 332.557 4.020 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@H]2CCSc3c(F)cccc32)C1 ZINC000359943105 1044651286 /nfs/dbraw/zinc/65/12/86/1044651286.db2.gz PSPRUQWKDFYUCS-YJBOKZPZSA-N 2 0 336.520 4.464 20 0 EIADRP CC1CC[NH+](CCCC[NH2+][C@H]2CCSc3c(F)cccc32)CC1 ZINC000359949930 1044652250 /nfs/dbraw/zinc/65/22/50/1044652250.db2.gz MXRYOWHRCNMCAK-SFHVURJKSA-N 2 0 336.520 4.464 20 0 EIADRP CS[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCCCC2)C1 ZINC000735324617 1044794841 /nfs/dbraw/zinc/79/48/41/1044794841.db2.gz VXTOYVODHJRUCC-WOJBJXKFSA-N 2 0 332.557 4.436 20 0 EIADRP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]CCCC[NH+](C)C ZINC000657859438 1044812716 /nfs/dbraw/zinc/81/27/16/1044812716.db2.gz URENBCNZIVNIHQ-GFCCVEGCSA-N 2 0 336.829 4.221 20 0 EIADRP Cc1nc(C(C)C)oc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000428292951 1044849196 /nfs/dbraw/zinc/84/91/96/1044849196.db2.gz DJJUHBGLJNDNJW-UHFFFAOYSA-N 2 0 333.520 4.194 20 0 EIADRP Cc1nccn1CCCC[N@H+](CCc1ccccc1)Cc1cccnc1 ZINC000429285681 1044891837 /nfs/dbraw/zinc/89/18/37/1044891837.db2.gz OVBLUDPEGBGVND-UHFFFAOYSA-N 2 0 348.494 4.112 20 0 EIADRP CCC[C@H]([NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1)c1cccnc1 ZINC000544570185 1044944982 /nfs/dbraw/zinc/94/49/82/1044944982.db2.gz WPZYJFSKSXZZKF-NQIIRXRSSA-N 2 0 325.500 4.423 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000347913513 1044998878 /nfs/dbraw/zinc/99/88/78/1044998878.db2.gz AEMWYYDXMLOGKU-QZTJIDSGSA-N 2 0 340.515 4.096 20 0 EIADRP COC1(C[C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)CCC1 ZINC000429372606 1045034899 /nfs/dbraw/zinc/03/48/99/1045034899.db2.gz NNFWGZAYNDMVDO-SFHVURJKSA-N 2 0 330.516 4.110 20 0 EIADRP C[C@H](Cc1cccs1)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000495420360 1045089337 /nfs/dbraw/zinc/08/93/37/1045089337.db2.gz HJDBUSOGTGQOEJ-ZIFCJYIRSA-N 2 0 328.525 4.179 20 0 EIADRP C[NH+](C)CCOC1CC[NH+](CC2CCC(c3ccccc3)CC2)CC1 ZINC000347776509 1045096812 /nfs/dbraw/zinc/09/68/12/1045096812.db2.gz MGNOJVXKHSINFG-UHFFFAOYSA-N 2 0 344.543 4.003 20 0 EIADRP CC(C)c1cc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)on1 ZINC000671747807 1045179397 /nfs/dbraw/zinc/17/93/97/1045179397.db2.gz PHPSSJCUQIVZCD-UHFFFAOYSA-N 2 0 341.499 4.331 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1scnc1C1CC1 ZINC000486962681 1045221957 /nfs/dbraw/zinc/22/19/57/1045221957.db2.gz DLMINUMKKWXXRR-UHFFFAOYSA-N 2 0 329.513 4.151 20 0 EIADRP c1ccc2c(c1)cccc2CSCC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000611104246 1045250513 /nfs/dbraw/zinc/25/05/13/1045250513.db2.gz PSHBKXVINBBEIP-PMACEKPBSA-N 2 0 340.536 4.289 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc(F)cc1 ZINC000495764236 1045328992 /nfs/dbraw/zinc/32/89/92/1045328992.db2.gz IGFLBRSSKAMLMC-HNNXBMFYSA-N 2 0 332.488 4.450 20 0 EIADRP CC(C)CCOc1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC000236588273 1045360421 /nfs/dbraw/zinc/36/04/21/1045360421.db2.gz HDVIJLNPXUFXPP-IHWFROFDSA-N 2 0 330.516 4.216 20 0 EIADRP c1cc2cccc(C[NH2+]Cc3ccc(C[NH+]4CCCCC4)cc3)c2[nH]1 ZINC000236659639 1045363629 /nfs/dbraw/zinc/36/36/29/1045363629.db2.gz TUZKXEYIIBOGMN-UHFFFAOYSA-N 2 0 333.479 4.444 20 0 EIADRP C/C(=C/c1ccccc1)C[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000236701520 1045364037 /nfs/dbraw/zinc/36/40/37/1045364037.db2.gz NCNAKZCMSKCHLL-OWFGXHLJSA-N 2 0 334.507 4.244 20 0 EIADRP C[N@H+](CCC[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1)Cc1ccccc1 ZINC000237095141 1045374731 /nfs/dbraw/zinc/37/47/31/1045374731.db2.gz BUXAZRPSNGJMET-SJORKVTESA-N 2 0 328.422 4.219 20 0 EIADRP CC[NH+](CC)Cc1ccccc1Nc1ccc(CC[NH+](C)C)cc1 ZINC001211995770 1045632936 /nfs/dbraw/zinc/63/29/36/1045632936.db2.gz LAVVCGZZAVOOHE-UHFFFAOYSA-N 2 0 325.500 4.376 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[NH+](CC)CC)c1ccc(F)cn1 ZINC000326170974 1045659240 /nfs/dbraw/zinc/65/92/40/1045659240.db2.gz NXISHJGAKZAMIZ-IBGZPJMESA-N 2 0 329.463 4.303 20 0 EIADRP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000429531726 1045676241 /nfs/dbraw/zinc/67/62/41/1045676241.db2.gz SFKZTMZPRWGJSX-HIFRSBDPSA-N 2 0 330.394 4.062 20 0 EIADRP CC1(C)CC([NH2+]CCCCCCCCCCC[NH3+])CC(C)(C)N1O ZINC001169981871 1045711390 /nfs/dbraw/zinc/71/13/90/1045711390.db2.gz CJKSBTDTFBALPQ-UHFFFAOYSA-N 2 0 341.584 4.456 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1cnn(C)c1 ZINC000247164406 1045843607 /nfs/dbraw/zinc/84/36/07/1045843607.db2.gz UJLZUMHKENOZQR-DYESRHJHSA-N 2 0 340.515 4.035 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000161613074 1046006352 /nfs/dbraw/zinc/00/63/52/1046006352.db2.gz BTFUURMQZUDJHZ-CKEIUWERSA-N 2 0 340.433 4.055 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+]Cc2ccc(O)cc2)C1 ZINC000237469155 1046101204 /nfs/dbraw/zinc/10/12/04/1046101204.db2.gz QAPMKXJFXUSVHM-QZTJIDSGSA-N 2 0 338.495 4.160 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]Cc3ccc(O)cc3)cc2)C1 ZINC000237471913 1046103507 /nfs/dbraw/zinc/10/35/07/1046103507.db2.gz UEEOZPLUKWFLFZ-QZTJIDSGSA-N 2 0 338.495 4.160 20 0 EIADRP C[C@H]([NH3+])C1CC[NH+](CC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000261920543 1046165845 /nfs/dbraw/zinc/16/58/45/1046165845.db2.gz KKTYSGIQLDCLSC-HNNXBMFYSA-N 2 0 344.449 4.156 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[N@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC000261932079 1046166262 /nfs/dbraw/zinc/16/62/62/1046166262.db2.gz LROFGFGVTRBGQM-IAGOWNOFSA-N 2 0 343.540 4.419 20 0 EIADRP Cc1cc(C[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)cc(C)c1O ZINC000310991875 1046192535 /nfs/dbraw/zinc/19/25/35/1046192535.db2.gz HVTGUXJTTMSZDJ-JOCHJYFZSA-N 2 0 338.495 4.011 20 0 EIADRP C[C@H](NC1(c2ccccc2F)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508717792 1046374039 /nfs/dbraw/zinc/37/40/39/1046374039.db2.gz IBOBXUSGNOHDRE-HKUYNNGSSA-N 2 0 338.470 4.315 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)C/C(C)=C\c2ccccc2COC)C[C@H]1C ZINC000508719528 1046376837 /nfs/dbraw/zinc/37/68/37/1046376837.db2.gz NYAFEXDQTIJWHJ-LDQLGUEGSA-N 2 0 330.516 4.041 20 0 EIADRP Cc1ccsc1CC[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508722737 1046424448 /nfs/dbraw/zinc/42/44/48/1046424448.db2.gz UGQANSABYXSSDN-PKOBYXMFSA-N 2 0 328.525 4.099 20 0 EIADRP COc1ccc2cc(C[N@@H+]3CCC[C@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000536659491 1046607963 /nfs/dbraw/zinc/60/79/63/1046607963.db2.gz IHFCBYNRXBMBLV-NRFANRHFSA-N 2 0 338.495 4.299 20 0 EIADRP COc1ccc(-c2ccccc2C)cc1C[NH2+]CCCC[NH+](C)C ZINC000459392917 1046612736 /nfs/dbraw/zinc/61/27/36/1046612736.db2.gz USEMGRIIQKUYAH-UHFFFAOYSA-N 2 0 326.484 4.102 20 0 EIADRP C[C@@H]1C[C@@H](NCc2ccc(F)cc2F)CC[N@@H+]1Cc1ccccc1 ZINC000379622199 1046715015 /nfs/dbraw/zinc/71/50/15/1046715015.db2.gz GEOHMLPKQHEPCZ-BEFAXECRSA-N 2 0 330.422 4.108 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCc3ccccc3C2)CCN1Cc1ccccc1 ZINC000379647796 1046741018 /nfs/dbraw/zinc/74/10/18/1046741018.db2.gz LDHKQHFRDZSORX-YFXJRYMSSA-N 2 0 334.507 4.187 20 0 EIADRP C[C@H](CCCc1cccnc1)[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1 ZINC000459642452 1046830862 /nfs/dbraw/zinc/83/08/62/1046830862.db2.gz BTDVTYIXKYFIQK-KNKQGSTJSA-N 2 0 343.559 4.426 20 0 EIADRP C[C@H](CCCc1cccnc1)[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1 ZINC000459642455 1046831028 /nfs/dbraw/zinc/83/10/28/1046831028.db2.gz BTDVTYIXKYFIQK-WOIUINJBSA-N 2 0 343.559 4.426 20 0 EIADRP C[C@H](CCCc1cccnc1)[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1 ZINC000459642454 1046831455 /nfs/dbraw/zinc/83/14/55/1046831455.db2.gz BTDVTYIXKYFIQK-NNMXDRDESA-N 2 0 343.559 4.426 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+][C@@H](C)C2)cc1OCCC ZINC000423363547 1047000419 /nfs/dbraw/zinc/00/04/19/1047000419.db2.gz AOKZDUYVNAJPGT-BQFCYCMXSA-N 2 0 334.504 4.055 20 0 EIADRP C[NH+]1CCC(CC[NH2+][C@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000497840869 1047117554 /nfs/dbraw/zinc/11/75/54/1047117554.db2.gz PDZKYVMRRZLLNF-QFIPXVFZSA-N 2 0 349.478 4.239 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCc3nc(Cl)ccc32)C1 ZINC000806131619 1047124266 /nfs/dbraw/zinc/12/42/66/1047124266.db2.gz LFQHFACZTQITPY-UXLLHSPISA-N 2 0 335.923 4.070 20 0 EIADRP Clc1ccc2c(n1)CC[C@@H]2[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000806129151 1047151146 /nfs/dbraw/zinc/15/11/46/1047151146.db2.gz CIQBUIOKDYWUIS-SFHVURJKSA-N 2 0 341.886 4.108 20 0 EIADRP Clc1ccc2c(n1)CC[C@@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000806128395 1047153608 /nfs/dbraw/zinc/15/36/08/1047153608.db2.gz QSSBCYQLDDGBII-SFHVURJKSA-N 2 0 341.886 4.108 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H]2CCc3nc(Cl)ccc32)CC1 ZINC000806142684 1047168896 /nfs/dbraw/zinc/16/88/96/1047168896.db2.gz FUGMRMRKKGZJSG-KRWDZBQOSA-N 2 0 335.923 4.070 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CCO1 ZINC000537406729 1047200296 /nfs/dbraw/zinc/20/02/96/1047200296.db2.gz IAAGTFBSTJYNCM-ZDFPQIBNSA-N 2 0 344.543 4.080 20 0 EIADRP CC[NH+](CC)CCC[N@@H+]1CCCCC[C@H]1C[C@H](O)c1cccs1 ZINC000788482683 1047213278 /nfs/dbraw/zinc/21/32/78/1047213278.db2.gz QLFJBWRDWADLMA-ROUUACIJSA-N 2 0 338.561 4.148 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCc2ccc(Cl)nc21 ZINC000788527564 1047227103 /nfs/dbraw/zinc/22/71/03/1047227103.db2.gz NKJQLBFDEFMYLO-GOSISDBHSA-N 2 0 343.902 4.352 20 0 EIADRP COc1ccc(C[NH2+]CCC[N@@H+]2CCCC[C@H]2C)c2ccccc12 ZINC000325425006 1047239683 /nfs/dbraw/zinc/23/96/83/1047239683.db2.gz XKJZUNXCWRALHW-QGZVFWFLSA-N 2 0 326.484 4.203 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCCc3c(O)cccc32)C1 ZINC000556236333 1047602141 /nfs/dbraw/zinc/60/21/41/1047602141.db2.gz QNECRCSOTKRISO-QKLQHJQFSA-N 2 0 330.516 4.117 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]CCCCC[NH+]1CCCC1)CC3 ZINC000556231886 1047608119 /nfs/dbraw/zinc/60/81/19/1047608119.db2.gz XYJYSHHKMTYCHW-GOSISDBHSA-N 2 0 339.527 4.189 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)cc1F ZINC000130298447 1047673964 /nfs/dbraw/zinc/67/39/64/1047673964.db2.gz RTZOLMFAXMUAAP-CABCVRRESA-N 2 0 332.385 4.098 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)CC2 ZINC000106479700 1047679898 /nfs/dbraw/zinc/67/98/98/1047679898.db2.gz FOHDMCYNPMYQQA-JOCHJYFZSA-N 2 0 338.495 4.103 20 0 EIADRP CC[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C1 ZINC000556408867 1047738809 /nfs/dbraw/zinc/73/88/09/1047738809.db2.gz HKGJGRUBRUMSHW-IEBWSBKVSA-N 2 0 330.516 4.218 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2cccc(-c3ccc(F)cc3)c2)CC1 ZINC001168305625 1047777702 /nfs/dbraw/zinc/77/77/02/1047777702.db2.gz QPCBYSSPBSWMHC-UHFFFAOYSA-N 2 0 326.459 4.455 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCN(C)[C@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000550665005 1047809754 /nfs/dbraw/zinc/80/97/54/1047809754.db2.gz CMRGHDSDGSEBPD-FPDPHYFHSA-N 2 0 344.449 4.493 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000556590217 1047830569 /nfs/dbraw/zinc/83/05/69/1047830569.db2.gz TWXKLECJMUBYKM-MCEIDBOGSA-N 2 0 344.543 4.289 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1 ZINC000556585047 1047832492 /nfs/dbraw/zinc/83/24/92/1047832492.db2.gz FODJKCKQWQREHU-CWFSZBLJSA-N 2 0 330.516 4.040 20 0 EIADRP C[N@H+](C1CCC([NH3+])CC1)[C@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171063035 1047905961 /nfs/dbraw/zinc/90/59/61/1047905961.db2.gz LAKUISFDEYPUSC-NRXISQOPSA-N 2 0 327.299 4.052 20 0 EIADRP C[NH+](C)CCCCC[NH2+][C@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171063085 1047909825 /nfs/dbraw/zinc/90/98/25/1047909825.db2.gz LLDIURHFIXHVPV-HNNXBMFYSA-N 2 0 329.315 4.172 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H]1CCc3cc(Cl)cc(Cl)c3C1)C2 ZINC001171064057 1047915561 /nfs/dbraw/zinc/91/55/61/1047915561.db2.gz QKFRMPOPSRKBAG-JONQDZQNSA-N 2 0 339.310 4.066 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1CCc3cc(Cl)cc(Cl)c3C1)C2 ZINC001171064059 1047917538 /nfs/dbraw/zinc/91/75/38/1047917538.db2.gz QKFRMPOPSRKBAG-LVQVYYBASA-N 2 0 339.310 4.066 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C[C@]2(C)CC2(Cl)Cl)CC1 ZINC000824771238 1047921822 /nfs/dbraw/zinc/92/18/22/1047921822.db2.gz AJLTYERRRZYLLC-BMFZPTHFSA-N 2 0 333.347 4.203 20 0 EIADRP CCCCC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)C(C)(C)C ZINC000808706538 1048052707 /nfs/dbraw/zinc/05/27/07/1048052707.db2.gz MNRRSSGCJKQRGO-AABGKKOBSA-N 2 0 338.580 4.339 20 0 EIADRP C[C@H](CCc1ccc(F)cc1F)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000556865747 1048070859 /nfs/dbraw/zinc/07/08/59/1048070859.db2.gz YKWNMRSVIPKPDK-OAHLLOKOSA-N 2 0 332.438 4.137 20 0 EIADRP FC1(F)CC([NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000556887851 1048101750 /nfs/dbraw/zinc/10/17/50/1048101750.db2.gz MGQXTUWWPAZQGA-YTQUADARSA-N 2 0 334.454 4.065 20 0 EIADRP Clc1ccc2c(c1)CC[C@@H]([NH2+]CC1CC[NH+](CC3CCC3)CC1)C2 ZINC001171107813 1048208489 /nfs/dbraw/zinc/20/84/89/1048208489.db2.gz CUCKZPJFFOLQBG-OAQYLSRUSA-N 2 0 346.946 4.299 20 0 EIADRP Clc1ccc2c(c1)CC[C@H]([NH2+]CC1CC[NH+](CC3CCC3)CC1)C2 ZINC001171107811 1048209390 /nfs/dbraw/zinc/20/93/90/1048209390.db2.gz CUCKZPJFFOLQBG-NRFANRHFSA-N 2 0 346.946 4.299 20 0 EIADRP COc1c(F)cc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)cc1Cl ZINC001143847339 1048226518 /nfs/dbraw/zinc/22/65/18/1048226518.db2.gz JAGJXAVOUMBLLL-UHFFFAOYSA-N 2 0 342.886 4.040 20 0 EIADRP FC1(F)C[C@@]12CC[NH+](CCCCCC[N@H+]1CC[C@@]3(CC3(F)F)C1)C2 ZINC000844470876 1048355595 /nfs/dbraw/zinc/35/55/95/1048355595.db2.gz MCXCVOUUDILSJK-HZPDHXFCSA-N 2 0 348.428 4.009 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+]([C@H]1CCc3cc(Cl)ccc3C1)CC2 ZINC001171135976 1048408377 /nfs/dbraw/zinc/40/83/77/1048408377.db2.gz QHTFMEDZCGSSHO-IBGZPJMESA-N 2 0 332.919 4.005 20 0 EIADRP Cc1cc(C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)cc(C)c1O ZINC000809611704 1048417646 /nfs/dbraw/zinc/41/76/46/1048417646.db2.gz LWQSZJMYVXOXLA-UHFFFAOYSA-N 2 0 330.516 4.143 20 0 EIADRP c1ccc(C[C@@H]2C[C@H]2[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499215469 1048422401 /nfs/dbraw/zinc/42/24/01/1048422401.db2.gz QDIBNRAWADIYQP-GNADVCDUSA-N 2 0 346.518 4.403 20 0 EIADRP Cc1ccccc1CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499247078 1048480144 /nfs/dbraw/zinc/48/01/44/1048480144.db2.gz UZHQWTBPJUPFIE-NUNAXRQHSA-N 2 0 334.507 4.323 20 0 EIADRP Cc1nc2ccc(C[N@@H+](C)Cc3ccc(C[NH+](C)C)cc3)cc2s1 ZINC000809737010 1048509923 /nfs/dbraw/zinc/50/99/23/1048509923.db2.gz BDGRFIIHSKHIOT-UHFFFAOYSA-N 2 0 339.508 4.298 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cccc(-c3cccnc3)c2)cc1 ZINC000809739114 1048510702 /nfs/dbraw/zinc/51/07/02/1048510702.db2.gz XVFCPHLFDRQVOX-UHFFFAOYSA-N 2 0 345.490 4.442 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)C/C=C\c2ccc(F)c(F)c2)cc1 ZINC000809738809 1048513815 /nfs/dbraw/zinc/51/38/15/1048513815.db2.gz KTNCHWGXUACSFM-PLNGDYQASA-N 2 0 330.422 4.172 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccccc2OC)CC1)CC1CC1 ZINC000557079967 1048522691 /nfs/dbraw/zinc/52/26/91/1048522691.db2.gz HGSXREBZDHHTCX-UHFFFAOYSA-N 2 0 330.516 4.029 20 0 EIADRP Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000815574886 1048538781 /nfs/dbraw/zinc/53/87/81/1048538781.db2.gz GCAOCGSDXIXNCY-KRWDZBQOSA-N 2 0 344.474 4.315 20 0 EIADRP Cc1ccc(C2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CCCC2)c(C)c1 ZINC000815657328 1048560066 /nfs/dbraw/zinc/56/00/66/1048560066.db2.gz WAXDOUNLMTZSDR-IHWFROFDSA-N 2 0 326.528 4.330 20 0 EIADRP Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3ccc([C@@H]4CCC[NH2+]4)cc3)c2c1 ZINC001171169626 1048623017 /nfs/dbraw/zinc/62/30/17/1048623017.db2.gz QMKMZAYAFHTIJW-KKSFZXQISA-N 2 0 333.479 4.253 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CC[C@@]3(C)C[C@@]3(F)Cl)CC2)C1 ZINC000846032153 1048800131 /nfs/dbraw/zinc/80/01/31/1048800131.db2.gz KEGOXONDNBXCAY-UBDQQSCGSA-N 2 0 330.919 4.324 20 0 EIADRP C[C@H]([NH2+]CC[C@]1(C)C[C@]1(F)Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000846036810 1048801247 /nfs/dbraw/zinc/80/12/47/1048801247.db2.gz MKEGJTXCXXRTEE-GDAAHCPNSA-N 2 0 338.898 4.191 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)Cc2cc(F)c(F)cc2Cl)CC1 ZINC001144726189 1048825722 /nfs/dbraw/zinc/82/57/22/1048825722.db2.gz HSIXHXWOELEBAT-UHFFFAOYSA-N 2 0 330.850 4.170 20 0 EIADRP Cc1nn(CC(C)C)c(Cl)c1[C@H]1CCC[N@@H+]1CCCCCC[NH3+] ZINC000846219420 1048843987 /nfs/dbraw/zinc/84/39/87/1048843987.db2.gz QLOXHHPYNDYYQU-MRXNPFEDSA-N 2 0 340.943 4.157 20 0 EIADRP CC[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(OC)c(C[NH+](CC)CC)c2)CCO1 ZINC000817586687 1049017912 /nfs/dbraw/zinc/01/79/12/1049017912.db2.gz QCCWXQRRBTVELF-FFZOFVMBSA-N 2 0 348.531 4.145 20 0 EIADRP C[C@H]([NH2+][C@H]1CCCc2sccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000134971064 1049047205 /nfs/dbraw/zinc/04/72/05/1049047205.db2.gz LVMVZDGGLLXSBL-KXBFYZLASA-N 2 0 344.524 4.417 20 0 EIADRP C[C@H]([NH2+][C@H]1CCCc2sccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000134969386 1049047302 /nfs/dbraw/zinc/04/73/02/1049047302.db2.gz VFOXEOGOZRPTLL-KXBFYZLASA-N 2 0 344.524 4.417 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCCc2sccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000134969363 1049048680 /nfs/dbraw/zinc/04/86/80/1049048680.db2.gz VFOXEOGOZRPTLL-DNVCBOLYSA-N 2 0 344.524 4.417 20 0 EIADRP [NH3+][C@H]1CCC[C@@H]1[NH2+]CCCN1c2ccccc2Sc2ccccc21 ZINC000817912693 1049058337 /nfs/dbraw/zinc/05/83/37/1049058337.db2.gz RDJXATOOSPLVSU-HOTGVXAUSA-N 2 0 339.508 4.149 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c2ccccc21 ZINC000817912512 1049059656 /nfs/dbraw/zinc/05/96/56/1049059656.db2.gz VHKANXZUNWIEED-UYBVGCJSSA-N 2 0 334.463 4.080 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](c1ccccc1)c1ccc2c(c1)CCCO2 ZINC000817912791 1049060033 /nfs/dbraw/zinc/06/00/33/1049060033.db2.gz XXUJGAVYBGSQDB-HTAPYJJXSA-N 2 0 338.495 4.208 20 0 EIADRP [NH3+]CCc1ccc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)cc1 ZINC000817948439 1049063911 /nfs/dbraw/zinc/06/39/11/1049063911.db2.gz JZUMXRCGXUTHIG-OAQYLSRUSA-N 2 0 326.459 4.348 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000817949543 1049064135 /nfs/dbraw/zinc/06/41/35/1049064135.db2.gz RAWABMYBUQWWNN-CABCVRRESA-N 2 0 339.508 4.079 20 0 EIADRP [NH3+]CCc1ccc(C[NH2+][C@H](c2ccccc2F)C2CCCC2)cc1 ZINC000817947341 1049064495 /nfs/dbraw/zinc/06/44/95/1049064495.db2.gz CMVHMMDVNUMMNG-NRFANRHFSA-N 2 0 326.459 4.348 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)ccc1SC(F)F ZINC000817957708 1049067466 /nfs/dbraw/zinc/06/74/66/1049067466.db2.gz OLHJUNIMQRUFIG-OLZOCXBDSA-N 2 0 344.471 4.050 20 0 EIADRP COc1cc(C)c([C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1C ZINC000817982854 1049076693 /nfs/dbraw/zinc/07/66/93/1049076693.db2.gz IRWCKGUGDSAVRA-FXAWDEMLSA-N 2 0 326.484 4.443 20 0 EIADRP CC(C)c1ccc(C2(O)CCC([NH2+]CCC[C@H]3CCC[NH2+]3)CC2)cc1 ZINC000817982190 1049078505 /nfs/dbraw/zinc/07/85/05/1049078505.db2.gz ZLTYWSVMQSRPCB-ITAUSPCMSA-N 2 0 344.543 4.062 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@H]2CCc3cccc(Cl)c3C2)CC1(C)C ZINC001170908928 1049176606 /nfs/dbraw/zinc/17/66/06/1049176606.db2.gz RANFQHXZUSOCBB-HNNXBMFYSA-N 2 0 334.935 4.438 20 0 EIADRP CCCC[NH+]1CCC(C[NH2+][C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170910996 1049186577 /nfs/dbraw/zinc/18/65/77/1049186577.db2.gz SUQYYKXWPHUPRX-GOSISDBHSA-N 2 0 334.935 4.299 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H]2CCCNc3ccccc32)CC1 ZINC000348094076 1049424924 /nfs/dbraw/zinc/42/49/24/1049424924.db2.gz FFDDOOAFNCSDOV-NRFANRHFSA-N 2 0 329.532 4.281 20 0 EIADRP Clc1ccccc1C[C@@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccoc1 ZINC000820807865 1049553363 /nfs/dbraw/zinc/55/33/63/1049553363.db2.gz SLJHQHGLYBTXAI-MGPUTAFESA-N 2 0 344.886 4.291 20 0 EIADRP Clc1ccccc1C[C@H](NC[C@@H]1CC[N@@H+](C2CC2)C1)c1ccoc1 ZINC000820807867 1049555577 /nfs/dbraw/zinc/55/55/77/1049555577.db2.gz SLJHQHGLYBTXAI-YWZLYKJASA-N 2 0 344.886 4.291 20 0 EIADRP CO[C@@H](C[NH2+][C@@H](C)c1cccc(C[NH+](C)C)c1)c1ccccc1Cl ZINC000820820751 1049557820 /nfs/dbraw/zinc/55/78/20/1049557820.db2.gz AZRUDBDXTMPIPS-YWZLYKJASA-N 2 0 346.902 4.440 20 0 EIADRP CCCCC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)c1ccccc1 ZINC000773069304 1049565611 /nfs/dbraw/zinc/56/56/11/1049565611.db2.gz NXNBSPAQALVQKW-BHDDXSALSA-N 2 0 344.543 4.275 20 0 EIADRP CCc1noc(C)c1[C@H](C)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000773099522 1049580316 /nfs/dbraw/zinc/58/03/16/1049580316.db2.gz REYILRUSPLUWAO-ZLPCBKJTSA-N 2 0 333.520 4.239 20 0 EIADRP FC1(F)CCC[C@H]1C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716704541 1049704353 /nfs/dbraw/zinc/70/43/53/1049704353.db2.gz GIHUGJXMZINIDQ-VJANTYMQSA-N 2 0 334.454 4.065 20 0 EIADRP [NH3+]CC1CC[NH+](Cc2ccc(NCC3(c4ccccc4)CC3)cc2)CC1 ZINC001171465270 1049716124 /nfs/dbraw/zinc/71/61/24/1049716124.db2.gz KKKJVBOQGWTYGE-UHFFFAOYSA-N 2 0 349.522 4.001 20 0 EIADRP Fc1cc2c(cc1F)C[C@@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)CC2 ZINC001171486351 1049716298 /nfs/dbraw/zinc/71/62/98/1049716298.db2.gz BPLIABWPBCWRNO-OALUTQOASA-N 2 0 348.481 4.163 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H](c2c(Cl)cccc2Cl)C2CC2)CC1 ZINC000813325614 1049745712 /nfs/dbraw/zinc/74/57/12/1049745712.db2.gz HRCHXBQKMLNIJD-KRWDZBQOSA-N 2 0 327.299 4.376 20 0 EIADRP Cc1cccc2c1CC[C@@H]([NH2+]CC1CC[NH+](C3CCCCC3)CC1)C2 ZINC001171554236 1049753776 /nfs/dbraw/zinc/75/37/76/1049753776.db2.gz YSCBYJLXBSTSRK-OAQYLSRUSA-N 2 0 340.555 4.487 20 0 EIADRP Cc1cccc2c1CC[C@H]([NH+]1CCC([N@H+](C)Cc3ccccc3)CC1)C2 ZINC001171571133 1049758582 /nfs/dbraw/zinc/75/85/82/1049758582.db2.gz SFHWRLHZTUYAIL-QHCPKHFHSA-N 2 0 348.534 4.449 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CC2(Cc3ccccc3F)CC2)CC1(C)C ZINC001171630963 1049761441 /nfs/dbraw/zinc/76/14/41/1049761441.db2.gz SCGLCPPKZKZFIU-UHFFFAOYSA-N 2 0 332.507 4.389 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CCc2c(F)cccc2Cl)CC1(C)C ZINC001171614385 1049765831 /nfs/dbraw/zinc/76/58/31/1049765831.db2.gz YQWIXRUEJZNQPC-UHFFFAOYSA-N 2 0 326.887 4.263 20 0 EIADRP Cc1ccc2c(CC[NH3+])cn(C3CC(C)(C)[NH+](C)C(C)(C)C3)c2c1 ZINC001171621725 1049766099 /nfs/dbraw/zinc/76/60/99/1049766099.db2.gz PHGZPKKYXMDTHP-UHFFFAOYSA-N 2 0 327.516 4.275 20 0 EIADRP C[NH+]1C(C)(C)CC(NC2CC[NH+](CC3CCCCC3)CC2)CC1(C)C ZINC001171626041 1049767744 /nfs/dbraw/zinc/76/77/44/1049767744.db2.gz TZSXCGPTUKOIOQ-UHFFFAOYSA-N 2 0 349.607 4.272 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@@H](c2ccnc(Cl)c2)C2CC2)CC1(C)C ZINC001171624484 1049768538 /nfs/dbraw/zinc/76/85/38/1049768538.db2.gz SXNRJVRWQZOCRK-QGZVFWFLSA-N 2 0 335.923 4.427 20 0 EIADRP C[C@@H]([NH3+])Cc1cn([C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171733308 1049786794 /nfs/dbraw/zinc/78/67/94/1049786794.db2.gz QEARQCZLYKTWFO-OPYAIIAOSA-N 2 0 347.506 4.367 20 0 EIADRP C[C@H]([NH3+])c1cn([C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171740732 1049801387 /nfs/dbraw/zinc/80/13/87/1049801387.db2.gz LEFBZQQWOYYPFO-ZIFCJYIRSA-N 2 0 333.479 4.497 20 0 EIADRP C[C@H]([NH3+])c1cn([C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171740725 1049801670 /nfs/dbraw/zinc/80/16/70/1049801670.db2.gz LEFBZQQWOYYPFO-AOIWGVFYSA-N 2 0 333.479 4.497 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+]([C@H]2Cc3cccc(F)c3C2)C2CCCCC2)CC1 ZINC001171786025 1049805010 /nfs/dbraw/zinc/80/50/10/1049805010.db2.gz WNEXOCXEPJGJGN-WDSOQIARSA-N 2 0 330.491 4.198 20 0 EIADRP Fc1cccc2c1C[C@@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)CC2 ZINC001170997065 1049808202 /nfs/dbraw/zinc/80/82/02/1049808202.db2.gz QMHYUUJDASMPIQ-OALUTQOASA-N 2 0 330.491 4.023 20 0 EIADRP CC(C)[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccc(C(F)(F)F)cc2)[C@@H](C)C1 ZINC001171961712 1049824330 /nfs/dbraw/zinc/82/43/30/1049824330.db2.gz BGGPRKUOGFDREG-DAYGRLMNSA-N 2 0 342.449 4.345 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC001171962437 1049825294 /nfs/dbraw/zinc/82/52/94/1049825294.db2.gz FBCBWOWXSOAKRI-NXVRBGIVSA-N 2 0 342.449 4.346 20 0 EIADRP C[C@@]1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCS1 ZINC000245686796 1049825526 /nfs/dbraw/zinc/82/55/26/1049825526.db2.gz JQRNVYDRXVKTCH-YRPNKDGESA-N 2 0 330.541 4.057 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)n1cc(CC[NH3+])c2c[nH+]ccc21 ZINC001171967260 1049827734 /nfs/dbraw/zinc/82/77/34/1049827734.db2.gz ZOBSSLMYGACTQC-CYBMUJFWSA-N 2 0 347.384 4.360 20 0 EIADRP CN1CCC([N@H+](C2CCCC2)[C@H]2CCc3cccc(F)c3C2)CC1 ZINC001171010077 1049828715 /nfs/dbraw/zinc/82/87/15/1049828715.db2.gz KOKSVYVXQGWFKN-IBGZPJMESA-N 2 0 330.491 4.022 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2occc2C)ccc1OC ZINC000813882853 1049830865 /nfs/dbraw/zinc/83/08/65/1049830865.db2.gz MXPHLDBCVVPFCN-INIZCTEOSA-N 2 0 330.472 4.289 20 0 EIADRP CC1(C)C[C@@H]([NH2+][C@H]2CCCc3ncccc32)CC[N@@H+]1Cc1ccccc1 ZINC001171982338 1049838338 /nfs/dbraw/zinc/83/83/38/1049838338.db2.gz HJOUFBCACLODOJ-UGKGYDQZSA-N 2 0 349.522 4.492 20 0 EIADRP CC1(C)C[C@H]([NH+]2CC[C@@]3(C2)CCCCO3)CC[N@@H+]1Cc1ccccc1 ZINC001171981729 1049838523 /nfs/dbraw/zinc/83/85/23/1049838523.db2.gz NGCUDPYJFMHABE-IFMALSPDSA-N 2 0 342.527 4.075 20 0 EIADRP Fc1cccc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000245724108 1049838556 /nfs/dbraw/zinc/83/85/56/1049838556.db2.gz PCXDOLCPOOGIHU-KOUNCHBCSA-N 2 0 338.470 4.153 20 0 EIADRP CCOC1CCC([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171980642 1049839321 /nfs/dbraw/zinc/83/93/21/1049839321.db2.gz SHXZTRVAZQKWKU-NYLDSWQDSA-N 2 0 344.543 4.367 20 0 EIADRP CC1(C)C[C@H]([NH+]2CC[C@H](c3cccnc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171985385 1049839909 /nfs/dbraw/zinc/83/99/09/1049839909.db2.gz WAWRLKIWNLBWIJ-FCHUYYIVSA-N 2 0 349.522 4.314 20 0 EIADRP CC(C)(C)[PH+](CCC[NH2+][C@@H]1CCN(C2CC2)C(=O)C1)C(C)(C)C ZINC001172016219 1049842289 /nfs/dbraw/zinc/84/22/89/1049842289.db2.gz SAGYSCXZCAZQRE-OAHLLOKOSA-N 2 0 340.492 4.198 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]CCCc2ccccn2)C3)cc1 ZINC001172074494 1049843837 /nfs/dbraw/zinc/84/38/37/1049843837.db2.gz VZZQPWWXDFVICF-WBDAEOGXSA-N 2 0 349.522 4.190 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CC[C@H](OCc3ccccc3)CC1)C2 ZINC001172099621 1049849586 /nfs/dbraw/zinc/84/95/86/1049849586.db2.gz LRLYPNARXJVHFH-UZBCKPFNSA-N 2 0 342.527 4.119 20 0 EIADRP CCC1([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CCOCC1 ZINC001172070112 1049852359 /nfs/dbraw/zinc/85/23/59/1049852359.db2.gz MJZVUIBHXBMKTO-MZADTFQBSA-N 2 0 342.527 4.121 20 0 EIADRP FC1(F)CC[C@@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172068236 1049852636 /nfs/dbraw/zinc/85/26/36/1049852636.db2.gz PSESVDKMJHPNCN-MKXGPGLRSA-N 2 0 334.454 4.350 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC1(Cc3ccc(F)cc3)CCC1)C2 ZINC001172111981 1049858596 /nfs/dbraw/zinc/85/85/96/1049858596.db2.gz YMQFVLLVWLSGFJ-ACDBMABISA-N 2 0 330.491 4.143 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@H]2CCc3c(Cl)cccc3C2)CC1(C)C ZINC001171021344 1049861050 /nfs/dbraw/zinc/86/10/50/1049861050.db2.gz BGYRGBYOJJKIQK-HNNXBMFYSA-N 2 0 334.935 4.438 20 0 EIADRP CCCC[NH+]1CCC(C[NH2+][C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171023405 1049864984 /nfs/dbraw/zinc/86/49/84/1049864984.db2.gz WONWEOMYAWHVNB-GOSISDBHSA-N 2 0 334.935 4.299 20 0 EIADRP COCCC[NH+]1CCC([NH2+]Cc2ccc(-c3ccsc3)cc2)CC1 ZINC001172246520 1049872337 /nfs/dbraw/zinc/87/23/37/1049872337.db2.gz LWUSHCQAKJESBF-UHFFFAOYSA-N 2 0 344.524 4.006 20 0 EIADRP CC(C)C[NH+]1CCC(C[NH2+][C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171030022 1049875199 /nfs/dbraw/zinc/87/51/99/1049875199.db2.gz KODDRGSJHSWHAJ-SFHVURJKSA-N 2 0 334.935 4.155 20 0 EIADRP CC[C@@H](C)OCC[C@@H](C)[NH2+]CC1CC[NH+](CC2CCCCC2)CC1 ZINC001172326357 1049879963 /nfs/dbraw/zinc/87/99/63/1049879963.db2.gz CRTCDMXQECZUGS-RTBURBONSA-N 2 0 338.580 4.462 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC001172575653 1049941793 /nfs/dbraw/zinc/94/17/93/1049941793.db2.gz JOBGNSNWNYYBAT-ZIAGYGMSSA-N 2 0 344.877 4.261 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(CN2CCO[C@@H](C)C2)c1)c1cccs1 ZINC000247198782 1050015696 /nfs/dbraw/zinc/01/56/96/1050015696.db2.gz WCXUCJDFWSVSNH-QFBILLFUSA-N 2 0 344.524 4.210 20 0 EIADRP Cc1nc2c(s1)[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)CCC2 ZINC000247222745 1050017711 /nfs/dbraw/zinc/01/77/11/1050017711.db2.gz XVXAWIHLAXMMKM-BFYDXBDKSA-N 2 0 335.561 4.177 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](CC)c2ccccc2OC(F)F)C1 ZINC000247239818 1050018002 /nfs/dbraw/zinc/01/80/02/1050018002.db2.gz YVJHJHZGSCRUKS-GDBMZVCRSA-N 2 0 326.431 4.061 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)ccc1F ZINC000248410783 1050055030 /nfs/dbraw/zinc/05/50/30/1050055030.db2.gz YGYSTDJZWHMUBS-ZOBUZTSGSA-N 2 0 334.479 4.138 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1cc(Br)cs1 ZINC000248656488 1050071153 /nfs/dbraw/zinc/07/11/53/1050071153.db2.gz DETRVVSPYMJRFH-WCFLWFBJSA-N 2 0 331.323 4.034 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCc1nc(C2CCCCC2)cs1 ZINC000090046552 1050151959 /nfs/dbraw/zinc/15/19/59/1050151959.db2.gz MALQIVZUPVOWJJ-VYDXJSESSA-N 2 0 335.561 4.052 20 0 EIADRP C[C@]1(C[NH3+])CCC[N@H+](CCCc2ccc(Cl)c(Cl)c2)CC1 ZINC001206295267 1050160107 /nfs/dbraw/zinc/16/01/07/1050160107.db2.gz LURHAFVXERVNIE-KRWDZBQOSA-N 2 0 329.315 4.377 20 0 EIADRP CC[NH+](CC)[C@@H](CNC1CC[NH+](C2CCCCC2)CC1)CC(C)C ZINC001177209086 1050161087 /nfs/dbraw/zinc/16/10/87/1050161087.db2.gz HKCSSNUQYNTZEU-OAQYLSRUSA-N 2 0 337.596 4.130 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC001172838082 1050163755 /nfs/dbraw/zinc/16/37/55/1050163755.db2.gz SHGDDMSBDFBIDK-CQSZACIVSA-N 2 0 334.866 4.262 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([N@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828348 1050165950 /nfs/dbraw/zinc/16/59/50/1050165950.db2.gz LDVPTFAARPEPCI-DNVJHFABSA-N 2 0 349.522 4.019 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC001172836812 1050171828 /nfs/dbraw/zinc/17/18/28/1050171828.db2.gz HSJWYIQHWMTHHZ-OAHLLOKOSA-N 2 0 326.887 4.122 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2cncc3ccccc32)C1 ZINC001177289661 1050177761 /nfs/dbraw/zinc/17/77/61/1050177761.db2.gz HLYQWRQWYHWYCN-HDICACEKSA-N 2 0 325.500 4.083 20 0 EIADRP CCOc1cccc(F)c1C[NH2+]CCCC[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC001177290063 1050178241 /nfs/dbraw/zinc/17/82/41/1050178241.db2.gz LQDNFICWAQTSCP-IRXDYDNUSA-N 2 0 336.495 4.072 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ccc3ncccc3c2)C1 ZINC001177290925 1050178425 /nfs/dbraw/zinc/17/84/25/1050178425.db2.gz ZNMWOQZJKSCOQE-ROUUACIJSA-N 2 0 325.500 4.083 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2c(Cl)cccc2N(C)C)C1 ZINC001177299709 1050179501 /nfs/dbraw/zinc/17/95/01/1050179501.db2.gz ZTVCSEKEBQDAAK-MRXNPFEDSA-N 2 0 337.939 4.008 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]CC2CCCCCC2)cc1 ZINC001177294990 1050180321 /nfs/dbraw/zinc/18/03/21/1050180321.db2.gz VPJQSURCUHTDQL-UHFFFAOYSA-N 2 0 332.532 4.467 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cccc(F)c1OC(F)F ZINC001177299555 1050180374 /nfs/dbraw/zinc/18/03/74/1050180374.db2.gz VJZFILAIVUSLGC-CQSZACIVSA-N 2 0 344.421 4.171 20 0 EIADRP CC(C)[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2c(F)cccc2Cl)[C@@H](C)C1 ZINC001172849530 1050188541 /nfs/dbraw/zinc/18/85/41/1050188541.db2.gz NPSIXVIBKSUVMT-IYOUNJFTSA-N 2 0 326.887 4.119 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[NH2+]CCCCC[NH+]1CCCC1 ZINC001172861361 1050198681 /nfs/dbraw/zinc/19/86/81/1050198681.db2.gz QNQASLPDYIVWLJ-OAHLLOKOSA-N 2 0 326.887 4.266 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC001172860436 1050198731 /nfs/dbraw/zinc/19/87/31/1050198731.db2.gz DXHHJNIJMMAURS-TUBUQKNSSA-N 2 0 326.887 4.120 20 0 EIADRP C[C@@H](CSc1ccc(Cl)cc1)[NH2+]C1CCC([NH+](C)C)CC1 ZINC001172882314 1050226575 /nfs/dbraw/zinc/22/65/75/1050226575.db2.gz NOFHXXCMFZSXDX-JEYLPNPQSA-N 2 0 326.937 4.283 20 0 EIADRP CC[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)CC1 ZINC001177673904 1050274549 /nfs/dbraw/zinc/27/45/49/1050274549.db2.gz BMGWQLWKDLZXQU-UYAOXDASSA-N 2 0 332.532 4.466 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@@H](C[NH2+]Cc3cccc4ccccc43)C2)cc1 ZINC001177668927 1050275015 /nfs/dbraw/zinc/27/50/15/1050275015.db2.gz KKSRWJJZCJEDFP-NRFANRHFSA-N 2 0 344.502 4.494 20 0 EIADRP COc1cc(C[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)cc2ccccc21 ZINC001177823491 1050298481 /nfs/dbraw/zinc/29/84/81/1050298481.db2.gz VELWUQKCZMWDFK-FQEVSTJZSA-N 2 0 328.500 4.304 20 0 EIADRP CC[NH+](CC)C1CCC(n2cc(CCC[NH3+])c3ccccc32)CC1 ZINC001173101950 1050302520 /nfs/dbraw/zinc/30/25/20/1050302520.db2.gz QLWBCDQSIJVHQJ-UHFFFAOYSA-N 2 0 327.516 4.358 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H]2CCC[C@@H]2OCc2ccccc2)CC1 ZINC001173104423 1050304396 /nfs/dbraw/zinc/30/43/96/1050304396.db2.gz OKLTWKPGGJMEOZ-UJKMTWAASA-N 2 0 344.543 4.367 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](c2ccnc(Cl)c2)C2CC2)CC1 ZINC001173102825 1050305302 /nfs/dbraw/zinc/30/53/02/1050305302.db2.gz BPZBXHJKUCPNGR-TVPLGVNVSA-N 2 0 335.923 4.429 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2(c3ccc(OC)cc3)CCC2)CC1 ZINC001173105191 1050305963 /nfs/dbraw/zinc/30/59/63/1050305963.db2.gz BYRQHODBJJLHCU-UHFFFAOYSA-N 2 0 330.516 4.317 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](c2cccnc2Cl)C2CC2)CC1 ZINC001173110651 1050309920 /nfs/dbraw/zinc/30/99/20/1050309920.db2.gz QLLAVTAWPAWMAE-LEOMRAHMSA-N 2 0 335.923 4.429 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+]C2CCC(Oc3ccccc3)CC2)cc1 ZINC001173197124 1050342287 /nfs/dbraw/zinc/34/22/87/1050342287.db2.gz BXZPVFWWDNNTMX-UHFFFAOYSA-N 2 0 338.495 4.228 20 0 EIADRP [NH3+]CCC[C@H]1CCCC[N@@H+](C2CCC(Oc3ccccc3)CC2)C1 ZINC001173201970 1050344125 /nfs/dbraw/zinc/34/41/25/1050344125.db2.gz KUVONQWGPBJSRA-LWEYNCJUSA-N 2 0 330.516 4.218 20 0 EIADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2ccc(C(F)(F)F)cc2Cl)CC1 ZINC001206311177 1050348232 /nfs/dbraw/zinc/34/82/32/1050348232.db2.gz KPQNBEJNQXKSGK-OAHLLOKOSA-N 2 0 334.813 4.310 20 0 EIADRP CC[NH+]1C[C@@H]2C[NH+]([C@@H](C)CC(c3ccccc3)c3ccccc3)C[C@H]2C1 ZINC001173213753 1050372787 /nfs/dbraw/zinc/37/27/87/1050372787.db2.gz HONRGJXYNZYDOQ-WWPVKYPJSA-N 2 0 348.534 4.481 20 0 EIADRP CC[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CCC[C@@H](N(C)Cc4ccccn4)[C@H]3C2)C1 ZINC001173276629 1050405578 /nfs/dbraw/zinc/40/55/78/1050405578.db2.gz CLORNAMJBCZDRP-MMGCJVFTSA-N 2 0 341.543 4.193 20 0 EIADRP C[C@H]([NH2+]Cc1cccc2c1CCC2)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001178331332 1050436417 /nfs/dbraw/zinc/43/64/17/1050436417.db2.gz QCNMOXNMEMRELY-AVRDEDQJSA-N 2 0 334.507 4.176 20 0 EIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1Cl ZINC000092856870 1050481162 /nfs/dbraw/zinc/48/11/62/1050481162.db2.gz IJTIPWHREAGSDW-HNNXBMFYSA-N 2 0 329.875 4.302 20 0 EIADRP CCOC(=O)C[C@H]1CC[C@@H]([NH2+]CCCCCCCCCCC[NH3+])C1 ZINC001173654090 1050536237 /nfs/dbraw/zinc/53/62/37/1050536237.db2.gz RLVMMZGPRJMAIA-RBUKOAKNSA-N 2 0 340.552 4.168 20 0 EIADRP C[NH+](C)[C@H]1CCC[C@@H]([NH2+]C2CCC3(CCc4ccccc43)CC2)C1 ZINC001173685331 1050538992 /nfs/dbraw/zinc/53/89/92/1050538992.db2.gz RUYBEULXGYOPCW-FGNUKQJGSA-N 2 0 326.528 4.276 20 0 EIADRP CC[C@H]1CCC[C@@H]1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC001178748670 1050541820 /nfs/dbraw/zinc/54/18/20/1050541820.db2.gz WDLQUCHGRLPIKM-VQTJNVASSA-N 2 0 330.516 4.077 20 0 EIADRP COC(=O)c1ccc(C[C@H](C)[NH2+]CC[PH+](C(C)C)C(C)C)cc1 ZINC001173724441 1050555875 /nfs/dbraw/zinc/55/58/75/1050555875.db2.gz YUXXYYCCCKARKC-INIZCTEOSA-N 2 0 337.444 4.293 20 0 EIADRP CC(C)(CC[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)C1CC1 ZINC001178818430 1050575224 /nfs/dbraw/zinc/57/52/24/1050575224.db2.gz YFTRDGYPHGVNEV-UHFFFAOYSA-N 2 0 330.516 4.077 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc3nc(Cl)ccc3s2)C[C@@H]1C ZINC001204236532 1050615260 /nfs/dbraw/zinc/61/52/60/1050615260.db2.gz HVJZJFPMJRXJAF-STQMWFEESA-N 2 0 337.920 4.254 20 0 EIADRP Clc1ccc(C[NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)cn1 ZINC001179277528 1050668403 /nfs/dbraw/zinc/66/84/03/1050668403.db2.gz JCYQCAKEGSUAOW-UHFFFAOYSA-N 2 0 343.902 4.127 20 0 EIADRP C[C@H]1CC[C@@H]([NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CS1 ZINC001179278752 1050671551 /nfs/dbraw/zinc/67/15/51/1050671551.db2.gz ZFEDYXIRDIDVRZ-FXAWDEMLSA-N 2 0 332.557 4.162 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2cccc(C)n2)ccc1OC ZINC000182524209 1050734888 /nfs/dbraw/zinc/73/48/88/1050734888.db2.gz GJXIFVQMRICQPL-QGZVFWFLSA-N 2 0 341.499 4.091 20 0 EIADRP CC[NH+](CC)CC[C@H]([NH2+][C@@H]1CC[C@H]2COCC[C@@H]2C1)c1ccccc1 ZINC001179805562 1050783585 /nfs/dbraw/zinc/78/35/85/1050783585.db2.gz KBJKKAICFGUQIW-MBDNFAEBSA-N 2 0 344.543 4.254 20 0 EIADRP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1cc2ccnc(Cl)c2s1 ZINC001179830095 1050788382 /nfs/dbraw/zinc/78/83/82/1050788382.db2.gz LBDJKFZKWLCWGI-GFCCVEGCSA-N 2 0 325.909 4.160 20 0 EIADRP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1cc(C)c(OC(F)F)c(C)c1 ZINC001179824817 1050801818 /nfs/dbraw/zinc/80/18/18/1050801818.db2.gz HBVJYKFSUVTIJG-HNNXBMFYSA-N 2 0 328.447 4.115 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+]CCC(C)(C)c2ccccc2)cc1 ZINC000619779155 1050901068 /nfs/dbraw/zinc/90/10/68/1050901068.db2.gz UJINFVKSFYOKFQ-UHFFFAOYSA-N 2 0 340.511 4.085 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+]Cc2ccc(F)cc2C(F)(F)F)CC1 ZINC001203282888 1050926705 /nfs/dbraw/zinc/92/67/05/1050926705.db2.gz LDENOOURIHKNRB-UHFFFAOYSA-N 2 0 346.412 4.445 20 0 EIADRP Cc1cscc1C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716629531 1051100157 /nfs/dbraw/zinc/10/01/57/1051100157.db2.gz ZQGXIMUYBOPXAN-IHPCNDPISA-N 2 0 326.509 4.199 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCc2ccco2)cc1C[NH+]1CCCCC1 ZINC000775367156 1051136602 /nfs/dbraw/zinc/13/66/02/1051136602.db2.gz WQWLIHCANQXWAW-QGZVFWFLSA-N 2 0 342.483 4.167 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(OC)c(Cl)c2)CC1 ZINC001190408448 1051176844 /nfs/dbraw/zinc/17/68/44/1051176844.db2.gz YZLCPEAHODHDTK-UHFFFAOYSA-N 2 0 338.923 4.293 20 0 EIADRP C[C@@H](C[NH2+]C[C@H]1CCC[N@@H+]1C1CCCCC1)c1cc(F)cc(F)c1 ZINC001181276060 1051195993 /nfs/dbraw/zinc/19/59/93/1051195993.db2.gz IKTYXRWDARYOQY-MGPUTAFESA-N 2 0 336.470 4.455 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H](C)C[C@H]2CCOC2)ccc1OC ZINC000775402070 1051235653 /nfs/dbraw/zinc/23/56/53/1051235653.db2.gz YQIDAHJZTHNQGC-OKZBNKHCSA-N 2 0 348.531 4.003 20 0 EIADRP C[C@@H](NC1(C[NH2+][C@H](C)c2cccs2)CCOCC1)c1ccccc1 ZINC000153917254 1051246710 /nfs/dbraw/zinc/24/67/10/1051246710.db2.gz KVYWEWSIDCLBLB-IAGOWNOFSA-N 2 0 344.524 4.299 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)C1 ZINC000620754058 1051273352 /nfs/dbraw/zinc/27/33/52/1051273352.db2.gz SOFXTINHXNEHQK-INIZCTEOSA-N 2 0 346.421 4.189 20 0 EIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(N(C)c3ccccc3)cc2)C1 ZINC000620762237 1051284749 /nfs/dbraw/zinc/28/47/49/1051284749.db2.gz WAZYHKJJEHUQPP-HXUWFJFHSA-N 2 0 337.511 4.274 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CC2(C3CC3)CC2)ccc1OC ZINC000775416795 1051291938 /nfs/dbraw/zinc/29/19/38/1051291938.db2.gz RLMPKXVCDOLEEZ-INIZCTEOSA-N 2 0 330.516 4.378 20 0 EIADRP CC(C)(C)c1cccc(OCCC[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)c1 ZINC001191122417 1051358038 /nfs/dbraw/zinc/35/80/38/1051358038.db2.gz QMHJYWSMSPJNQC-IBGZPJMESA-N 2 0 344.543 4.171 20 0 EIADRP Cc1nc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cs1 ZINC000269429543 1051434839 /nfs/dbraw/zinc/43/48/39/1051434839.db2.gz OZVHGUGCSKTGTQ-OAHLLOKOSA-N 2 0 329.513 4.014 20 0 EIADRP CC1(C)CC([NH2+]Cc2cc(Cl)cc3cccnc32)CC(C)(C)[NH2+]1 ZINC000155616642 1051437242 /nfs/dbraw/zinc/43/72/42/1051437242.db2.gz CNMAHNPKAAFWIG-UHFFFAOYSA-N 2 0 331.891 4.287 20 0 EIADRP C/C=C/COc1ccc(CC[C@H](C)[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC001182248545 1051440437 /nfs/dbraw/zinc/44/04/37/1051440437.db2.gz ACTTZACVUAOEKS-CFQKCQFKSA-N 2 0 344.543 4.284 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCc2c(Cl)cccc2Cl)C[C@@H]1C ZINC001191417634 1051453554 /nfs/dbraw/zinc/45/35/54/1051453554.db2.gz PZSKEHNRLJOPMB-KBPBESRZSA-N 2 0 329.315 4.341 20 0 EIADRP Cc1ccc(COc2ccc(C[NH2+][C@@H](C)CC[NH+](C)C)cc2)cc1 ZINC000620948205 1051510913 /nfs/dbraw/zinc/51/09/13/1051510913.db2.gz YARMDEPWDCZDQO-SFHVURJKSA-N 2 0 326.484 4.004 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc2c(c1)OCCCO2 ZINC000157896617 1051682235 /nfs/dbraw/zinc/68/22/35/1051682235.db2.gz LBPMRJVUTZSQRU-ROUUACIJSA-N 2 0 346.515 4.153 20 0 EIADRP C[C@H]1c2ccccc2C[C@H]1[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1 ZINC001182805609 1051701240 /nfs/dbraw/zinc/70/12/40/1051701240.db2.gz FGOPHISSJHJAOS-QPAOKJHLSA-N 2 0 326.528 4.348 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000158142361 1051719094 /nfs/dbraw/zinc/71/90/94/1051719094.db2.gz BJFQOAQJUJBIEY-MSOLQXFVSA-N 2 0 338.495 4.355 20 0 EIADRP CC(C)O[C@@H](C[N@H+](C)CCCC[NH+]1CCCCC1)c1ccccc1 ZINC001175687638 1051730529 /nfs/dbraw/zinc/73/05/29/1051730529.db2.gz JSAARRBQGUWRLW-NRFANRHFSA-N 2 0 332.532 4.351 20 0 EIADRP C[C@]1(C[NH3+])CCCCN(Cc2cccc(C(F)(F)F)c2Cl)C1 ZINC001206550060 1051757680 /nfs/dbraw/zinc/75/76/80/1051757680.db2.gz UMTOOMKURDMAEJ-OAHLLOKOSA-N 2 0 334.813 4.310 20 0 EIADRP CCC1([NH+]2CCCC2)CCN(C/C=C/c2ccc(F)c(F)c2)CC1 ZINC001183238841 1051810209 /nfs/dbraw/zinc/81/02/09/1051810209.db2.gz QHTAXWFXPAHODJ-AATRIKPKSA-N 2 0 334.454 4.318 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cncc(Cl)c2)CC1)CC1CC1 ZINC000621272368 1051815357 /nfs/dbraw/zinc/81/53/57/1051815357.db2.gz OJAPMDWKVSBRRL-UHFFFAOYSA-N 2 0 335.923 4.069 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CCO[C@H]3c3ccccc3)CC2)C1 ZINC001183312258 1051824722 /nfs/dbraw/zinc/82/47/22/1051824722.db2.gz HDCXIZBFLRTFFU-YCZSINBZSA-N 2 0 342.527 4.149 20 0 EIADRP CC[NH+]1CCC(C[NH+]2CCC(Cc3ccccc3Cl)CC2)CC1 ZINC001183364006 1051828710 /nfs/dbraw/zinc/82/87/10/1051828710.db2.gz ROYKKBHAKMNJGW-UHFFFAOYSA-N 2 0 334.935 4.326 20 0 EIADRP Cc1cc(C)cc(C[NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)c1 ZINC000716715829 1051832286 /nfs/dbraw/zinc/83/22/86/1051832286.db2.gz YCFMFOGATKESSX-VABKMULXSA-N 2 0 334.507 4.446 20 0 EIADRP CC(C)C[N@H+](C/C=C/c1ccc(F)c(F)c1)CC1CC[NH+](C)CC1 ZINC001183463220 1051846201 /nfs/dbraw/zinc/84/62/01/1051846201.db2.gz CKQLGNKNVBCZRV-SNAWJCMRSA-N 2 0 336.470 4.278 20 0 EIADRP C[NH+](C)CCCCC(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C ZINC001184061317 1051946984 /nfs/dbraw/zinc/94/69/84/1051946984.db2.gz KGTNUPNIVMLDMQ-UHFFFAOYSA-N 2 0 330.497 4.304 20 0 EIADRP C[C@@]1(c2ccccc2)CC[C@H]([NH2+]C2CCC(C)([NH+]3CCC3)CC2)C1 ZINC001184135540 1051952203 /nfs/dbraw/zinc/95/22/03/1051952203.db2.gz RMDCHYCIIHSBON-UTZODRGISA-N 2 0 326.528 4.493 20 0 EIADRP C[C@@H]1CC[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CC[C@@H]1C[NH3+] ZINC001205638871 1051968225 /nfs/dbraw/zinc/96/82/25/1051968225.db2.gz SRRAVQMSWDBTCG-ZYHUDNBSSA-N 2 0 335.706 4.454 20 0 EIADRP Cc1ccc(C[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)c(C)c1 ZINC000164494787 1052030649 /nfs/dbraw/zinc/03/06/49/1052030649.db2.gz ZZYIWQLTDNRIQN-GOSISDBHSA-N 2 0 326.484 4.095 20 0 EIADRP Cc1nccn1CCCC[NH2+][C@H](C)c1nc(-c2ccccc2)cs1 ZINC000164696986 1052037841 /nfs/dbraw/zinc/03/78/41/1052037841.db2.gz GANOEQXCNQOOJL-OAHLLOKOSA-N 2 0 340.496 4.446 20 0 EIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H]2CCCc3sccc32)cc1 ZINC000165190220 1052053464 /nfs/dbraw/zinc/05/34/64/1052053464.db2.gz RKHRSIUAYGPWLC-IBGZPJMESA-N 2 0 344.524 4.246 20 0 EIADRP CC(C)Cc1ccc(C[N@H+]2C[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC001193991508 1052054331 /nfs/dbraw/zinc/05/43/31/1052054331.db2.gz VSLMXGKPNKDCHG-PSWAGMNNSA-N 2 0 348.534 4.449 20 0 EIADRP CC(C)Oc1cccc([C@@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000298229881 1052111073 /nfs/dbraw/zinc/11/10/73/1052111073.db2.gz BEGWVYFKOZRRCD-QGZVFWFLSA-N 2 0 339.483 4.188 20 0 EIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@H](c2ccccc2)C2CC2)cc1 ZINC000171128073 1052396344 /nfs/dbraw/zinc/39/63/44/1052396344.db2.gz WFLXVCVWDZCXBJ-JOCHJYFZSA-N 2 0 338.495 4.258 20 0 EIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H](c2ccccc2)C2CC2)cc1 ZINC000171128066 1052396953 /nfs/dbraw/zinc/39/69/53/1052396953.db2.gz WFLXVCVWDZCXBJ-QFIPXVFZSA-N 2 0 338.495 4.258 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000671298594 1052590589 /nfs/dbraw/zinc/59/05/89/1052590589.db2.gz RNQHKZKSIOUJQD-ZWKOTPCHSA-N 2 0 338.417 4.193 20 0 EIADRP COc1cc([C@@H](C)N[C@@H]2CC[N@H+](C)C(C)(C)C2)ccc1OC(C)C ZINC000623349597 1052629947 /nfs/dbraw/zinc/62/99/47/1052629947.db2.gz GFVBJKDFFPRKOM-NVXWUHKLSA-N 2 0 334.504 4.006 20 0 EIADRP CC(C)Oc1ccc(CC[C@@H](C)[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623363357 1052635164 /nfs/dbraw/zinc/63/51/64/1052635164.db2.gz PTOYWPKJNXCLKN-MJGOQNOKSA-N 2 0 332.532 4.257 20 0 EIADRP COc1ccc(-c2csc(C[NH2+][C@@H]3CC[N@H+](C)C(C)(C)C3)c2)cc1 ZINC000623439008 1052656957 /nfs/dbraw/zinc/65/69/57/1052656957.db2.gz SEUQGNJERSEKGH-QGZVFWFLSA-N 2 0 344.524 4.386 20 0 EIADRP C[C@@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000178087283 1052698284 /nfs/dbraw/zinc/69/82/84/1052698284.db2.gz FTPJJTSEJRMVEO-VFNWGFHPSA-N 2 0 342.458 4.104 20 0 EIADRP Clc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000623861236 1052824583 /nfs/dbraw/zinc/82/45/83/1052824583.db2.gz SJGQZRZFOOYSFG-YJYMSZOUSA-N 2 0 343.902 4.273 20 0 EIADRP Fc1ccc(S[C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000623866513 1052825208 /nfs/dbraw/zinc/82/52/08/1052825208.db2.gz YQOTVWTZTDGIBY-IZBJGVDFSA-N 2 0 348.531 4.445 20 0 EIADRP Cc1csc([C@H](C)[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)n1 ZINC000623924195 1052838967 /nfs/dbraw/zinc/83/89/67/1052838967.db2.gz VLRCZIRXESRYOW-AOIWGVFYSA-N 2 0 343.540 4.403 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000383360173 1053328614 /nfs/dbraw/zinc/32/86/14/1053328614.db2.gz SHQAORAQKSFPSW-WBVHZDCISA-N 2 0 330.422 4.138 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(C)o1 ZINC000383543026 1053353394 /nfs/dbraw/zinc/35/33/94/1053353394.db2.gz UXPFVLFNVNGUBZ-FUHIMQAGSA-N 2 0 326.484 4.458 20 0 EIADRP COc1ccc(CC[C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000764966304 1053401428 /nfs/dbraw/zinc/40/14/28/1053401428.db2.gz ODCACVSTSRXKNH-IBGZPJMESA-N 2 0 332.532 4.118 20 0 EIADRP Fc1cc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cnc1Cl ZINC000865404177 1053492073 /nfs/dbraw/zinc/49/20/73/1053492073.db2.gz BQHNOIAXGJKEPP-UHFFFAOYSA-N 2 0 347.865 4.150 20 0 EIADRP CCOc1cccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000385805309 1053549588 /nfs/dbraw/zinc/54/95/88/1053549588.db2.gz NHLNJVUOKPDENL-WIYYLYMNSA-N 2 0 338.495 4.086 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)CC1 ZINC000865717325 1053579435 /nfs/dbraw/zinc/57/94/35/1053579435.db2.gz WSVITYJDLIFLTJ-FPOVZHCZSA-N 2 0 329.532 4.208 20 0 EIADRP CC(C)[C@H]([NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1)c1ccccn1 ZINC000866247031 1053662560 /nfs/dbraw/zinc/66/25/60/1053662560.db2.gz QHTYVMMTLAXZDL-NRFANRHFSA-N 2 0 325.500 4.409 20 0 EIADRP CC(C)[C@@H]([NH2+]C[C@@H]1CCCN(Cc2cccs2)C1)c1ccccn1 ZINC000866250509 1053664796 /nfs/dbraw/zinc/66/47/96/1053664796.db2.gz CXGHKKDMMLKPRJ-FXAWDEMLSA-N 2 0 343.540 4.342 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(OC)cc1 ZINC000386441166 1053728582 /nfs/dbraw/zinc/72/85/82/1053728582.db2.gz PULPQTXNCZANRX-SIKLNZKXSA-N 2 0 338.495 4.258 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ccc(C)o2)ccc1OC ZINC000866479086 1053746428 /nfs/dbraw/zinc/74/64/28/1053746428.db2.gz PQGAUYZEGQURCP-MRXNPFEDSA-N 2 0 330.472 4.289 20 0 EIADRP C[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ncc(-c2ccccc2)n1C ZINC000866516854 1053765377 /nfs/dbraw/zinc/76/53/77/1053765377.db2.gz DGKVITWXTGMBQD-SRWJYRBRSA-N 2 0 340.515 4.001 20 0 EIADRP Cn1cncc1CCC[N@@H+]1CC[C@H](c2ccccc2Cl)C1(C)C ZINC001197313425 1053872861 /nfs/dbraw/zinc/87/28/61/1053872861.db2.gz ACPDFIQARNUJBK-QGZVFWFLSA-N 2 0 331.891 4.274 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CC[C@@H]2CC2(Cl)Cl)CC1 ZINC000857064913 1054168761 /nfs/dbraw/zinc/16/87/61/1054168761.db2.gz GEJNDEKAJRIHOY-FMKPAKJESA-N 2 0 333.347 4.203 20 0 EIADRP CCC[N@H+](C[C@@H](OC)C1CCC1)C1CCN(Cc2ccccc2)CC1 ZINC001198641155 1054214523 /nfs/dbraw/zinc/21/45/23/1054214523.db2.gz NFVHSENJYDYGAV-JOCHJYFZSA-N 2 0 344.543 4.178 20 0 EIADRP CC(C)(C)[C@@H]1CC[N@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CCO1 ZINC001198799941 1054272909 /nfs/dbraw/zinc/27/29/09/1054272909.db2.gz GFCOXHSTTMXWMR-NRFANRHFSA-N 2 0 344.543 4.310 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)c1ccc2c(c1)CCO2 ZINC000123921772 1054361519 /nfs/dbraw/zinc/36/15/19/1054361519.db2.gz IZIISVGUCJNCKH-NRFANRHFSA-N 2 0 338.495 4.314 20 0 EIADRP CC[C@@H](CCC(F)(F)F)[NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC000872082695 1054382647 /nfs/dbraw/zinc/38/26/47/1054382647.db2.gz ZUBKGWYSNOZCGB-IKGGRYGDSA-N 2 0 328.422 4.043 20 0 EIADRP CC[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[NH+]2C[C@@H](C)C[C@H](C)C2)CCO1 ZINC001199310375 1054386743 /nfs/dbraw/zinc/38/67/43/1054386743.db2.gz TZUJWHJDPWKWHF-MOXQZVSFSA-N 2 0 344.543 4.212 20 0 EIADRP COCc1cccc(C[NH2+]CC(C)(C)C[N@H+](C)Cc2ccccc2)c1 ZINC001199319472 1054390050 /nfs/dbraw/zinc/39/00/50/1054390050.db2.gz COQOAAJDEMDDKG-UHFFFAOYSA-N 2 0 340.511 4.081 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]C[C@@H]1CCCC[C@H]1C ZINC001199329502 1054392005 /nfs/dbraw/zinc/39/20/05/1054392005.db2.gz UFZNKQAFFSCIME-MOPGFXCFSA-N 2 0 332.532 4.323 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ncc(Cl)s2)CC1 ZINC000872111750 1054392251 /nfs/dbraw/zinc/39/22/51/1054392251.db2.gz DLFDQVVHOGRMCA-UHFFFAOYSA-N 2 0 349.931 4.329 20 0 EIADRP [NH3+][C@H](C[C@H]1CCC[N@H+](Cc2csc(C3CC3)n2)C1)C1CCCC1 ZINC000872156698 1054412568 /nfs/dbraw/zinc/41/25/68/1054412568.db2.gz LFYVEBYXQZGNLJ-RDTXWAMCSA-N 2 0 333.545 4.140 20 0 EIADRP CCOc1ccc(Cl)cc1C[NH2+][C@H](Cn1ccnc1)C(C)(C)C ZINC001199608510 1054431654 /nfs/dbraw/zinc/43/16/54/1054431654.db2.gz IZSDLKYXDFRIAK-QGZVFWFLSA-N 2 0 335.879 4.140 20 0 EIADRP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1cncc2ccccc21 ZINC000776007474 1054443924 /nfs/dbraw/zinc/44/39/24/1054443924.db2.gz FBYVWRQXUQPZQN-UHFFFAOYSA-N 2 0 325.500 4.369 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC2CC[NH+](C3CCCCC3)CC2)C1 ZINC001199760857 1054463038 /nfs/dbraw/zinc/46/30/38/1054463038.db2.gz STJOFKUHYRCGSE-RTBURBONSA-N 2 0 349.607 4.130 20 0 EIADRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(Oc3cccnc3)c(C)c2)C1 ZINC001199842994 1054477134 /nfs/dbraw/zinc/47/71/34/1054477134.db2.gz LSKXXRUTHVZTEX-LJQANCHMSA-N 2 0 339.483 4.004 20 0 EIADRP C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC001199963326 1054505439 /nfs/dbraw/zinc/50/54/39/1054505439.db2.gz WJORURSJCVQHEV-DOMZBBRYSA-N 2 0 329.315 4.387 20 0 EIADRP CC(C)(C)[C@]1(C[NH3+])CC[N@H+](Cc2cnc(-c3cccs3)s2)C1 ZINC000873222895 1054510529 /nfs/dbraw/zinc/51/05/29/1054510529.db2.gz DLELFUQHTRMCGA-KRWDZBQOSA-N 2 0 335.542 4.069 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873273282 1054518791 /nfs/dbraw/zinc/51/87/91/1054518791.db2.gz ZWPWUYZIVMODNI-STQMWFEESA-N 2 0 347.503 4.296 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+]CCc2c[nH]c3c2cccc3Cl)CC1 ZINC000624331991 1054569809 /nfs/dbraw/zinc/56/98/09/1054569809.db2.gz OZWAQVXBCNVHSK-UHFFFAOYSA-N 2 0 333.907 4.216 20 0 EIADRP CC[NH+]1CCC(CC2CC[NH+](Cc3ccc(OC)cc3)CC2)CC1 ZINC001203958077 1054596463 /nfs/dbraw/zinc/59/64/63/1054596463.db2.gz FSBZEGUNXQMHNR-UHFFFAOYSA-N 2 0 330.516 4.029 20 0 EIADRP C[N@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+](C[C@@H]1CC=CCC1)CC2 ZINC001201408957 1054787966 /nfs/dbraw/zinc/78/79/66/1054787966.db2.gz MXIJBXUSFNRJPA-UYAOXDASSA-N 2 0 328.500 4.312 20 0 EIADRP CC(C)CC1(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)CCC1 ZINC001201425592 1054797267 /nfs/dbraw/zinc/79/72/67/1054797267.db2.gz WHXUAJKTZMMEFG-UHFFFAOYSA-N 2 0 344.543 4.467 20 0 EIADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(SC(F)F)cc1 ZINC000125464278 1054799355 /nfs/dbraw/zinc/79/93/55/1054799355.db2.gz XIWXPPVWWQLEET-ZDUSSCGKSA-N 2 0 328.472 4.384 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2cccc(F)c2)C[N@@H+]1Cc1ccccc1 ZINC001201492557 1054818785 /nfs/dbraw/zinc/81/87/85/1054818785.db2.gz RJRIQKQDHLBWOC-YLJYHZDGSA-N 2 0 326.459 4.216 20 0 EIADRP C[NH+](C)Cc1ccccc1NC1=C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001201478186 1054830767 /nfs/dbraw/zinc/83/07/67/1054830767.db2.gz ZZAOKHOLUQHQID-YADHBBJMSA-N 2 0 347.506 4.481 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(SC(F)F)cc2)CC1 ZINC000765770394 1054845641 /nfs/dbraw/zinc/84/56/41/1054845641.db2.gz ZTPWIPSAXMMCBQ-ZDUSSCGKSA-N 2 0 328.472 4.384 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)c(C)c1OC ZINC000671741459 1054882187 /nfs/dbraw/zinc/88/21/87/1054882187.db2.gz TVTCWFYDFGYNFZ-SFHVURJKSA-N 2 0 348.531 4.175 20 0 EIADRP CS[C@@H]1CC[C@H]([NH2+][C@H]2CCN(C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC000877070925 1055011218 /nfs/dbraw/zinc/01/12/18/1055011218.db2.gz YVAQTJYWMDZCNL-RAUXBKROSA-N 2 0 330.541 4.228 20 0 EIADRP CCO[P@](C)(=O)CC[C@H](C)[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000877075636 1055014935 /nfs/dbraw/zinc/01/49/35/1055014935.db2.gz DGWCOEIUYMHAEC-LYHSWCNTSA-N 2 0 344.480 4.096 20 0 EIADRP Cc1c(C[NH2+]Cc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)ccnc1F ZINC000862271095 1055041959 /nfs/dbraw/zinc/04/19/59/1055041959.db2.gz CNONWMBYDVEIJU-INIZCTEOSA-N 2 0 341.474 4.051 20 0 EIADRP Clc1ccc([C@H](C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)OCC2CC2)cc1 ZINC000671764599 1055057687 /nfs/dbraw/zinc/05/76/87/1055057687.db2.gz GLEVDHRNUDVPAP-ZCNNSNEGSA-N 2 0 348.918 4.024 20 0 EIADRP Clc1ccc([C@H](C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)OCC2CC2)cc1 ZINC000671764598 1055058363 /nfs/dbraw/zinc/05/83/63/1055058363.db2.gz GLEVDHRNUDVPAP-UFYCRDLUSA-N 2 0 348.918 4.024 20 0 EIADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccc(NC(=O)OC(C)(C)C)cc1 ZINC000877568784 1055082811 /nfs/dbraw/zinc/08/28/11/1055082811.db2.gz WHMKKVPTXOOPKS-UHFFFAOYSA-N 2 0 349.519 4.244 20 0 EIADRP C[C@@H](CCCC(F)(F)F)[NH2+]CC1(c2ccccc2)CC[NH+](C)CC1 ZINC000877718933 1055111244 /nfs/dbraw/zinc/11/12/44/1055111244.db2.gz YXFSHTGNQIAAAZ-INIZCTEOSA-N 2 0 342.449 4.361 20 0 EIADRP CCO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)C1 ZINC001202288317 1055125111 /nfs/dbraw/zinc/12/51/11/1055125111.db2.gz AZEBTNZZKJDQHO-FCHUYYIVSA-N 2 0 344.543 4.356 20 0 EIADRP C[C@@H](NCc1cc(C(F)(F)F)co1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000878411520 1055297419 /nfs/dbraw/zinc/29/74/19/1055297419.db2.gz LHUJNKKRVBAIKM-OLZOCXBDSA-N 2 0 330.394 4.041 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[C@H](c2ccccc2)O1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000878412323 1055301290 /nfs/dbraw/zinc/30/12/90/1055301290.db2.gz VTUBIBLKFRGRRY-XODARUQUSA-N 2 0 342.527 4.149 20 0 EIADRP CN(c1ccccc1)c1ccc(C[NH2+]CCCCn2ccnc2)cc1 ZINC000616026378 1055313936 /nfs/dbraw/zinc/31/39/36/1055313936.db2.gz AIWSOXZTHHRXRC-UHFFFAOYSA-N 2 0 334.467 4.221 20 0 EIADRP C[C@@H](Cc1ccccn1)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000655833883 1055701010 /nfs/dbraw/zinc/70/10/10/1055701010.db2.gz HPYIVCXQYGLKPT-NLMOZGTASA-N 2 0 337.511 4.045 20 0 EIADRP CC[NH+](CC)CCOCC[NH2+][C@@H](C)c1cc(Cl)sc1Cl ZINC000542680175 1055819189 /nfs/dbraw/zinc/81/91/89/1055819189.db2.gz JZAYLJMNKTVCBF-NSHDSACASA-N 2 0 339.332 4.064 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)C2CCC(C(F)(F)F)CC2)CC1 ZINC000474730737 1056014793 /nfs/dbraw/zinc/01/47/93/1056014793.db2.gz PUVLBDYMKKJOKX-ODIFPOPNSA-N 2 0 334.470 4.455 20 0 EIADRP Clc1cccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000062426710 1056724610 /nfs/dbraw/zinc/72/46/10/1056724610.db2.gz RLRGFYDHWPCJIU-LJQANCHMSA-N 2 0 328.887 4.342 20 0 EIADRP Brc1ccc(C2([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CCC2)cc1 ZINC000180439604 1058612644 /nfs/dbraw/zinc/61/26/44/1058612644.db2.gz ZEUIZNQQZUQMGP-IAGOWNOFSA-N 2 0 349.316 4.045 20 0 EIADRP c1ccc(C[N@H+]2CCC[C@@H](C[NH2+]Cc3ccc4cnccc4c3)C2)cc1 ZINC000388244820 1060275664 /nfs/dbraw/zinc/27/56/64/1060275664.db2.gz FRQWUVJKBABADU-NRFANRHFSA-N 2 0 345.490 4.237 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1ccc(F)cc1N(C)C ZINC000766514510 1060472799 /nfs/dbraw/zinc/47/27/99/1060472799.db2.gz XXGFFJSIOSGPTO-IVMQYODDSA-N 2 0 347.522 4.339 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C(C)(C)c1ccc(C(F)(F)F)cc1)C2 ZINC001169091874 1060647483 /nfs/dbraw/zinc/64/74/83/1060647483.db2.gz WPVKOLGDRFPIEQ-MUJYYYPQSA-N 2 0 326.406 4.155 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H]1CCCc3c(Br)cccc31)C2 ZINC001169118262 1060647602 /nfs/dbraw/zinc/64/76/02/1060647602.db2.gz GEZJYGDACRZKHT-ZUMXRPEOSA-N 2 0 349.316 4.041 20 0 EIADRP CC[NH+]1CCC([NH2+]CCc2ccc(CCc3ccccc3)cc2)CC1 ZINC001169244281 1060716626 /nfs/dbraw/zinc/71/66/26/1060716626.db2.gz LIHYZBLVMCNVAB-UHFFFAOYSA-N 2 0 336.523 4.088 20 0 EIADRP CC[NH+]1CCC([NH2+]Cc2ccc3nc(-c4ccccc4)oc3c2)CC1 ZINC001169241466 1060719834 /nfs/dbraw/zinc/71/98/34/1060719834.db2.gz KTZOCDOZJGJIFF-UHFFFAOYSA-N 2 0 335.451 4.069 20 0 EIADRP C[C@@H]1C[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)CCC[C@@H]1C[NH3+] ZINC001206013209 1060863541 /nfs/dbraw/zinc/86/35/41/1060863541.db2.gz QIVIPSVBQFYZPO-GHMZBOCLSA-N 2 0 335.706 4.454 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)c(C)o1 ZINC000767363243 1061212352 /nfs/dbraw/zinc/21/23/52/1061212352.db2.gz VQCVRTWUJONELZ-INIZCTEOSA-N 2 0 326.484 4.418 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccc(Br)cc1 ZINC000019914655 212083840 /nfs/dbraw/zinc/08/38/40/212083840.db2.gz PRLZQUFZQRIPCL-CQSZACIVSA-N 2 0 327.310 4.049 20 0 EIADRP C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000532200567 1032087397 /nfs/dbraw/zinc/08/73/97/1032087397.db2.gz WJXSAWZZSQXBMM-VFNWGFHPSA-N 2 0 326.459 4.301 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CCc3c2cccc3Cl)c1 ZINC000532211061 1032091039 /nfs/dbraw/zinc/09/10/39/1032091039.db2.gz JTGSBLUXXDKJFN-HXUWFJFHSA-N 2 0 344.886 4.058 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(Br)cc2)C1 ZINC000532214758 1032094675 /nfs/dbraw/zinc/09/46/75/1032094675.db2.gz LCFFWJGJKWZARJ-CABCVRRESA-N 2 0 339.321 4.220 20 0 EIADRP COc1ccc(-c2ccccc2)cc1C[NH2+]CCC1CC[NH+](C)CC1 ZINC000532300239 1032132820 /nfs/dbraw/zinc/13/28/20/1032132820.db2.gz XGJYELKUQISGBU-UHFFFAOYSA-N 2 0 338.495 4.184 20 0 EIADRP C[C@@H](NCc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)c1nccs1 ZINC000245545490 1032299319 /nfs/dbraw/zinc/29/93/19/1032299319.db2.gz VNILZIOYGUUXGV-IXDOHACOSA-N 2 0 343.540 4.472 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(Sc3ccccc3)cc2)CC[N@@H+]1C ZINC000532804324 1032323813 /nfs/dbraw/zinc/32/38/13/1032323813.db2.gz BEVNNXQPISFUKI-SJLPKXTDSA-N 2 0 326.509 4.410 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CC(C)(C)Cc3occc32)ccc1F ZINC000120881881 1032453259 /nfs/dbraw/zinc/45/32/59/1032453259.db2.gz JKGWQNAFRWELPT-SFHVURJKSA-N 2 0 330.447 4.284 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2cc(Cl)c(N)c(Cl)c2)CC1 ZINC000760167707 1032517502 /nfs/dbraw/zinc/51/75/02/1032517502.db2.gz KVGGRODHPLMMRS-LBPRGKRZSA-N 2 0 344.330 4.348 20 0 EIADRP Cc1nccn1CCCC[N@@H+](C)[C@@H](C)c1nc2ccccc2s1 ZINC000179266914 1032556826 /nfs/dbraw/zinc/55/68/26/1032556826.db2.gz IAGFELJMGSGEEU-AWEZNQCLSA-N 2 0 328.485 4.274 20 0 EIADRP CC[C@H]([NH2+][C@H]1CCN(Cc2ccccn2)C[C@H]1C)c1ccccc1F ZINC000245983098 1032573981 /nfs/dbraw/zinc/57/39/81/1032573981.db2.gz PREZWHYMTNFBLK-CZAAIQMYSA-N 2 0 341.474 4.172 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H](N[C@@H](CC)c2ccccc2F)[C@H](C)C1 ZINC000245987139 1032576279 /nfs/dbraw/zinc/57/62/79/1032576279.db2.gz QEVVFDUQGNZUND-UXPWSPDFSA-N 2 0 336.495 4.003 20 0 EIADRP CCCC[C@H](CC)CC[NH+]1CCC(N2CC[NH+](C(C)C)CC2)CC1 ZINC000438100200 1032729097 /nfs/dbraw/zinc/72/90/97/1032729097.db2.gz BYRUVWBJORAZKX-FQEVSTJZSA-N 2 0 337.596 4.083 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]C[C@H]3CCC[C@H]([NH3+])C3)cs2)cs1 ZINC000643541055 1018788865 /nfs/dbraw/zinc/78/88/65/1018788865.db2.gz CTCFLFUKKCAZIA-WHOFXGATSA-N 2 0 335.542 4.348 20 0 EIADRP C[N@@H+]1CC[C@@]2(CC[NH+](CCCCc3ccc(Cl)c(Cl)c3)C2)C1 ZINC000430148403 1018867841 /nfs/dbraw/zinc/86/78/41/1018867841.db2.gz RTZXWENHQVQJRB-GOSISDBHSA-N 2 0 341.326 4.344 20 0 EIADRP CC[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cccc(Br)c1 ZINC000643545818 1018892749 /nfs/dbraw/zinc/89/27/49/1018892749.db2.gz CNNWBUDXOUVDDX-HZPDHXFCSA-N 2 0 337.305 4.165 20 0 EIADRP c1c2c(cc3c1OCCC[C@H]3[NH2+][C@@H]1CC[NH2+]C3(CCC3)C1)CCCC2 ZINC000643546504 1018896660 /nfs/dbraw/zinc/89/66/60/1018896660.db2.gz PMNWDVOCZAEYSC-UYAOXDASSA-N 2 0 340.511 4.043 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c2cccc(Br)c21 ZINC000643546536 1018898059 /nfs/dbraw/zinc/89/80/59/1018898059.db2.gz QJNIVUPKEVNQTP-IOASZLSFSA-N 2 0 349.316 4.262 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(SCC(F)F)cc1 ZINC000643546668 1018900538 /nfs/dbraw/zinc/90/05/38/1018900538.db2.gz SOYYRDPBUKCKKB-ZFWWWQNUSA-N 2 0 340.483 4.369 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643548980 1018933414 /nfs/dbraw/zinc/93/34/14/1018933414.db2.gz YMLFKCHVMASXPX-RHSMWYFYSA-N 2 0 340.433 4.291 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1ccc(Cl)cn1 ZINC000274983118 1019887901 /nfs/dbraw/zinc/88/79/01/1019887901.db2.gz ZPIPOXQFTUELOS-HNNXBMFYSA-N 2 0 331.891 4.428 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCCc3c(Cl)sc(Cl)c32)C1 ZINC000655806717 1020974147 /nfs/dbraw/zinc/97/41/47/1020974147.db2.gz ZTWHBRSXVQJRAB-UMNHJUIQSA-N 2 0 333.328 4.362 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)C1 ZINC000655806055 1020976119 /nfs/dbraw/zinc/97/61/19/1020976119.db2.gz YLAGGCQEYLRJNB-TYNCELHUSA-N 2 0 343.298 4.137 20 0 EIADRP C[N@H+](C[C@H]1CN(Cc2ccccc2)CCCO1)C1CCCCCCC1 ZINC001167302631 1020978791 /nfs/dbraw/zinc/97/87/91/1020978791.db2.gz RMUKCWJRLUXUTJ-QFIPXVFZSA-N 2 0 344.543 4.322 20 0 EIADRP C[C@H](Cc1ccccn1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000655834514 1020998079 /nfs/dbraw/zinc/99/80/79/1020998079.db2.gz PHQMRUPKEOVFJT-HWHRFOGPSA-N 2 0 349.522 4.045 20 0 EIADRP CC[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1CCCCO1 ZINC000655850667 1021016330 /nfs/dbraw/zinc/01/63/30/1021016330.db2.gz YJJVKOVFKAMJNS-BIRZXAFVSA-N 2 0 342.527 4.119 20 0 EIADRP COCCC[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000340472712 1021083738 /nfs/dbraw/zinc/08/37/38/1021083738.db2.gz KZYUFZWIHKTTPN-HXUWFJFHSA-N 2 0 336.495 4.005 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1nc(C(F)(F)F)cs1 ZINC000340476573 1021098102 /nfs/dbraw/zinc/09/81/02/1021098102.db2.gz SYMAWMGKWYZMLG-LBPRGKRZSA-N 2 0 335.439 4.079 20 0 EIADRP c1cc2ccc(C[N@H+]3CCC[C@H](C[NH+]4CCCCCC4)C3)cc2[nH]1 ZINC001167326857 1021129321 /nfs/dbraw/zinc/12/93/21/1021129321.db2.gz UWVMUIZNRBZRSR-LJQANCHMSA-N 2 0 325.500 4.256 20 0 EIADRP Clc1cccc(C2CC[NH+](Cc3cc4c(s3)C[NH2+]CC4)CC2)c1 ZINC001210519360 1021165788 /nfs/dbraw/zinc/16/57/88/1021165788.db2.gz OKBDUAIMOIGYDZ-UHFFFAOYSA-N 2 0 346.927 4.427 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H]2CCCOc3c(C)cc(Cl)cc32)CC1 ZINC000570232343 1021261475 /nfs/dbraw/zinc/26/14/75/1021261475.db2.gz NWLRNXZYPMZQLB-GOSISDBHSA-N 2 0 336.907 4.184 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000157850343 1021852335 /nfs/dbraw/zinc/85/23/35/1021852335.db2.gz HZENDPIAMANXQQ-IBGZPJMESA-N 3 0 335.580 4.028 20 0 EIADRP COc1ccc(C[NH+]2CCC(CC[NH+](C)C)CC2)c2ccccc12 ZINC000511489378 1021883383 /nfs/dbraw/zinc/88/33/83/1021883383.db2.gz RPMNQAIKMCFAOI-UHFFFAOYSA-N 2 0 326.484 4.012 20 0 EIADRP Clc1ccc([C@@H]2CCC[C@H]([NH2+][C@@H]3CCn4ccnc4C3)C2)cc1 ZINC000414131994 1021903276 /nfs/dbraw/zinc/90/32/76/1021903276.db2.gz LRWRQGSCOZPAGS-BPQIPLTHSA-N 2 0 329.875 4.167 20 0 EIADRP c1ccc(CC2(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)CCCCC2)cc1 ZINC000471592362 1022200144 /nfs/dbraw/zinc/20/01/44/1022200144.db2.gz DJPQTPURGMURLR-SFTDATJTSA-N 2 0 326.528 4.396 20 0 EIADRP CC[N@H+](CCC1CC[NH+](C[C@@H](OC)c2ccccc2)CC1)CC1CC1 ZINC000549387776 1022202922 /nfs/dbraw/zinc/20/29/22/1022202922.db2.gz PIPYXMHVFSMEPF-JOCHJYFZSA-N 2 0 344.543 4.208 20 0 EIADRP COc1cccc(C[C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000089622956 1022222014 /nfs/dbraw/zinc/22/20/14/1022222014.db2.gz AXMAWBOUPUCTCF-QGZVFWFLSA-N 2 0 330.516 4.013 20 0 EIADRP COC1CC([NH2+][C@H](c2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)C1 ZINC000580576413 1022222165 /nfs/dbraw/zinc/22/21/65/1022222165.db2.gz SQKFVRYYMULQCH-PDQDRIIMSA-N 2 0 348.918 4.021 20 0 EIADRP Cc1cc(OCCC[C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)ccc1Cl ZINC000549041206 1022250898 /nfs/dbraw/zinc/25/08/98/1022250898.db2.gz FVLSDSUTFTYVOX-SJORKVTESA-N 2 0 338.923 4.127 20 0 EIADRP Cc1n[nH]cc1[C@H](C)[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000245911397 1033039774 /nfs/dbraw/zinc/03/97/74/1033039774.db2.gz FXFACPCRCAEDRM-ZACQAIPSSA-N 2 0 340.515 4.047 20 0 EIADRP Cc1cc(F)ncc1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC000892580269 1022313711 /nfs/dbraw/zinc/31/37/11/1022313711.db2.gz ILYADIVFSWCELC-KRWDZBQOSA-N 2 0 341.474 4.193 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1ccc(-n2ccnc2)cc1 ZINC000467198080 1022546962 /nfs/dbraw/zinc/54/69/62/1022546962.db2.gz WONBLGHWLGTKIZ-PXNSSMCTSA-N 2 0 339.483 4.405 20 0 EIADRP C[C@H](CCc1ccco1)[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000310846192 1022647737 /nfs/dbraw/zinc/64/77/37/1022647737.db2.gz IKTMIQOSVWWJRU-TZIWHRDSSA-N 2 0 340.511 4.493 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1cncc(F)c1 ZINC000163942152 1022654045 /nfs/dbraw/zinc/65/40/45/1022654045.db2.gz DEJXSHBKDJVLRZ-INIZCTEOSA-N 2 0 327.447 4.057 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1cncc(F)c1 ZINC000163942204 1022657014 /nfs/dbraw/zinc/65/70/14/1022657014.db2.gz DEJXSHBKDJVLRZ-MRXNPFEDSA-N 2 0 327.447 4.057 20 0 EIADRP c1sc(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)nc1-c1ccccc1 ZINC000647542956 1022779031 /nfs/dbraw/zinc/77/90/31/1022779031.db2.gz FGGLESDVRQDVKT-ZWKOTPCHSA-N 2 0 341.524 4.022 20 0 EIADRP CC(C)(C)[C@H]1C[C@H]([NH2+]C2CC[NH+](CC3CCCCC3)CC2)CCO1 ZINC000378407957 1022805825 /nfs/dbraw/zinc/80/58/25/1022805825.db2.gz YRZPDMJZTKPXAI-WOJBJXKFSA-N 2 0 336.564 4.214 20 0 EIADRP CN1CC[C@H]([NH2+][C@@H]2CCCc3cc(N)ccc32)C[C@H]1c1ccccc1 ZINC000423369638 1022860400 /nfs/dbraw/zinc/86/04/00/1022860400.db2.gz SUBYGKHTHQEKMK-NNWRFLSQSA-N 2 0 335.495 4.071 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCCc3nc(C)sc32)c1 ZINC000163563951 1022895702 /nfs/dbraw/zinc/89/57/02/1022895702.db2.gz BUAOZLZYUOKBGH-GOSISDBHSA-N 2 0 343.540 4.461 20 0 EIADRP [NH3+]CCC[C@H]([NH2+][C@H]1CCSc2c(F)cccc21)c1ccccc1 ZINC000423495665 1022925420 /nfs/dbraw/zinc/92/54/20/1022925420.db2.gz CKEUZKPUJXUXIN-ROUUACIJSA-N 2 0 330.472 4.432 20 0 EIADRP [NH3+]CCC[C@H]([NH2+][C@@H]1CCSc2c(F)cccc21)c1ccccc1 ZINC000423495666 1022926313 /nfs/dbraw/zinc/92/63/13/1022926313.db2.gz CKEUZKPUJXUXIN-ZWKOTPCHSA-N 2 0 330.472 4.432 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cnn(C(C)C)c2)cc1 ZINC000163577442 1022953133 /nfs/dbraw/zinc/95/31/33/1022953133.db2.gz ABVWCPGMZZMTGW-KRWDZBQOSA-N 2 0 328.504 4.157 20 0 EIADRP C[C@]1(C[NH2+]Cc2cccc3cccnc32)CC[N@H+](Cc2ccccc2)C1 ZINC000311500132 1023183915 /nfs/dbraw/zinc/18/39/15/1023183915.db2.gz LMMPOMBCRCKVIE-HSZRJFAPSA-N 2 0 345.490 4.237 20 0 EIADRP C[C@@]1(C[NH2+]Cc2cccc3cccnc32)CC[N@H+](Cc2ccccc2)C1 ZINC000311500133 1023184325 /nfs/dbraw/zinc/18/43/25/1023184325.db2.gz LMMPOMBCRCKVIE-QHCPKHFHSA-N 2 0 345.490 4.237 20 0 EIADRP C[C@H]([NH2+]CCCCNc1ccccn1)c1nc(C(F)(F)F)cs1 ZINC000343837742 1023243686 /nfs/dbraw/zinc/24/36/86/1023243686.db2.gz PUDRITJKYFVKDO-NSHDSACASA-N 2 0 344.406 4.100 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000376672597 1023254977 /nfs/dbraw/zinc/25/49/77/1023254977.db2.gz OJELGPNBPZUIOD-KNQAVFIVSA-N 2 0 335.495 4.035 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417347040 1023273614 /nfs/dbraw/zinc/27/36/14/1023273614.db2.gz VOFFRVCFZYDUPB-JZFYCYHFSA-N 2 0 332.557 4.483 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CCC[NH2+]C(C)C ZINC000581542474 1023348612 /nfs/dbraw/zinc/34/86/12/1023348612.db2.gz ZVJJFWSHGOJHHT-CYBMUJFWSA-N 2 0 335.492 4.296 20 0 EIADRP C[C@H]([NH2+]CCc1nsc2ccccc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000660255322 1023388807 /nfs/dbraw/zinc/38/88/07/1023388807.db2.gz BAHHSGGXZQOSBJ-HOTGVXAUSA-N 2 0 343.540 4.081 20 0 EIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1NCc1ccc(Cl)cn1 ZINC000549167912 1023411354 /nfs/dbraw/zinc/41/13/54/1023411354.db2.gz XUGZIVBRIWFBLC-LJQANCHMSA-N 2 0 343.902 4.125 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1ccc(F)cc1C(F)(F)F)c1ccccc1 ZINC000415060280 1023411628 /nfs/dbraw/zinc/41/16/28/1023411628.db2.gz WEEJOQAXHZUWRU-KRWDZBQOSA-N 2 0 340.364 4.414 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CC1CC[NH2+]CC1 ZINC000415086838 1023437947 /nfs/dbraw/zinc/43/79/47/1023437947.db2.gz VBADBVFRVAZHBN-AWEZNQCLSA-N 2 0 329.513 4.077 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(F)cc1 ZINC000656684046 1023440609 /nfs/dbraw/zinc/44/06/09/1023440609.db2.gz SPPHYPUKNQKGQJ-OAQYLSRUSA-N 2 0 341.474 4.174 20 0 EIADRP Cc1cc(C)cc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c1 ZINC000341263789 1023470861 /nfs/dbraw/zinc/47/08/61/1023470861.db2.gz ITGWREQMRQFWAZ-UHFFFAOYSA-N 2 0 338.495 4.066 20 0 EIADRP Cc1cccc(C)c1C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000341281775 1023507167 /nfs/dbraw/zinc/50/71/67/1023507167.db2.gz XUOPXTDAMDFJLU-UHFFFAOYSA-N 2 0 338.495 4.066 20 0 EIADRP Cc1ccc(C)c(OC2CC[NH+](CC[C@@H]3CCCC[N@H+]3C)CC2)c1 ZINC000472759386 1023511410 /nfs/dbraw/zinc/51/14/10/1023511410.db2.gz KSDKAWSCMDLUBD-IBGZPJMESA-N 2 0 330.516 4.021 20 0 EIADRP C[C@H](C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500118180 1023515407 /nfs/dbraw/zinc/51/54/07/1023515407.db2.gz SNSVTIFQPIFYKD-UWWQBHOKSA-N 2 0 340.433 4.225 20 0 EIADRP C[C@H](C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500118179 1023516095 /nfs/dbraw/zinc/51/60/95/1023516095.db2.gz SNSVTIFQPIFYKD-QGPMSJSTSA-N 2 0 340.433 4.225 20 0 EIADRP c1sc(-c2ccccc2)nc1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000656784486 1023528506 /nfs/dbraw/zinc/52/85/06/1023528506.db2.gz DNWAFGFGKKENJL-SFHVURJKSA-N 2 0 341.524 4.022 20 0 EIADRP [NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCC[N@@H+]2Cc2cccc(C3CCCC3)c2)C1 ZINC000656785840 1023530332 /nfs/dbraw/zinc/53/03/32/1023530332.db2.gz KEENGOPTWCDCCA-BHIFYINESA-N 2 0 342.527 4.205 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccccc1Br ZINC000019915298 1023634035 /nfs/dbraw/zinc/63/40/35/1023634035.db2.gz GQLCHBVNWPKZDS-AWEZNQCLSA-N 2 0 327.310 4.049 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccsc1Br)c1ccccc1 ZINC000925666937 1023637587 /nfs/dbraw/zinc/63/75/87/1023637587.db2.gz SANPSHUWKDNJFR-CQSZACIVSA-N 2 0 339.302 4.080 20 0 EIADRP C[C@H](C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1c(Cl)cccc1Cl ZINC000192803765 1023649524 /nfs/dbraw/zinc/64/95/24/1023649524.db2.gz LSGOVHWNZIBVLK-RLAWYHOSSA-N 2 0 327.299 4.312 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(Cl)cc1 ZINC000398097548 1023684263 /nfs/dbraw/zinc/68/42/63/1023684263.db2.gz KWUSLTALRXMGNE-JXFKEZNVSA-N 2 0 328.887 4.340 20 0 EIADRP CC[NH+](CC)Cc1ccccc1CN[C@@H](C)c1cccnc1Cl ZINC000163768165 1023702461 /nfs/dbraw/zinc/70/24/61/1023702461.db2.gz KREZQLBWTDDULD-HNNXBMFYSA-N 2 0 331.891 4.428 20 0 EIADRP CCC[NH+]1CCC([N@H+](C)Cc2ccc(C)c(Br)c2)CC1 ZINC000510468265 1023758635 /nfs/dbraw/zinc/75/86/35/1023758635.db2.gz ZEWYSGXWTKWYFK-UHFFFAOYSA-N 2 0 339.321 4.064 20 0 EIADRP CC[N@@H+]1CCC[C@H](C[NH2+]C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000500420900 1023814744 /nfs/dbraw/zinc/81/47/44/1023814744.db2.gz LYNUFAJNEXCBOS-RBFDBLARSA-N 2 0 340.433 4.430 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000511741922 1023854441 /nfs/dbraw/zinc/85/44/41/1023854441.db2.gz XSRDEEXCKRQMCP-CBXNMNPBSA-N 2 0 344.543 4.194 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)CCCOc2ccc(Cl)c(C)c2)C1 ZINC000510653328 1024172968 /nfs/dbraw/zinc/17/29/68/1024172968.db2.gz RERWBZBBXGVHGA-IRXDYDNUSA-N 2 0 338.923 4.127 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)CCCOc2ccc(Cl)c(C)c2)C1 ZINC000510653327 1024173965 /nfs/dbraw/zinc/17/39/65/1024173965.db2.gz RERWBZBBXGVHGA-IAGOWNOFSA-N 2 0 338.923 4.127 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)CC1 ZINC000510654987 1024178894 /nfs/dbraw/zinc/17/88/94/1024178894.db2.gz DWZBBNVBUSLQGY-OAHLLOKOSA-N 2 0 342.449 4.491 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CC[C@H]3C3CCC3)CC2)cc1 ZINC000510665986 1024202198 /nfs/dbraw/zinc/20/21/98/1024202198.db2.gz PEXHESCOEGRYRZ-FCHUYYIVSA-N 2 0 342.527 4.076 20 0 EIADRP C[C@H](NC1CC[NH+](C2CCC2)CC1)c1ccc(-c2ccccc2)cn1 ZINC000651688371 1024207864 /nfs/dbraw/zinc/20/78/64/1024207864.db2.gz IMBIHSKYJIGWFO-KRWDZBQOSA-N 2 0 335.495 4.416 20 0 EIADRP CC[N@H+](CCC[NH2+][C@@H](C)Cc1ccn(C(C)C)n1)C1CCCCC1 ZINC000651910452 1024216595 /nfs/dbraw/zinc/21/65/95/1024216595.db2.gz UJHHDUBONRFOAE-SFHVURJKSA-N 2 0 334.552 4.029 20 0 EIADRP Cc1nccn1CCC[NH2+][C@H](c1cccc(C)c1)c1cccc(F)c1 ZINC000510687010 1024234083 /nfs/dbraw/zinc/23/40/83/1024234083.db2.gz NJQMMFUMUHMWQE-OAQYLSRUSA-N 2 0 337.442 4.408 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccc(Br)c(C)c1 ZINC000091467221 1024272201 /nfs/dbraw/zinc/27/22/01/1024272201.db2.gz OTCFGZIYYMAOKT-OAHLLOKOSA-N 2 0 341.337 4.358 20 0 EIADRP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCCN(Cc2cccs2)C1 ZINC000510719954 1024312506 /nfs/dbraw/zinc/31/25/06/1024312506.db2.gz KMJLHEZDTASOJB-ZIFCJYIRSA-N 2 0 338.536 4.468 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc3ccsc32)[C@H](C)C1 ZINC000652219682 1024390874 /nfs/dbraw/zinc/39/08/74/1024390874.db2.gz IJVSXDVMIVFHGP-VQIMIIECSA-N 2 0 346.540 4.128 20 0 EIADRP C[NH+](C)[C@H](CNc1cc[nH+]c2cc(F)ccc12)c1ccc(F)cc1 ZINC000500436603 1024707672 /nfs/dbraw/zinc/70/76/72/1024707672.db2.gz AXEPBPWFYZPRBW-LJQANCHMSA-N 2 0 327.378 4.228 20 0 EIADRP CS[C@@H]1CCC[C@H]([NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000548483981 1024831210 /nfs/dbraw/zinc/83/12/10/1024831210.db2.gz RGRSLFXTVNAJIW-RSPOEFSDSA-N 2 0 332.557 4.161 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(F)cc2C(F)(F)F)CC1 ZINC000535811344 1024957890 /nfs/dbraw/zinc/95/78/90/1024957890.db2.gz IAIGCMZUSRNSHA-UHFFFAOYSA-N 2 0 346.412 4.397 20 0 EIADRP c1ccc2sc([C@@H]3CCC[N@H+]3Cc3cccc4c3CC[NH2+]C4)nc2c1 ZINC000662257468 1025005900 /nfs/dbraw/zinc/00/59/00/1025005900.db2.gz CYCAZAZITDKTLI-IBGZPJMESA-N 2 0 349.503 4.279 20 0 EIADRP COC1(C[C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCC1 ZINC000277057136 1025015242 /nfs/dbraw/zinc/01/52/42/1025015242.db2.gz HQXKEJSVTSXRDZ-XSLAUPDRSA-N 2 0 342.527 4.119 20 0 EIADRP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccccc1C(F)(F)F ZINC000662281305 1025033371 /nfs/dbraw/zinc/03/33/71/1025033371.db2.gz JDZZGIZXERBXFK-ZDUSSCGKSA-N 2 0 334.385 4.202 20 0 EIADRP C[C@H](c1ccc(OC(F)F)cc1)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662295867 1025050495 /nfs/dbraw/zinc/05/04/95/1025050495.db2.gz IIEDUBYJKJMPJO-RHSMWYFYSA-N 2 0 338.442 4.061 20 0 EIADRP c1c(C2CC[NH+](CCC3CCCCC3)CC2)n[nH]c1C1CC[NH2+]CC1 ZINC000662327269 1025080762 /nfs/dbraw/zinc/08/07/62/1025080762.db2.gz LRABNWBXSDCBRJ-UHFFFAOYSA-N 2 0 344.547 4.027 20 0 EIADRP COCC[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)(C)C ZINC000510993678 1025272149 /nfs/dbraw/zinc/27/21/49/1025272149.db2.gz GEZQVOSMCFXMIE-BURNTYAHSA-N 2 0 344.543 4.223 20 0 EIADRP CN(C)c1ccncc1C[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000342108748 1025272219 /nfs/dbraw/zinc/27/22/19/1025272219.db2.gz VIINHCBYOLQSPT-UHFFFAOYSA-N 2 0 347.462 4.016 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc(OC(F)F)cc1 ZINC000663467570 1025409058 /nfs/dbraw/zinc/40/90/58/1025409058.db2.gz GTHWSIXCHJANJD-HOCLYGCPSA-N 2 0 338.442 4.061 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc(OC(F)F)cc1 ZINC000663467574 1025410187 /nfs/dbraw/zinc/41/01/87/1025410187.db2.gz GTHWSIXCHJANJD-ZBFHGGJFSA-N 2 0 338.442 4.061 20 0 EIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc(SC(F)(F)F)c1 ZINC000925777232 1025419738 /nfs/dbraw/zinc/41/97/38/1025419738.db2.gz CLDBZYMYKCINEZ-BKQLOGFTSA-N 2 0 330.419 4.232 20 0 EIADRP CC(C)n1c2ccccc2nc1[C@H]1CCC[N@@H+]1CC1CC[NH+](C)CC1 ZINC000892034303 1025453180 /nfs/dbraw/zinc/45/31/80/1025453180.db2.gz LUSDRTKUXYCPCT-HXUWFJFHSA-N 2 0 340.515 4.096 20 0 EIADRP CCN1CCC[C@@H]1C[NH2+][C@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000546164909 1025583125 /nfs/dbraw/zinc/58/31/25/1025583125.db2.gz VRAPUAJVFKFDFX-WOJBJXKFSA-N 2 0 343.902 4.093 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000156750667 1025599530 /nfs/dbraw/zinc/59/95/30/1025599530.db2.gz KONLRZOCZDDPFA-IAGOWNOFSA-N 2 0 330.516 4.184 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC2(CC1)OCc1ccccc12 ZINC001167827550 1025653782 /nfs/dbraw/zinc/65/37/82/1025653782.db2.gz XJQDYSIFLWPVIR-SFHVURJKSA-N 2 0 330.516 4.018 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)sc1Br ZINC000512011435 1025713135 /nfs/dbraw/zinc/71/31/35/1025713135.db2.gz VUNJVCATZGETLG-AVGNSLFASA-N 2 0 345.350 4.342 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCSC[C@@H]1c1ccc(F)cc1 ZINC001167833329 1025788697 /nfs/dbraw/zinc/78/86/97/1025788697.db2.gz AFRDRCNGTCXCIM-QFBILLFUSA-N 2 0 338.536 4.426 20 0 EIADRP Cc1ccc2cc(C[NH2+]Cc3cccc(C[NH+]4CCCC4)c3)[nH]c2c1 ZINC000657300098 1025803408 /nfs/dbraw/zinc/80/34/08/1025803408.db2.gz IGAMSYXWMGSNOE-UHFFFAOYSA-N 2 0 333.479 4.362 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@H]1c1cccc(C(=O)OC)c1 ZINC001167834083 1025810477 /nfs/dbraw/zinc/81/04/77/1025810477.db2.gz HLINSFRWUMWWCZ-PXNSSMCTSA-N 2 0 346.515 4.121 20 0 EIADRP c1c2ccncc2sc1C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000657301008 1025814266 /nfs/dbraw/zinc/81/42/66/1025814266.db2.gz XWIJRCYQQNRRMA-UHFFFAOYSA-N 2 0 337.492 4.182 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCN([C@H](C)c2ccc(F)cc2)CC1 ZINC001167835856 1025839325 /nfs/dbraw/zinc/83/93/25/1025839325.db2.gz URHYHUJXAIJPTP-RBUKOAKNSA-N 2 0 349.538 4.015 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccccc1 ZINC000415011382 1025845808 /nfs/dbraw/zinc/84/58/08/1025845808.db2.gz HQNQGUKPGUHBOB-GOSISDBHSA-N 2 0 348.494 4.146 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+]Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000415016266 1025857245 /nfs/dbraw/zinc/85/72/45/1025857245.db2.gz CCLWDSKXJMLOEF-CQSZACIVSA-N 2 0 348.922 4.176 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1cc(Br)cs1 ZINC000453387228 1025862843 /nfs/dbraw/zinc/86/28/43/1025862843.db2.gz BALBBVUZLGNSDB-NSHDSACASA-N 2 0 331.323 4.036 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H](CCC[NH3+])c3ccccc3)CC2)C1 ZINC000415061581 1025862967 /nfs/dbraw/zinc/86/29/67/1025862967.db2.gz YRSAXICYQKMCBS-BVYCBKJFSA-N 3 0 343.559 4.099 20 0 EIADRP CCC[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccsc1 ZINC000187680395 1025881011 /nfs/dbraw/zinc/88/10/11/1025881011.db2.gz PCAUQSXKZXCHRA-SFHVURJKSA-N 2 0 332.513 4.320 20 0 EIADRP C[C@@H]([NH2+]CCCN1CCCO[C@H](C)C1)c1cc(Cl)cc(Cl)c1 ZINC000432418148 1025896390 /nfs/dbraw/zinc/89/63/90/1025896390.db2.gz QJONPYUMIPQMEU-ZIAGYGMSSA-N 2 0 345.314 4.145 20 0 EIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@H](CC2CCC2)c2ccccc2)CCCO1 ZINC000432421196 1025899946 /nfs/dbraw/zinc/89/99/46/1025899946.db2.gz OKJFVISBYQILHB-WIYYLYMNSA-N 2 0 330.516 4.008 20 0 EIADRP C[C@H]1C[N@H+](CCC[NH2+][C@@H](CC2CCC2)c2ccccc2)CCCO1 ZINC000432421195 1025900686 /nfs/dbraw/zinc/90/06/86/1025900686.db2.gz OKJFVISBYQILHB-RXVVDRJESA-N 2 0 330.516 4.008 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cccc(F)c1 ZINC000187789546 1025901450 /nfs/dbraw/zinc/90/14/50/1025901450.db2.gz WGTSPSBRRWYMMG-FQEVSTJZSA-N 2 0 330.447 4.007 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H](CC2CCC2)c2ccccc2)CC1 ZINC000344069400 1025948928 /nfs/dbraw/zinc/94/89/28/1025948928.db2.gz HXKRMHCBNAEXKE-NRFANRHFSA-N 2 0 330.516 4.008 20 0 EIADRP Fc1ccc2c(c1)[C@@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CCC2 ZINC000344098249 1026002377 /nfs/dbraw/zinc/00/23/77/1026002377.db2.gz IXAXAIUKFBZBNO-NRFANRHFSA-N 2 0 339.458 4.104 20 0 EIADRP COc1ccc(F)c(CNCc2ccccc2C[NH+]2CCCCC2)c1 ZINC000550078914 1026009476 /nfs/dbraw/zinc/00/94/76/1026009476.db2.gz GHIBXDICUIREEG-UHFFFAOYSA-N 2 0 342.458 4.110 20 0 EIADRP C[C@H](Cc1ccc(Cl)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167971238 1026066377 /nfs/dbraw/zinc/06/63/77/1026066377.db2.gz UNDOQEAVUGACLR-PHHCVGHBSA-N 2 0 332.919 4.266 20 0 EIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCC(C)(C)C1CC1)c1ccccc1O2 ZINC000582068794 1026067192 /nfs/dbraw/zinc/06/71/92/1026067192.db2.gz FLESHDBSMFQNKN-IBGZPJMESA-N 2 0 342.527 4.391 20 0 EIADRP Cc1cccc2c(CC[NH2+]Cc3cc(-n4ccnc4)cs3)c[nH]c21 ZINC000344207705 1026130620 /nfs/dbraw/zinc/13/06/20/1026130620.db2.gz INAIWSYDXRWILC-UHFFFAOYSA-N 2 0 336.464 4.056 20 0 EIADRP Cc1ccc2cc(C[NH2+]C3CC[NH+](CC4CCCC4)CC3)[nH]c2c1 ZINC000657336497 1026160295 /nfs/dbraw/zinc/16/02/95/1026160295.db2.gz UMUNIQZBMSPQDB-UHFFFAOYSA-N 2 0 325.500 4.221 20 0 EIADRP CC(C)[C@@H](C[N@H+](C)C1CC[NH+](C2CCOCC2)CC1)c1ccccc1 ZINC000375670146 1026208008 /nfs/dbraw/zinc/20/80/08/1026208008.db2.gz ZSOSOSQKNJGTKJ-JOCHJYFZSA-N 2 0 344.543 4.001 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000506858307 1026426570 /nfs/dbraw/zinc/42/65/70/1026426570.db2.gz AEJDOJUDDMTHGV-UHFFFAOYSA-N 2 0 339.321 4.003 20 0 EIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000279499965 1026462098 /nfs/dbraw/zinc/46/20/98/1026462098.db2.gz MNBSVWZKAPDWHM-FKPGQJDZSA-N 2 0 330.516 4.005 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(OC)c(OCC)c2)CC1 ZINC000506860103 1026478711 /nfs/dbraw/zinc/47/87/11/1026478711.db2.gz HLPFJVXTXHENLW-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP [NH2+]=C(NCCCC[NH3+])Nc1ccc(-c2ccccc2)c2ccccc12 ZINC001167878370 1026536645 /nfs/dbraw/zinc/53/66/45/1026536645.db2.gz KWMVMUWOIPCYTM-UHFFFAOYSA-N 2 0 332.451 4.182 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)cs2)cs1 ZINC000152425241 1026543149 /nfs/dbraw/zinc/54/31/49/1026543149.db2.gz JGYSWIYSQSFGFW-TZMCWYRMSA-N 2 0 347.553 4.315 20 0 EIADRP COCc1ccccc1/C=C(/C)C[N@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000507097392 1026639020 /nfs/dbraw/zinc/63/90/20/1026639020.db2.gz GKCAVCKWNHQNCI-JXAWBTAJSA-N 2 0 330.516 4.041 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1cc2cc(Br)ccc2o1 ZINC000051693644 1026662637 /nfs/dbraw/zinc/66/26/37/1026662637.db2.gz XSJZHFVVBUNXFP-GWMXKSKGSA-N 2 0 337.261 4.116 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1cc2cc(Br)ccc2o1 ZINC000051693643 1026662837 /nfs/dbraw/zinc/66/28/37/1026662837.db2.gz XSJZHFVVBUNXFP-FNBIGBAISA-N 2 0 337.261 4.116 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1cncs1 ZINC000159013131 1026731313 /nfs/dbraw/zinc/73/13/13/1026731313.db2.gz PSIDJEGWTZRNMK-BBWFWOEESA-N 2 0 343.540 4.472 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1ccccn1 ZINC000159212985 1026781256 /nfs/dbraw/zinc/78/12/56/1026781256.db2.gz RXSQKRMFTYRBAE-QGZVFWFLSA-N 2 0 335.451 4.157 20 0 EIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)CCCO2 ZINC000507447501 1026798096 /nfs/dbraw/zinc/79/80/96/1026798096.db2.gz IGXUCUDDOASERP-IBGZPJMESA-N 2 0 330.516 4.345 20 0 EIADRP CCC1(C[NH2+][C@H](C)[C@@H]2CCCOC2)CC[NH+](Cc2ccccc2)CC1 ZINC000507472649 1026807493 /nfs/dbraw/zinc/80/74/93/1026807493.db2.gz RKXUIMNHSFQEMC-TZIWHRDSSA-N 2 0 344.543 4.084 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000560249303 1026821624 /nfs/dbraw/zinc/82/16/24/1026821624.db2.gz HQXGPUOZLSQWFP-XHIHJMKYSA-N 2 0 344.543 4.431 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)[C@@H]1CCCOC1 ZINC000507511133 1026822351 /nfs/dbraw/zinc/82/23/51/1026822351.db2.gz NXBRGJSJWCKNGF-WIYYLYMNSA-N 2 0 344.543 4.356 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ccc2c(c1)OCCCO2 ZINC000119956536 1026836701 /nfs/dbraw/zinc/83/67/01/1026836701.db2.gz YEISMWNZOZUPGT-IAGOWNOFSA-N 2 0 334.504 4.009 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCOc2cccc3ccccc32)C[C@H]1C ZINC001167589380 1026860107 /nfs/dbraw/zinc/86/01/07/1026860107.db2.gz DKKYOBPXNIBJDQ-QUCCMNQESA-N 2 0 340.511 4.413 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000560450156 1026936347 /nfs/dbraw/zinc/93/63/47/1026936347.db2.gz DUJORBIGGJHPRO-XMHGGMMESA-N 2 0 344.543 4.289 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccccc1Br ZINC000519776958 1026995814 /nfs/dbraw/zinc/99/58/14/1026995814.db2.gz PYTFIQRUDNGXJJ-QGZVFWFLSA-N 2 0 333.273 4.149 20 0 EIADRP FC(F)(F)c1cccc(CCCC[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000474470004 1027097049 /nfs/dbraw/zinc/09/70/49/1027097049.db2.gz CYJYJKDSTSAWOZ-ZWKOTPCHSA-N 2 0 340.433 4.245 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000474481612 1027117124 /nfs/dbraw/zinc/11/71/24/1027117124.db2.gz YJTDCRICZLBETR-QRVBRYPASA-N 2 0 332.532 4.289 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)C1CCOCC1 ZINC000474484330 1027121426 /nfs/dbraw/zinc/12/14/26/1027121426.db2.gz HXOKRCNVJMDSJM-GUDVDZBRSA-N 2 0 344.543 4.069 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cccc(Br)c1 ZINC000564989391 1027464386 /nfs/dbraw/zinc/46/43/86/1027464386.db2.gz YALZWUXJROUAMG-QGZVFWFLSA-N 2 0 333.273 4.149 20 0 EIADRP COc1ccc2[nH+]c(C)cc(N3C(C)(C)CC([NH3+])CC3(C)C)c2c1 ZINC001167626406 1027482909 /nfs/dbraw/zinc/48/29/09/1027482909.db2.gz KESYQARZGBDQOP-UHFFFAOYSA-N 2 0 327.472 4.037 20 0 EIADRP CC(=O)c1c(C)cc(C)c(CN(C)CC[C@@H]2CCCC[N@@H+]2C)c1C ZINC000441367422 1027492661 /nfs/dbraw/zinc/49/26/61/1027492661.db2.gz IBXZXZAUCUGHQG-IBGZPJMESA-N 2 0 330.516 4.121 20 0 EIADRP C[C@H]([NH2+]C[C@@]1(C)CCCN1Cc1ccccc1)C1CCSCC1 ZINC000474923250 1027802089 /nfs/dbraw/zinc/80/20/89/1027802089.db2.gz PIJRFVJUILHMQI-FXAWDEMLSA-N 2 0 332.557 4.162 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)C1CCSCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000474942043 1027808416 /nfs/dbraw/zinc/80/84/16/1027808416.db2.gz KKSJKFHPEWBXPL-QKLQHJQFSA-N 2 0 332.557 4.018 20 0 EIADRP FC(F)(F)c1cccc([C@H]2C[C@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)C2)c1 ZINC000280803816 1027895055 /nfs/dbraw/zinc/89/50/55/1027895055.db2.gz LBRWSLUVFNRDMD-DDBAPUKQSA-N 2 0 338.417 4.168 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000583075300 1027956031 /nfs/dbraw/zinc/95/60/31/1027956031.db2.gz KYYIZIWXBXPKAG-KRWDZBQOSA-N 2 0 330.516 4.391 20 0 EIADRP CC[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccc(OC)c(OC)c1 ZINC000324070186 1028098739 /nfs/dbraw/zinc/09/87/39/1028098739.db2.gz XZRNXHPXCYTZHJ-WMZOPIPTSA-N 2 0 334.504 4.009 20 0 EIADRP Cc1ccc2cc(C[NH2+]CCCC[N@H+]3CCCC[C@@H]3C)ccc2n1 ZINC000189256221 1028110658 /nfs/dbraw/zinc/11/06/58/1028110658.db2.gz FNVCEOSNCRIFOS-SFHVURJKSA-N 2 0 325.500 4.287 20 0 EIADRP Cc1ccc(OCCC[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc1C ZINC000523450342 1028126161 /nfs/dbraw/zinc/12/61/61/1028126161.db2.gz RTSWSMIGSDNZJH-HXUWFJFHSA-N 2 0 330.516 4.023 20 0 EIADRP CC[C@H]1c2ccsc2CC[N@H+]1Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000346132374 1028273632 /nfs/dbraw/zinc/27/36/32/1028273632.db2.gz BVIAVWMHJGQXDU-SFHVURJKSA-N 2 0 338.480 4.147 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@H]1c1ccc(C)cc1 ZINC000346138782 1028275597 /nfs/dbraw/zinc/27/55/97/1028275597.db2.gz TZMHDYNLLVZOCU-NRFANRHFSA-N 2 0 332.451 4.221 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCCC[C@@H]1Cc1ccccc1 ZINC000346174675 1028304157 /nfs/dbraw/zinc/30/41/57/1028304157.db2.gz MQOJYBRFZAWBAL-JOCHJYFZSA-N 2 0 346.478 4.173 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@H]1CCc1ccccc1 ZINC000346178262 1028308974 /nfs/dbraw/zinc/30/89/74/1028308974.db2.gz OWNGADWMAPIENQ-NRFANRHFSA-N 2 0 346.478 4.173 20 0 EIADRP CC[C@@H](Cc1ccccc1)[N@H+](C)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000346222499 1028331756 /nfs/dbraw/zinc/33/17/56/1028331756.db2.gz OWHSWDPVWOOCEJ-FQEVSTJZSA-N 2 0 334.467 4.029 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](c1cncc(F)c1)C1CC1 ZINC000281095770 1028374102 /nfs/dbraw/zinc/37/41/02/1028374102.db2.gz AXEQVDAVSVKPNN-NRFANRHFSA-N 2 0 341.474 4.302 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](c2cncc(F)c2)C2CC2)cc1 ZINC000281148779 1028399346 /nfs/dbraw/zinc/39/93/46/1028399346.db2.gz GKYZVILZKKYGNG-NRFANRHFSA-N 2 0 341.474 4.303 20 0 EIADRP COCc1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)o1 ZINC000125504243 1028418667 /nfs/dbraw/zinc/41/86/67/1028418667.db2.gz IZVNWKNFOZYEKY-QGZVFWFLSA-N 2 0 342.483 4.090 20 0 EIADRP CC[NH+](CC)Cc1ccccc1CN[C@@H](c1ncc[nH]1)c1ccccc1 ZINC000125618362 1028439576 /nfs/dbraw/zinc/43/95/76/1028439576.db2.gz CFIWQTBMCIADFZ-OAQYLSRUSA-N 2 0 348.494 4.131 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CC2 ZINC000162910673 1028538518 /nfs/dbraw/zinc/53/85/18/1028538518.db2.gz MELZEXGJCUGBCM-JOCHJYFZSA-N 2 0 336.479 4.068 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000583395823 1028657738 /nfs/dbraw/zinc/65/77/38/1028657738.db2.gz NZPPOTNBWWOBQX-LRHZJYQRSA-N 2 0 327.299 4.027 20 0 EIADRP C(=C/C[N@@H+]1CCC[C@H]1c1cccnc1)\C[NH+]1CCC[C@@H]1c1cccnc1 ZINC000346978603 1028831275 /nfs/dbraw/zinc/83/12/75/1028831275.db2.gz UEZABGVONGZQNQ-XFDDJKQHSA-N 2 0 348.494 4.007 20 0 EIADRP CC(C)OC1CC[NH+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168050737 1028910097 /nfs/dbraw/zinc/91/00/97/1028910097.db2.gz CODMMJPJPLSGLX-OALUTQOASA-N 2 0 344.543 4.317 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000650746672 1029088929 /nfs/dbraw/zinc/08/89/29/1029088929.db2.gz IETFNUBTILRFJH-GOEBONIOSA-N 2 0 326.406 4.060 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000650746671 1029089546 /nfs/dbraw/zinc/08/95/46/1029089546.db2.gz IETFNUBTILRFJH-GDBMZVCRSA-N 2 0 326.406 4.060 20 0 EIADRP C[C@@H]([NH2+]CCCn1ccnc1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000151131605 1029142092 /nfs/dbraw/zinc/14/20/92/1029142092.db2.gz JIHSUXGPHNCCPC-OLZOCXBDSA-N 2 0 342.270 4.026 20 0 EIADRP C[C@@H]1CC([N@@H+]2CC[C@@H](c3ccncc3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168053360 1029160814 /nfs/dbraw/zinc/16/08/14/1029160814.db2.gz OCGOLJUOUGSCFN-WOIUINJBSA-N 2 0 349.522 4.313 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](C[C@@H]3CC[C@H]([NH3+])[C@@H](C)C3)C[C@H]2C)CCO1 ZINC001168087489 1029185790 /nfs/dbraw/zinc/18/57/90/1029185790.db2.gz LYMXSDHTMGCEQE-WGYJFHDGSA-N 2 0 336.564 4.102 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1ccccc1OC(F)(F)F ZINC000650758279 1029218548 /nfs/dbraw/zinc/21/85/48/1029218548.db2.gz MMSVBDIKESTPAC-ZDUSSCGKSA-N 2 0 338.373 4.155 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)C(c1ccccc1)c1ccccc1 ZINC000247057206 1029235957 /nfs/dbraw/zinc/23/59/57/1029235957.db2.gz NPHJKQROAITBMN-BWAGFHJFSA-N 2 0 334.507 4.423 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(-n2ccnc2)cc1 ZINC000157882315 1029260324 /nfs/dbraw/zinc/26/03/24/1029260324.db2.gz RFTIWVPMOVTUCU-MOPGFXCFSA-N 2 0 340.515 4.178 20 0 EIADRP COc1cccc2c1CCC[C@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000583851024 1029275908 /nfs/dbraw/zinc/27/59/08/1029275908.db2.gz PBTHIWMBESKENH-OAQYLSRUSA-N 2 0 342.527 4.459 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]CCC3CC[NH2+]CC3)cs2)cs1 ZINC000650764317 1029278877 /nfs/dbraw/zinc/27/88/77/1029278877.db2.gz WAYZQQKAMFSXRE-LBPRGKRZSA-N 2 0 335.542 4.220 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CCC1CC[NH2+]CC1 ZINC000650764348 1029279281 /nfs/dbraw/zinc/27/92/81/1029279281.db2.gz WQDHGWLHNJNXCS-CYBMUJFWSA-N 2 0 347.503 4.298 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000278480444 1029325077 /nfs/dbraw/zinc/32/50/77/1029325077.db2.gz OPJIILKYDKCCCB-GJZGRUSLSA-N 2 0 343.540 4.252 20 0 EIADRP C[C@@H](C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000475225691 1029447727 /nfs/dbraw/zinc/44/77/27/1029447727.db2.gz UKSZVOXBXAGXMW-PKOBYXMFSA-N 2 0 326.459 4.041 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@H]3CC[C@@H](c4ccccc4)C3)C2)cc1 ZINC000475276619 1029482983 /nfs/dbraw/zinc/48/29/83/1029482983.db2.gz PHGFMRLCTISBTC-MZYLBHOOSA-N 2 0 334.507 4.434 20 0 EIADRP Cc1ccc([C@H]([NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)C2CCCC2)cc1 ZINC000446820466 1029588616 /nfs/dbraw/zinc/58/86/16/1029588616.db2.gz CWETZLZQBMBPDW-FGZHOGPDSA-N 2 0 344.543 4.053 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)CCCO2 ZINC000359938933 1029603751 /nfs/dbraw/zinc/60/37/51/1029603751.db2.gz AMPAWYZQWOAJIZ-XLIONFOSSA-N 2 0 346.515 4.153 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCc2c1cccc2F ZINC000325233186 1029630235 /nfs/dbraw/zinc/63/02/35/1029630235.db2.gz BQICYSHKZADMPC-NRFANRHFSA-N 2 0 326.459 4.445 20 0 EIADRP c1sc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1-c1ccccc1 ZINC000446885944 1029631458 /nfs/dbraw/zinc/63/14/58/1029631458.db2.gz CELHSJDTFRDIOV-UHFFFAOYSA-N 2 0 326.509 4.379 20 0 EIADRP Clc1ccc([C@H]2CCC[C@@H]2[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446887698 1029633401 /nfs/dbraw/zinc/63/34/01/1029633401.db2.gz XIRYYRJFKMFDON-UXHICEINSA-N 2 0 332.919 4.440 20 0 EIADRP C[NH2+]Cc1cccc(N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168065242 1029646203 /nfs/dbraw/zinc/64/62/03/1029646203.db2.gz VEXHEPXBITZBLO-OPMZPASUSA-N 2 0 337.511 4.260 20 0 EIADRP CSc1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000192920276 1029647111 /nfs/dbraw/zinc/64/71/11/1029647111.db2.gz XYWCAFOCGUIQDF-IBGZPJMESA-N 2 0 326.509 4.020 20 0 EIADRP Fc1ccc(C2CC([NH2+]C[C@H]3CC[N@H+](Cc4ccccc4)C3)C2)cc1 ZINC000192929892 1029647828 /nfs/dbraw/zinc/64/78/28/1029647828.db2.gz KSZQKISOYVJIOZ-HOHBBMLPSA-N 2 0 338.470 4.183 20 0 EIADRP CCN(Cc1c[nH]c(-c2ccccc2)n1)Cc1ccc(C[NH+](C)C)cc1 ZINC000584259676 1029698917 /nfs/dbraw/zinc/69/89/17/1029698917.db2.gz XROYTUHFFOQICE-UHFFFAOYSA-N 2 0 348.494 4.160 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657838283 1029728125 /nfs/dbraw/zinc/72/81/25/1029728125.db2.gz PYOBGHVSNFTFBW-HUUCEWRRSA-N 2 0 325.447 4.182 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1cc2cnccc2o1 ZINC000657839676 1029733283 /nfs/dbraw/zinc/73/32/83/1029733283.db2.gz YJQALDRHKRUTQW-ZACQAIPSSA-N 2 0 329.488 4.237 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(Br)c(Cl)c2)C1 ZINC000657840427 1029747897 /nfs/dbraw/zinc/74/78/97/1029747897.db2.gz GHSFFXIHYYXJAN-NEPJUHHUSA-N 2 0 345.712 4.095 20 0 EIADRP C[C@@H](Cc1c(Cl)cccc1Cl)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000584366694 1029768476 /nfs/dbraw/zinc/76/84/76/1029768476.db2.gz HDXPRUDVHREVJG-HSBZDZAISA-N 2 0 329.315 4.387 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)C(C)(C)C(F)F ZINC000657861633 1029867428 /nfs/dbraw/zinc/86/74/28/1029867428.db2.gz VGHIXEHTWSIOCD-CYBMUJFWSA-N 2 0 330.488 4.230 20 0 EIADRP CC(C)c1nn(-c2ccccc2)cc1C[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000092071304 1029898808 /nfs/dbraw/zinc/89/88/08/1029898808.db2.gz GLXJQNKNNCDEJH-KRWDZBQOSA-N 2 0 349.482 4.098 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1nc2c(s1)CCCC2 ZINC000093398258 1030004303 /nfs/dbraw/zinc/00/43/03/1030004303.db2.gz KBAYEMORCRGJAB-CVEARBPZSA-N 2 0 335.561 4.327 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccccc1OC(F)(F)F ZINC000447553091 1030132329 /nfs/dbraw/zinc/13/23/29/1030132329.db2.gz PLKWUYLRXXUXOD-ZDUSSCGKSA-N 2 0 342.405 4.110 20 0 EIADRP Fc1ccc(C[C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000447536256 1030141071 /nfs/dbraw/zinc/14/10/71/1030141071.db2.gz LZPUEEIWBHOTNO-AVRDEDQJSA-N 2 0 338.470 4.183 20 0 EIADRP Cc1nc(C(C)(C)C)sc1[C@H](C)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447568717 1030153426 /nfs/dbraw/zinc/15/34/26/1030153426.db2.gz LVVCFGMKEJCKOI-ZDUSSCGKSA-N 2 0 335.561 4.274 20 0 EIADRP Clc1ccc2c(c1)OCCC[C@@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447566727 1030178339 /nfs/dbraw/zinc/17/83/39/1030178339.db2.gz WAFUYFWFVUZSRG-SFHVURJKSA-N 2 0 334.891 4.018 20 0 EIADRP CC(C)COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000447566824 1030179458 /nfs/dbraw/zinc/17/94/58/1030179458.db2.gz WSPIVZOAUOKWQM-QGZVFWFLSA-N 2 0 330.516 4.246 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C2(c4ccccc4)CC2)C3)cc1 ZINC000447589011 1030188527 /nfs/dbraw/zinc/18/85/27/1030188527.db2.gz WHKODEOKIONNNL-DKUWSORSSA-N 2 0 332.491 4.461 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCc2c(F)cccc2Cl)[C@H](C)C1 ZINC000447728304 1030292832 /nfs/dbraw/zinc/29/28/32/1030292832.db2.gz LBGSGTHZSMZWOD-RDTXWAMCSA-N 2 0 326.887 4.074 20 0 EIADRP C/C=C/COc1ccc(CC[C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)cc1 ZINC000685455689 1030341978 /nfs/dbraw/zinc/34/19/78/1030341978.db2.gz LFXUHYOGVFTFRB-HRSGFYEVSA-N 2 0 344.543 4.283 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)CC1 ZINC000121759721 1030369905 /nfs/dbraw/zinc/36/99/05/1030369905.db2.gz PABLGBPLCDTWKS-LJQANCHMSA-N 2 0 328.500 4.145 20 0 EIADRP COc1cc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)ccc1C ZINC000447857361 1030380033 /nfs/dbraw/zinc/38/00/33/1030380033.db2.gz WISWPRGTHVVIDH-UHFFFAOYSA-N 2 0 338.495 4.279 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1cc2ccncc2s1 ZINC000657899385 1030409557 /nfs/dbraw/zinc/40/95/57/1030409557.db2.gz AGLZUSOGHOCNCM-AWEZNQCLSA-N 2 0 329.513 4.354 20 0 EIADRP C[C@@H]([NH2+]CCCc1ccccc1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000530477271 1030447698 /nfs/dbraw/zinc/44/76/98/1030447698.db2.gz XBPRETQYAMNESR-NQIIRXRSSA-N 2 0 340.486 4.259 20 0 EIADRP C[NH+](C)CCCOc1ccc(C[NH2+]Cc2ccc(C(F)F)cc2)cc1 ZINC000527227345 1030584250 /nfs/dbraw/zinc/58/42/50/1030584250.db2.gz NLVDWZZOVBLNBC-UHFFFAOYSA-N 2 0 348.437 4.245 20 0 EIADRP Cc1c([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cnn1C(C)C ZINC000191391682 1030622156 /nfs/dbraw/zinc/62/21/56/1030622156.db2.gz DAJDFODZCODJPB-KKXNLOMOSA-N 2 0 346.563 4.466 20 0 EIADRP C[C@H](N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cc2cnccc2o1 ZINC000657968522 1030711049 /nfs/dbraw/zinc/71/10/49/1030711049.db2.gz AVYDFSDXBNKYKE-HRCADAONSA-N 2 0 327.472 4.131 20 0 EIADRP C[C@H](CC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(C(F)(F)F)c1 ZINC000192923561 1030720008 /nfs/dbraw/zinc/72/00/08/1030720008.db2.gz ASSAUVJVYKPTJV-TZUVLKIQSA-N 2 0 340.433 4.414 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2[nH]ccc2c1 ZINC000398179860 1030731008 /nfs/dbraw/zinc/73/10/08/1030731008.db2.gz WUURNDQBGOEJMI-UTKZUKDTSA-N 2 0 333.479 4.168 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2cc3cc(Cl)cnc3o2)C1 ZINC000648424195 1030783048 /nfs/dbraw/zinc/78/30/48/1030783048.db2.gz DQYQVWHOESZLGU-GASCZTMLSA-N 2 0 349.906 4.329 20 0 EIADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658067900 1030814654 /nfs/dbraw/zinc/81/46/54/1030814654.db2.gz RJMRUUGYJIPIMG-UTKZUKDTSA-N 2 0 342.527 4.024 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3ccc4cc[nH]c4c3)CC2)CC1 ZINC000527685020 1030824585 /nfs/dbraw/zinc/82/45/85/1030824585.db2.gz SZXHAAHEIXFKLP-UHFFFAOYSA-N 2 0 325.500 4.301 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cccc(C)c1 ZINC000658162514 1030859715 /nfs/dbraw/zinc/85/97/15/1030859715.db2.gz DWLUKPVUFWDBES-QFIPXVFZSA-N 2 0 337.511 4.343 20 0 EIADRP CCc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658166698 1030862299 /nfs/dbraw/zinc/86/22/99/1030862299.db2.gz OCUIZAOQUFEQRY-GOSISDBHSA-N 2 0 337.511 4.207 20 0 EIADRP CCC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccc1 ZINC000658166709 1030862916 /nfs/dbraw/zinc/86/29/16/1030862916.db2.gz OEVQLQIBJDOVFN-QFIPXVFZSA-N 2 0 337.511 4.425 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CC[C@]2(C)CC2(F)F)CC1 ZINC000658217933 1030895086 /nfs/dbraw/zinc/89/50/86/1030895086.db2.gz BEMAXWXEVWKOJD-CTWPCTMYSA-N 2 0 336.470 4.455 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCOc2cccc3ccccc32)C[C@@H]1C ZINC000531140867 1030912286 /nfs/dbraw/zinc/91/22/86/1030912286.db2.gz MCHAGDIHZULHQR-HKUYNNGSSA-N 2 0 326.484 4.023 20 0 EIADRP Cc1cnccc1O[C@H]1CC[N@@H+]([C@@H](C)Cc2ccc(Cl)cc2)C1 ZINC001168191542 1030969383 /nfs/dbraw/zinc/96/93/83/1030969383.db2.gz GRMJSHFFWUWORU-YJBOKZPZSA-N 2 0 330.859 4.128 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccncc1 ZINC000658319278 1030978546 /nfs/dbraw/zinc/97/85/46/1030978546.db2.gz YWDQQYRVJZEESP-FGZHOGPDSA-N 2 0 349.522 4.425 20 0 EIADRP COCCC[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccc(F)cc1 ZINC000658352109 1031020180 /nfs/dbraw/zinc/02/01/80/1031020180.db2.gz DAJFFWXPJPFBHN-OAQYLSRUSA-N 2 0 348.506 4.005 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)C1 ZINC000658353733 1031021576 /nfs/dbraw/zinc/02/15/76/1031021576.db2.gz QRIHGLPMLKDTMJ-NHCUHLMSSA-N 2 0 341.543 4.128 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccccc1OC(F)F ZINC000658356653 1031025211 /nfs/dbraw/zinc/02/52/11/1031025211.db2.gz LHMRWKVUWPJSST-AWEZNQCLSA-N 2 0 338.442 4.061 20 0 EIADRP Fc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](CC3CC3)CC1)CCS2 ZINC000658356256 1031025429 /nfs/dbraw/zinc/02/54/29/1031025429.db2.gz NCRCXDLKQBLNFA-GOSISDBHSA-N 2 0 334.504 4.074 20 0 EIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2c[nH]c3ccccc23)CC1 ZINC000532441704 1031069929 /nfs/dbraw/zinc/06/99/29/1031069929.db2.gz CJZVIYWCAXKUPU-HTAPYJJXSA-N 2 0 339.527 4.343 20 0 EIADRP C[C@H]([NH2+]CCO[C@@H]1CCCC[C@@H]1C)c1ccc(-n2ccnc2)cc1 ZINC000532448163 1031075016 /nfs/dbraw/zinc/07/50/16/1031075016.db2.gz SJQNLCLADFSNJH-ABSDTBQOSA-N 2 0 327.472 4.118 20 0 EIADRP Cc1cc(C)c(C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)c(C)c1 ZINC000532463595 1031130605 /nfs/dbraw/zinc/13/06/05/1031130605.db2.gz VUZSLQVEOVLXMV-IBGZPJMESA-N 2 0 340.511 4.403 20 0 EIADRP Cc1[nH]c2c(cc(C)cc2C[NH2+]C2CC[NH+](CC3CC3)CC2)c1C ZINC000532483016 1031218353 /nfs/dbraw/zinc/21/83/53/1031218353.db2.gz JRVFSSADQHYIEL-UHFFFAOYSA-N 2 0 325.500 4.057 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCCCC[NH+]2CCCCC2)c(OC)c1 ZINC000532511504 1031245405 /nfs/dbraw/zinc/24/54/05/1031245405.db2.gz HBJWLRJQRAGCLT-QGZVFWFLSA-N 2 0 334.504 4.011 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCCCC[NH+]2CCCCC2)c(OC)c1 ZINC000532511502 1031247081 /nfs/dbraw/zinc/24/70/81/1031247081.db2.gz HBJWLRJQRAGCLT-KRWDZBQOSA-N 2 0 334.504 4.011 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2cnc(-c3ccccc3F)s2)CC1 ZINC000449013831 1031343521 /nfs/dbraw/zinc/34/35/21/1031343521.db2.gz FNFXTEBDCWSAKI-UHFFFAOYSA-N 2 0 347.503 4.113 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCOC2(CCC2)C1 ZINC000449084228 1031412364 /nfs/dbraw/zinc/41/23/64/1031412364.db2.gz XABGBPIYMUBUKX-WIYYLYMNSA-N 2 0 342.527 4.252 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@@H]3CCOC4(CCC4)C3)cc2)C1 ZINC000449074139 1031425963 /nfs/dbraw/zinc/42/59/63/1031425963.db2.gz BLRAZDRQHRYDEV-WIYYLYMNSA-N 2 0 342.527 4.110 20 0 EIADRP Clc1ccc([C@@H]2CC[C@H]([NH2+]C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC000449091540 1031452657 /nfs/dbraw/zinc/45/26/57/1031452657.db2.gz QDBRNJJEHHPFMW-XLIONFOSSA-N 2 0 332.919 4.440 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC(NC2CC[NH+](CC3CC3)CC2)CC1 ZINC000449090712 1031452674 /nfs/dbraw/zinc/45/26/74/1031452674.db2.gz OKRBEQUVAOAFEE-UHFFFAOYSA-N 2 0 349.607 4.130 20 0 EIADRP CC1CC[NH+](Cc2cccc(C[NH2+][C@@H]3CCOC4(CCC4)C3)c2)CC1 ZINC000449131949 1031465322 /nfs/dbraw/zinc/46/53/22/1031465322.db2.gz QOFXZKGEPRFCRJ-OAQYLSRUSA-N 2 0 342.527 4.110 20 0 EIADRP C[C@@H](Cc1ccoc1)[NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1 ZINC000449157070 1031486517 /nfs/dbraw/zinc/48/65/17/1031486517.db2.gz FTWIANXPTUIMGD-KRWDZBQOSA-N 2 0 338.451 4.225 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](CN[C@@H](C)c2sccc2Br)C1 ZINC000531702764 1031488092 /nfs/dbraw/zinc/48/80/92/1031488092.db2.gz WGUHFPFAIGUXIU-QWHCGFSZSA-N 2 0 345.350 4.282 20 0 EIADRP CC[C@@H](C[C@H](C)CO)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449172914 1031493873 /nfs/dbraw/zinc/49/38/73/1031493873.db2.gz KGIFPHQPSITMEM-IRXDYDNUSA-N 2 0 326.569 4.052 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@H]2c2ccccc2C(F)(F)F)C1 ZINC000584479622 1031505080 /nfs/dbraw/zinc/50/50/80/1031505080.db2.gz AVAGVMNGRUWTBC-RPCCPQHDSA-N 2 0 326.406 4.201 20 0 EIADRP CCSCC[C@@H](C)[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449166129 1031507643 /nfs/dbraw/zinc/50/76/43/1031507643.db2.gz BYARVEZAMCZYJB-QZTJIDSGSA-N 2 0 334.573 4.203 20 0 EIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2cc3cccnc3o2)C[N@@H+]1Cc1ccccc1 ZINC000449217119 1031553404 /nfs/dbraw/zinc/55/34/04/1031553404.db2.gz WZNDHCAMSUOETM-PKOBYXMFSA-N 2 0 349.478 4.218 20 0 EIADRP CC(C)[C@H]1C[C@H]([NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CCO1 ZINC000449255028 1031573283 /nfs/dbraw/zinc/57/32/83/1031573283.db2.gz ZLEYEFMFUWYLHL-RTBURBONSA-N 2 0 338.580 4.459 20 0 EIADRP CC[C@H](CC(F)(F)F)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449243598 1031577055 /nfs/dbraw/zinc/57/70/55/1031577055.db2.gz LXNFBYZYFBMLNE-DOTOQJQBSA-N 2 0 342.449 4.403 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCC[C@H]2CCCCO2)CC1 ZINC000449241749 1031578286 /nfs/dbraw/zinc/57/82/86/1031578286.db2.gz CMGINWABOUQYFU-SIKLNZKXSA-N 2 0 344.543 4.021 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CCCN(C)[C@@H]1c1cccs1)c1ccncc1 ZINC000453116536 1031606909 /nfs/dbraw/zinc/60/69/09/1031606909.db2.gz HRQXXIQHTXNLLN-AOIWGVFYSA-N 2 0 329.513 4.267 20 0 EIADRP CC[C@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ccncc1 ZINC000453153552 1031631159 /nfs/dbraw/zinc/63/11/59/1031631159.db2.gz VKGGJTCVKCEZRL-GKJHBJHPSA-N 2 0 337.511 4.279 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]CC3CC[NH+](C)CC3)cs2)cs1 ZINC000126279935 1031640484 /nfs/dbraw/zinc/64/04/84/1031640484.db2.gz ULYWIGUFPQCLGU-LBPRGKRZSA-N 2 0 335.542 4.172 20 0 EIADRP CC1(C)C[N@H+](Cc2ccccn2)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449411955 1031696428 /nfs/dbraw/zinc/69/64/28/1031696428.db2.gz DKPLFRXNWBKQJW-JOCHJYFZSA-N 2 0 349.522 4.204 20 0 EIADRP C[C@H](CCCc1cccnc1)[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000453193670 1031703766 /nfs/dbraw/zinc/70/37/66/1031703766.db2.gz GKZLQYYKLZPGLB-QWFCFKBJSA-N 2 0 329.532 4.035 20 0 EIADRP Cc1nn(-c2ccc(Cl)cc2)cc1C[NH2+]C(C)(C)CCC[NH+](C)C ZINC000449527998 1031822777 /nfs/dbraw/zinc/82/27/77/1031822777.db2.gz MLWQAUNWLKPDGA-UHFFFAOYSA-N 2 0 348.922 4.044 20 0 EIADRP CC(C)Oc1ccc([C@H]2CCC[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000449560110 1031848068 /nfs/dbraw/zinc/84/80/68/1031848068.db2.gz GEUWPKXYXNJYOZ-YZOZSUJXSA-N 2 0 342.527 4.325 20 0 EIADRP CC[C@@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](Cc2ccc(OC)cc2)CC1 ZINC000531950168 1031864976 /nfs/dbraw/zinc/86/49/76/1031864976.db2.gz CZBJDUFKVKEWEB-CTNGQTDRSA-N 2 0 330.516 4.076 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000531972413 1031910293 /nfs/dbraw/zinc/91/02/93/1031910293.db2.gz RIVLNIKSUXKXEW-LAUBAEHRSA-N 2 0 344.449 4.180 20 0 EIADRP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453405342 1031942220 /nfs/dbraw/zinc/94/22/20/1031942220.db2.gz QJHQZFUBZBBNID-CQSZACIVSA-N 2 0 328.422 4.100 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2ccc(C(C)(C)C)cc2)cc1 ZINC000512836254 1034059274 /nfs/dbraw/zinc/05/92/74/1034059274.db2.gz XVKPSJHLSDKJDP-UHFFFAOYSA-N 2 0 340.511 4.214 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC(C)(C)c1ccc(C(F)(F)F)cc1 ZINC000469039951 1034299747 /nfs/dbraw/zinc/29/97/47/1034299747.db2.gz RYIXERRWDABBLO-CKEIUWERSA-N 2 0 342.449 4.301 20 0 EIADRP Clc1nccc2cc(C[NH2+]C3CC[NH+](C4CCC4)CC3)sc21 ZINC000894204474 1034686971 /nfs/dbraw/zinc/68/69/71/1034686971.db2.gz OZJNOUBMBRJKGH-UHFFFAOYSA-N 2 0 335.904 4.056 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)cc2)cc1 ZINC000246556135 1034852752 /nfs/dbraw/zinc/85/27/52/1034852752.db2.gz WWXNLJCOCVAESK-RTWAWAEBSA-N 2 0 336.479 4.079 20 0 EIADRP CC[NH+]1CCC([NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000501416034 1035438046 /nfs/dbraw/zinc/43/80/46/1035438046.db2.gz YCJWDHTVWOYIIG-UHFFFAOYSA-N 2 0 344.449 4.171 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000501408073 1035439915 /nfs/dbraw/zinc/43/99/15/1035439915.db2.gz TXJQPTJSMYJFAH-ZJCQAOIJSA-N 2 0 338.417 4.325 20 0 EIADRP C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](CC[C@@H]1CC[NH2+]C1)C1CC1 ZINC000420299091 1035502150 /nfs/dbraw/zinc/50/21/50/1035502150.db2.gz GGBHINVZIOAIMJ-KGLIPLIRSA-N 2 0 326.406 4.230 20 0 EIADRP Clc1ccc2sc(C3CC[NH+](CC[C@@H]4CC[NH2+]C4)CC3)nc2c1 ZINC000420307666 1035505717 /nfs/dbraw/zinc/50/57/17/1035505717.db2.gz RRIKJVYWVUKMMX-ZDUSSCGKSA-N 2 0 349.931 4.129 20 0 EIADRP c1csc([C@@H]2c3ccsc3CC[N@H+]2CC[C@H]2CCC[NH2+]C2)c1 ZINC000420320516 1035512465 /nfs/dbraw/zinc/51/24/65/1035512465.db2.gz QKXLOIGOHNMZMQ-KDOFPFPSSA-N 2 0 332.538 4.147 20 0 EIADRP CC(C)=CCC[C@@H](C)CC[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000668440058 1035728314 /nfs/dbraw/zinc/72/83/14/1035728314.db2.gz HZPIJBYNNXCVFB-LJQANCHMSA-N 2 0 336.564 4.240 20 0 EIADRP C[NH+]1CCC(CC[NH2+]Cc2ccc(-c3ccccc3Cl)o2)CC1 ZINC000237158271 1036054962 /nfs/dbraw/zinc/05/49/62/1036054962.db2.gz WZGDSIAHXXMLHU-UHFFFAOYSA-N 2 0 332.875 4.422 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000502420481 1036205217 /nfs/dbraw/zinc/20/52/17/1036205217.db2.gz YNLNPXISQLMMLZ-QESAQDPVSA-N 2 0 344.543 4.082 20 0 EIADRP Fc1cc(Cl)cc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c1 ZINC000485724107 1036210106 /nfs/dbraw/zinc/21/01/06/1036210106.db2.gz XVWVOEIOUMMONP-UHFFFAOYSA-N 2 0 332.850 4.365 20 0 EIADRP CC(C)OCc1ccccc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000571789626 1036254751 /nfs/dbraw/zinc/25/47/51/1036254751.db2.gz VEKHZTXTUAKDDE-PCCBWWKXSA-N 2 0 330.516 4.012 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]C/C=C/c2ccccc2OC)cc1 ZINC000588177109 1036284620 /nfs/dbraw/zinc/28/46/20/1036284620.db2.gz ICHPALBFKJIQLV-CSKARUKUSA-N 2 0 338.495 4.340 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000421379268 1036328044 /nfs/dbraw/zinc/32/80/44/1036328044.db2.gz UGGKNICGYOMXGK-FXQLRMTLSA-N 2 0 331.529 4.251 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000502699176 1036516916 /nfs/dbraw/zinc/51/69/16/1036516916.db2.gz XMMPUJWYZLAFAR-COPCDDAFSA-N 2 0 344.543 4.356 20 0 EIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+][C@H]2CCC23CCC3)CC1 ZINC000502722505 1036560587 /nfs/dbraw/zinc/56/05/87/1036560587.db2.gz KLQBCSGZAJVHIM-IBGZPJMESA-N 2 0 332.919 4.474 20 0 EIADRP COCC[C@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000502710995 1036567856 /nfs/dbraw/zinc/56/78/56/1036567856.db2.gz ZSXSMSZQCHJROS-KNQAVFIVSA-N 2 0 344.543 4.357 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1C[C@@H]1c1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486479364 1036726770 /nfs/dbraw/zinc/72/67/70/1036726770.db2.gz VFVYEWZFCSNSIK-OUFMZXHOSA-N 2 0 334.507 4.290 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccncc2Cl)cc1 ZINC000421820947 1036773082 /nfs/dbraw/zinc/77/30/82/1036773082.db2.gz ONYCXGHWIIJHRV-OAHLLOKOSA-N 2 0 331.891 4.428 20 0 EIADRP CC[N@H+](CCC1CC[NH+](C[C@H]2C[C@@H](C)O[C@@H](C)C2)CC1)CC(C)C ZINC001168414258 1036824439 /nfs/dbraw/zinc/82/44/39/1036824439.db2.gz OIBUIVHLAVAVAJ-KXTWHKPSSA-N 2 0 338.580 4.270 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421891894 1036838073 /nfs/dbraw/zinc/83/80/73/1036838073.db2.gz YYNYKUCJWUJQSW-ALLBUHFWSA-N 2 0 325.500 4.316 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1csc(-c2ccccc2F)n1 ZINC000421868868 1036840492 /nfs/dbraw/zinc/84/04/92/1036840492.db2.gz CTCSSJUTNJTSRY-NFOMZHRRSA-N 2 0 347.503 4.473 20 0 EIADRP CCOc1ccc(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc1F ZINC000486933844 1036896254 /nfs/dbraw/zinc/89/62/54/1036896254.db2.gz JBUBBBXJOHRVQB-UHFFFAOYSA-N 2 0 342.458 4.110 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@H]2CCC23CCOCC3)cc1 ZINC000669698638 1037014601 /nfs/dbraw/zinc/01/46/01/1037014601.db2.gz VPQYIEAEZUJZCL-RXVVDRJESA-N 2 0 342.527 4.110 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2cccc(OC(F)(F)F)c2)C1 ZINC000590301378 1037036823 /nfs/dbraw/zinc/03/68/23/1037036823.db2.gz CLJYQADKTALOFP-HNNXBMFYSA-N 2 0 344.421 4.187 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1sccc1Br ZINC000572950948 1037094512 /nfs/dbraw/zinc/09/45/12/1037094512.db2.gz HOQOEAKWXANOSE-UNXYVOJBSA-N 2 0 331.323 4.034 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2c(Cl)ccc3cccnc32)CC1 ZINC000590786266 1037167887 /nfs/dbraw/zinc/16/78/87/1037167887.db2.gz LTBAIQAGGRSTOR-UHFFFAOYSA-N 2 0 345.918 4.440 20 0 EIADRP Cc1cc(C)cc(OCCC[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)c1 ZINC000590819067 1037183473 /nfs/dbraw/zinc/18/34/73/1037183473.db2.gz YADLPBQBNGTYDT-UHFFFAOYSA-N 2 0 332.532 4.125 20 0 EIADRP CC(C)[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CS1 ZINC000488414666 1037581975 /nfs/dbraw/zinc/58/19/75/1037581975.db2.gz HIDZUXGLTYWYRB-UXHICEINSA-N 2 0 332.557 4.018 20 0 EIADRP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)CS1 ZINC000488434581 1037593559 /nfs/dbraw/zinc/59/35/59/1037593559.db2.gz JEAZSXIEQXQFOE-ZCNNSNEGSA-N 2 0 346.584 4.061 20 0 EIADRP C/C(=C\c1ccccc1)C[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000488459046 1037600499 /nfs/dbraw/zinc/60/04/99/1037600499.db2.gz NCNAKZCMSKCHLL-VVMUCNELSA-N 2 0 334.507 4.244 20 0 EIADRP Cc1cc(C)c(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)c(C)c1 ZINC000488571534 1037669278 /nfs/dbraw/zinc/66/92/78/1037669278.db2.gz STTYPOQFVNSGBI-JOCHJYFZSA-N 2 0 336.523 4.266 20 0 EIADRP C[C@@H](C[NH+]1CCC([NH2+]CC2CC2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000414656217 1037686177 /nfs/dbraw/zinc/68/61/77/1037686177.db2.gz IBFGERGGWSJRFX-AWEZNQCLSA-N 2 0 340.433 4.273 20 0 EIADRP CC[NH2+]CC1CC[NH+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000414658881 1037696558 /nfs/dbraw/zinc/69/65/58/1037696558.db2.gz KHTBNZVPNRSGBM-CQSZACIVSA-N 2 0 328.422 4.130 20 0 EIADRP C[NH2+]CCC1CC[NH+](Cc2ccc(-c3ccccc3OC)cc2)CC1 ZINC000414663343 1037709420 /nfs/dbraw/zinc/70/94/20/1037709420.db2.gz RGDGRQBSSGLGNF-UHFFFAOYSA-N 2 0 338.495 4.184 20 0 EIADRP C[NH2+]CC1CC[NH+](Cc2cc(-c3ccccc3C)ccc2OC)CC1 ZINC000414666387 1037731155 /nfs/dbraw/zinc/73/11/55/1037731155.db2.gz GGUKDBANTVISOI-UHFFFAOYSA-N 2 0 338.495 4.102 20 0 EIADRP Cc1ccccc1[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)C1CC1 ZINC000422711917 1037804529 /nfs/dbraw/zinc/80/45/29/1037804529.db2.gz NJWNRHFFIJSOLT-WWNPGLIZSA-N 2 0 348.490 4.292 20 0 EIADRP CCCC[C@@H]([NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)c1ccc(OC)cc1 ZINC000422718072 1037812427 /nfs/dbraw/zinc/81/24/27/1037812427.db2.gz WLQZOFYBIUDOGF-HRAATJIYSA-N 2 0 341.499 4.439 20 0 EIADRP c1ccc2c(c1)cccc2CSCC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000592468524 1037817802 /nfs/dbraw/zinc/81/78/02/1037817802.db2.gz BCCNLYCVSSMECD-YZGWKJHDSA-N 2 0 340.536 4.051 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@@H](C)CCCC[NH3+] ZINC000422745141 1037823219 /nfs/dbraw/zinc/82/32/19/1037823219.db2.gz UOIBMBDLPJTDCZ-QWHCGFSZSA-N 2 0 335.492 4.426 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H](C)CCCC[NH3+] ZINC000422745142 1037823502 /nfs/dbraw/zinc/82/35/02/1037823502.db2.gz UOIBMBDLPJTDCZ-STQMWFEESA-N 2 0 335.492 4.426 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](Cc1ccccc1)c1ccccc1 ZINC000422773960 1037830019 /nfs/dbraw/zinc/83/00/19/1037830019.db2.gz ZLXBJHIPXYZSQE-WZONZLPQSA-N 2 0 345.490 4.483 20 0 EIADRP CC(C)[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1 ZINC000422776361 1037831476 /nfs/dbraw/zinc/83/14/76/1037831476.db2.gz AJAWCECDIATSAU-HJNYFJLDSA-N 2 0 336.479 4.229 20 0 EIADRP COc1ccc([C@@H]([NH2+][C@@H](C)CCC[NH3+])c2ccccc2Cl)c(C)c1 ZINC000422797009 1037834450 /nfs/dbraw/zinc/83/44/50/1037834450.db2.gz KWNOHSFJYVDNBS-MGPUTAFESA-N 2 0 346.902 4.463 20 0 EIADRP C[C@H](OCCC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)c1ccccc1 ZINC000422788267 1037835048 /nfs/dbraw/zinc/83/50/48/1037835048.db2.gz QXSPUWZPVAEKIW-MJUUVYJYSA-N 2 0 330.516 4.055 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+][C@H]3CC[NH2+]CC[C@@H]3C)cc2)cs1 ZINC000422800627 1037835742 /nfs/dbraw/zinc/83/57/42/1037835742.db2.gz CLWURUFELMMDFY-DEYYWGMASA-N 2 0 329.513 4.157 20 0 EIADRP Cc1cccc(Oc2cc(C[NH2+][C@H](C)CCCC[NH3+])ccn2)c1C ZINC000422803457 1037836045 /nfs/dbraw/zinc/83/60/45/1037836045.db2.gz GALINCAJCATNPS-MRXNPFEDSA-N 2 0 327.472 4.098 20 0 EIADRP C[C@H](CC[NH2+][C@H]1CC[NH2+]CC[C@@H]1C)c1cccc(C(F)(F)F)c1 ZINC000422806065 1037837603 /nfs/dbraw/zinc/83/76/03/1037837603.db2.gz HRUKHBJAHFHFCI-KEYYUXOJSA-N 2 0 328.422 4.177 20 0 EIADRP Cc1ccc([C@@H]2OCCC[C@@H]2C[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000422804650 1037838341 /nfs/dbraw/zinc/83/83/41/1037838341.db2.gz HZLWWIINTYYVGC-MNAPGUCWSA-N 2 0 336.479 4.197 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000422814975 1037840441 /nfs/dbraw/zinc/84/04/41/1037840441.db2.gz WSFMKLDNQPTGHX-HOTGVXAUSA-N 2 0 346.478 4.323 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1ccc(-c2cccnc2)cc1 ZINC000422824155 1037841244 /nfs/dbraw/zinc/84/12/44/1037841244.db2.gz NEHBIGDDJWABGV-HOTGVXAUSA-N 2 0 346.478 4.323 20 0 EIADRP Fc1cccc(C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c2cccc(F)c2)c1 ZINC000422836037 1037842772 /nfs/dbraw/zinc/84/27/72/1037842772.db2.gz ZMUVCOGUERRKDA-JGUMPVPUSA-N 2 0 342.433 4.121 20 0 EIADRP FC(F)(F)c1ccc([C@H]2CCCC[C@H]2[NH2+]C2CC[NH2+]CC2)cc1 ZINC000422831610 1037843035 /nfs/dbraw/zinc/84/30/35/1037843035.db2.gz WVLAQMDYYBJLML-IAGOWNOFSA-N 2 0 326.406 4.073 20 0 EIADRP CC(C)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(Cl)c(Cl)c1 ZINC000422838276 1037843668 /nfs/dbraw/zinc/84/36/68/1037843668.db2.gz NYPMBEPKNAMPMF-PBWFPOADSA-N 2 0 327.299 4.144 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@@H](C)C1C[NH2+]C1 ZINC000422884743 1037854265 /nfs/dbraw/zinc/85/42/65/1037854265.db2.gz FOYIQBCSQMNLAV-QWRGUYRKSA-N 2 0 335.904 4.030 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1cccc(OC(C)C)c1 ZINC000422886718 1037854361 /nfs/dbraw/zinc/85/43/61/1037854361.db2.gz XFOGUDIKXRNXHB-LSDHHAIUSA-N 2 0 327.472 4.048 20 0 EIADRP CC[NH+](CC)[C@H](CN[C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1)c1ccsc1 ZINC000422868783 1037856292 /nfs/dbraw/zinc/85/62/92/1037856292.db2.gz WAUGUVVCDYFZMO-IYWMVGAKSA-N 2 0 349.588 4.031 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1F ZINC000422873732 1037860596 /nfs/dbraw/zinc/86/05/96/1037860596.db2.gz LYCFIIBPQGFCAV-NYSBEXSLSA-N 2 0 340.442 4.041 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](c1ccc(Br)cc1)C1CCC1 ZINC000422935786 1037875509 /nfs/dbraw/zinc/87/55/09/1037875509.db2.gz DRBVASUXYUDQRJ-MLGOLLRUSA-N 2 0 325.294 4.007 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCc1cccc(Cl)c1Cl ZINC000422935769 1037876641 /nfs/dbraw/zinc/87/66/41/1037876641.db2.gz DPCLOVKAZWCKJX-LLVKDONJSA-N 2 0 338.282 4.049 20 0 EIADRP COC[C@H](CCC[NH3+])[NH2+][C@H](c1cccc(C(F)(F)F)c1)C(C)(C)C ZINC000422920655 1037878870 /nfs/dbraw/zinc/87/88/70/1037878870.db2.gz MMJBESLTFXPCRR-JKSUJKDBSA-N 2 0 346.437 4.136 20 0 EIADRP c1cc(OC2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000422946883 1037885657 /nfs/dbraw/zinc/88/56/57/1037885657.db2.gz PQJBYDREJBWYIK-PCCBWWKXSA-N 2 0 328.500 4.018 20 0 EIADRP CCC[C@H]([NH2+][C@H](CCC[NH3+])COC)c1ccc(Cl)c(Cl)c1 ZINC000422958604 1037889194 /nfs/dbraw/zinc/88/91/94/1037889194.db2.gz YKJXXQPHWFZGNB-CJNGLKHVSA-N 2 0 333.303 4.178 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c2ccccc21 ZINC000422993380 1037891839 /nfs/dbraw/zinc/89/18/39/1037891839.db2.gz SRTPNRIENPSQBF-MZKRTTBSSA-N 2 0 348.490 4.255 20 0 EIADRP [NH3+]CC1CCC([NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000423019321 1037902103 /nfs/dbraw/zinc/90/21/03/1037902103.db2.gz VBSYVJIRTSGKPI-UAIPMZCESA-N 2 0 326.406 4.264 20 0 EIADRP Cc1cc([C@H]([NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)C2CC2)ccc1F ZINC000423015956 1037903463 /nfs/dbraw/zinc/90/34/63/1037903463.db2.gz RXHUBUWRLAXTHD-VBKZILBWSA-N 2 0 327.447 4.098 20 0 EIADRP CC[N@H+](Cc1ccc(-c2ccccc2OC)cc1)[C@H]1CCC[NH2+]CC1 ZINC000414712454 1037910690 /nfs/dbraw/zinc/91/06/90/1037910690.db2.gz IXUMQCMFGMCKFO-FQEVSTJZSA-N 2 0 338.495 4.326 20 0 EIADRP [NH3+][C@H]1C[C@H]([NH+]2CCC(Cc3ccc(F)c(F)c3)CC2)c2ccccc21 ZINC000423046145 1037924799 /nfs/dbraw/zinc/92/47/99/1037924799.db2.gz DVOSYYNFBAAURW-SFTDATJTSA-N 2 0 342.433 4.364 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC(C)(C)c1cccc(Cl)c1F ZINC000423056282 1037925474 /nfs/dbraw/zinc/92/54/74/1037925474.db2.gz XXIPLWAGYFKRQP-GFCCVEGCSA-N 2 0 349.881 4.270 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000423060505 1037928016 /nfs/dbraw/zinc/92/80/16/1037928016.db2.gz OQBGEWVUJZQXLH-GFCCVEGCSA-N 2 0 337.389 4.027 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cc2ccccc2o1 ZINC000423060286 1037931199 /nfs/dbraw/zinc/93/11/99/1037931199.db2.gz NZUULJMBPZZYBU-FXCLAUTBSA-N 2 0 348.446 4.339 20 0 EIADRP c1ccc2c(c1)O[C@]1(CC[NH2+]C1)C[C@@H]2[NH2+]Cc1ccc(C2CCC2)cc1 ZINC000423067842 1037934575 /nfs/dbraw/zinc/93/45/75/1037934575.db2.gz AGHPXJNQYUNESD-JTHBVZDNSA-N 2 0 348.490 4.300 20 0 EIADRP COCCCC[C@H]([NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)c1ccccc1 ZINC000423085561 1037945387 /nfs/dbraw/zinc/94/53/87/1037945387.db2.gz KTYQFOFHVRZCHJ-UWJYYQICSA-N 2 0 341.499 4.057 20 0 EIADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@H]1CC[C@H](c2ccc(F)cc2)C1 ZINC000423087596 1037948999 /nfs/dbraw/zinc/94/89/99/1037948999.db2.gz PYDOCJKNCVBRGD-HGWQEYRNSA-N 2 0 326.459 4.010 20 0 EIADRP C[C@H]1CC[NH2+]CC[C@H]1[NH2+][C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000423095006 1037955504 /nfs/dbraw/zinc/95/55/04/1037955504.db2.gz DATCRFHAJUVVQS-PLNCSYRRSA-N 2 0 327.299 4.217 20 0 EIADRP FC(F)(F)c1cccc([C@@H]([NH2+][C@@H]2CCC[NH2+]CC2)C2CCC2)c1 ZINC000423107105 1037982237 /nfs/dbraw/zinc/98/22/37/1037982237.db2.gz PGOSBYKHDLFFOF-SJORKVTESA-N 2 0 326.406 4.278 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+][C@@H](C)[C@H]3CCC[NH2+]C3)cs2)cs1 ZINC000423216834 1038062591 /nfs/dbraw/zinc/06/25/91/1038062591.db2.gz PCOITSMBJVATIE-OBJOEFQTSA-N 2 0 335.542 4.219 20 0 EIADRP CSC[C@@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1 ZINC000593321275 1038063126 /nfs/dbraw/zinc/06/31/26/1038063126.db2.gz HIUQUQNPYIHRGR-MRXNPFEDSA-N 2 0 346.462 4.089 20 0 EIADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1ccc(SCC(F)F)cc1 ZINC000423262852 1038074416 /nfs/dbraw/zinc/07/44/16/1038074416.db2.gz WHSYHDCPENRJCJ-ZIAGYGMSSA-N 2 0 328.472 4.084 20 0 EIADRP CC1(C)C[C@H]([NH2+]C2CCC([NH3+])CC2)c2cc(Br)ccc21 ZINC000423242122 1038075271 /nfs/dbraw/zinc/07/52/71/1038075271.db2.gz YNXSVORBHGCHRR-ZUEPYMLJSA-N 2 0 337.305 4.031 20 0 EIADRP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000503992135 1038076187 /nfs/dbraw/zinc/07/61/87/1038076187.db2.gz ILIKHWVGPXXKOZ-AWEZNQCLSA-N 2 0 328.422 4.430 20 0 EIADRP CC[NH+](CC)CC1CC[NH+]([C@H](C)c2ncc(-c3ccccc3)o2)CC1 ZINC000607357990 1038077059 /nfs/dbraw/zinc/07/70/59/1038077059.db2.gz PMEFKDKXOSRLLY-QGZVFWFLSA-N 2 0 341.499 4.456 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCc3cc(Br)ccc32)cc1 ZINC000423293062 1038098733 /nfs/dbraw/zinc/09/87/33/1038098733.db2.gz POWLLTRYMFXMNI-SGTLLEGYSA-N 2 0 345.284 4.246 20 0 EIADRP [NH3+][C@H](C[NH2+][C@@H]1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1)C1CC1 ZINC000423315523 1038112842 /nfs/dbraw/zinc/11/28/42/1038112842.db2.gz IWPRQOJDMRVMFA-BRWVUGGUSA-N 2 0 326.406 4.059 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccccc2Br)cc1 ZINC000423293890 1038118639 /nfs/dbraw/zinc/11/86/39/1038118639.db2.gz SKHXCXRRIQLCGV-STQMWFEESA-N 2 0 333.273 4.320 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)CCCS2 ZINC000423295685 1038118942 /nfs/dbraw/zinc/11/89/42/1038118942.db2.gz XEICSOYVSQAHKA-LIRRHRJNSA-N 2 0 342.508 4.432 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1OC ZINC000423296232 1038119278 /nfs/dbraw/zinc/11/92/78/1038119278.db2.gz YPWQTYXVPALZEG-BZUAXINKSA-N 2 0 342.483 4.005 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000423371578 1038188912 /nfs/dbraw/zinc/18/89/12/1038188912.db2.gz GPPDKPJQFKLHQT-JQFCIGGWSA-N 2 0 329.513 4.347 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000423371580 1038191306 /nfs/dbraw/zinc/19/13/06/1038191306.db2.gz GPPDKPJQFKLHQT-RRQGHBQHSA-N 2 0 329.513 4.347 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000423385164 1038194525 /nfs/dbraw/zinc/19/45/25/1038194525.db2.gz GKVVXRQQHWAWPX-JKIFEVAISA-N 2 0 329.513 4.076 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2ccccc2Cl)c2cccs2)CC[NH2+]1 ZINC000423388618 1038199273 /nfs/dbraw/zinc/19/92/73/1038199273.db2.gz UHGDEOHQTGUAOI-UKPHBRMFSA-N 2 0 334.916 4.415 20 0 EIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423395252 1038203620 /nfs/dbraw/zinc/20/36/20/1038203620.db2.gz RWOGVIIFBTZRSX-CYBMUJFWSA-N 2 0 334.385 4.029 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423399829 1038204354 /nfs/dbraw/zinc/20/43/54/1038204354.db2.gz VEEPFFAEUCOAAA-XFBWCDHKSA-N 2 0 332.900 4.287 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423405141 1038216174 /nfs/dbraw/zinc/21/61/74/1038216174.db2.gz ZNXLZCIWLYXKHF-DYEKYZERSA-N 2 0 332.435 4.132 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](c1ccc(F)cc1)c1cnc2ccccc2c1 ZINC000423443824 1038225450 /nfs/dbraw/zinc/22/54/50/1038225450.db2.gz AQMSDGMOGFMQEK-VFNWGFHPSA-N 2 0 337.442 4.180 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](c1ccc(Br)cc1F)C1CC1 ZINC000423447660 1038227131 /nfs/dbraw/zinc/22/71/31/1038227131.db2.gz ZWKPXWXFQOHHDB-BDJLRTHQSA-N 2 0 343.284 4.146 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3)cc1 ZINC000423437738 1038235304 /nfs/dbraw/zinc/23/53/04/1038235304.db2.gz GOCPZMUADDDYCY-INIZCTEOSA-N 2 0 346.478 4.390 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3)cc1 ZINC000423437739 1038236448 /nfs/dbraw/zinc/23/64/48/1038236448.db2.gz GOCPZMUADDDYCY-MRXNPFEDSA-N 2 0 346.478 4.390 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1csc(-c2ccccc2F)n1 ZINC000423468196 1038244074 /nfs/dbraw/zinc/24/40/74/1038244074.db2.gz JOGMSOGZHRKHGX-MJBXVCDLSA-N 2 0 333.476 4.117 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccc(F)c(F)c1 ZINC000423475051 1038246584 /nfs/dbraw/zinc/24/65/84/1038246584.db2.gz PTKOGYYQETVHGX-RPVQJOFSSA-N 2 0 348.412 4.148 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423470714 1038247903 /nfs/dbraw/zinc/24/79/03/1038247903.db2.gz LUTGWGKHJWBQON-BRWVUGGUSA-N 2 0 327.516 4.331 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccsc1 ZINC000423474392 1038247981 /nfs/dbraw/zinc/24/79/81/1038247981.db2.gz OSJGAYVXBHLANC-UHOSZYNNSA-N 2 0 332.488 4.321 20 0 EIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000423501142 1038258479 /nfs/dbraw/zinc/25/84/79/1038258479.db2.gz LALOSUUYSPLCAC-KBXCAEBGSA-N 2 0 334.410 4.419 20 0 EIADRP COc1ccc([C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)c2ccc(F)cc2)cc1 ZINC000423487926 1038259076 /nfs/dbraw/zinc/25/90/76/1038259076.db2.gz UUZUYZZFOOALKS-TZIWHRDSSA-N 2 0 342.458 4.046 20 0 EIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423487725 1038260410 /nfs/dbraw/zinc/26/04/10/1038260410.db2.gz UPKJNFGWKKPDTA-WMLDXEAASA-N 2 0 328.422 4.148 20 0 EIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000423511487 1038270558 /nfs/dbraw/zinc/27/05/58/1038270558.db2.gz TUXXUHHSYFHMJU-UWJYYQICSA-N 2 0 334.467 4.003 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423512029 1038270837 /nfs/dbraw/zinc/27/08/37/1038270837.db2.gz UFQIKIJLTMIGEE-VGSWGCGISA-N 2 0 348.494 4.312 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+][C@H](CCC[NH3+])c2ccccc2)C1 ZINC000423512566 1038271200 /nfs/dbraw/zinc/27/12/00/1038271200.db2.gz OOVKAFJRJGMAPJ-NJDAHSKKSA-N 2 0 337.511 4.486 20 0 EIADRP COc1cc(C)c([C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1OC ZINC000423516979 1038272260 /nfs/dbraw/zinc/27/22/60/1038272260.db2.gz YJEAOLWALIJDFK-APWZRJJASA-N 2 0 342.483 4.143 20 0 EIADRP Fc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC[NH2+]C2CC2)CCC3)cc1 ZINC000423524663 1038278019 /nfs/dbraw/zinc/27/80/19/1038278019.db2.gz JRZBXMJGGFKAOK-INIZCTEOSA-N 2 0 345.487 4.058 20 0 EIADRP c1ccc2c(c1)sc1c2CCC[C@H]1[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423557511 1038283915 /nfs/dbraw/zinc/28/39/15/1038283915.db2.gz ZWNWCCJRRFSLTH-LUXYFRNMSA-N 2 0 326.509 4.256 20 0 EIADRP FC(F)(F)c1ccc([C@H]2CC[C@@H]([NH2+]CCC3=CC[NH2+]CC3)C2)cc1 ZINC000423535387 1038284761 /nfs/dbraw/zinc/28/47/61/1038284761.db2.gz CWMPWANFXPQPPL-FUHWJXTLSA-N 2 0 338.417 4.241 20 0 EIADRP CC(C)Oc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)cc1Cl ZINC000423540231 1038285208 /nfs/dbraw/zinc/28/52/08/1038285208.db2.gz DCWTVFWWYRVUQN-QSPRXWTASA-N 2 0 336.907 4.166 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423538693 1038285773 /nfs/dbraw/zinc/28/57/73/1038285773.db2.gz GVTWYVLFRCABNR-VIBAHUMZSA-N 2 0 341.524 4.157 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(OC(F)(F)F)cc1 ZINC000423540971 1038287075 /nfs/dbraw/zinc/28/70/75/1038287075.db2.gz KGJGTGLRJWZPAV-MPTYRVRUSA-N 2 0 342.405 4.014 20 0 EIADRP c1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC2=CC[NH2+]CC2)CCC3)cc1 ZINC000423544165 1038288900 /nfs/dbraw/zinc/28/89/00/1038288900.db2.gz VYMZPHSDHZHEIC-KRWDZBQOSA-N 2 0 339.508 4.087 20 0 EIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@H]3C[NH2+]C[C@@H]3C1)CCCO2 ZINC000423542158 1038289838 /nfs/dbraw/zinc/28/98/38/1038289838.db2.gz LUUKQGMZALNVLE-PNYFIKQUSA-N 2 0 328.500 4.001 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)C(c1ccccc1)c1ccccc1 ZINC000423548010 1038292380 /nfs/dbraw/zinc/29/23/80/1038292380.db2.gz QSUDZLBSHGEFSZ-KVJIRVJXSA-N 2 0 334.507 4.185 20 0 EIADRP COc1ccc([C@@H]([NH2+]CCCC[NH+](C)C)c2ccccc2Cl)cc1 ZINC000490149335 1038344649 /nfs/dbraw/zinc/34/46/49/1038344649.db2.gz IYWPCLKPKDVTNQ-HXUWFJFHSA-N 2 0 346.902 4.369 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)CC[N@@H+]1C ZINC000608061541 1038442394 /nfs/dbraw/zinc/44/23/94/1038442394.db2.gz JLQCDGZVCNUQEF-WIYYLYMNSA-N 2 0 347.506 4.262 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC[N@@H+]1C ZINC000608061500 1038442766 /nfs/dbraw/zinc/44/27/66/1038442766.db2.gz WIQARCLZVWEGLI-KDOFPFPSSA-N 2 0 346.421 4.329 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)c(Cl)c1 ZINC000424265502 1038761687 /nfs/dbraw/zinc/76/16/87/1038761687.db2.gz VTMHKJJZTITVTQ-AWEZNQCLSA-N 2 0 332.875 4.261 20 0 EIADRP Clc1cccc2c1CC[C@@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000539037451 1038788982 /nfs/dbraw/zinc/78/89/82/1038788982.db2.gz MTSQOMGZGGJVTG-FQEVSTJZSA-N 2 0 341.886 4.229 20 0 EIADRP CCCc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)cc1 ZINC000539064133 1038794664 /nfs/dbraw/zinc/79/46/64/1038794664.db2.gz FTRFMCDBQVNANY-BULFRSBZSA-N 2 0 344.543 4.058 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](Cc2ccncc2)c2cccs2)C1 ZINC000424311946 1038797394 /nfs/dbraw/zinc/79/73/94/1038797394.db2.gz LNZKKMFZBSLTNU-MOPGFXCFSA-N 2 0 343.540 4.137 20 0 EIADRP FC1(F)CCC(CC2CC2)([NH2+]C2CC[NH+](CC3CC3)CC2)CC1 ZINC001168364281 1038801680 /nfs/dbraw/zinc/80/16/80/1038801680.db2.gz AVZXQWRZTXVHII-UHFFFAOYSA-N 2 0 326.475 4.199 20 0 EIADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000424381081 1038839817 /nfs/dbraw/zinc/83/98/17/1038839817.db2.gz YENNDNIOTLRCEK-QMCVQRASSA-N 2 0 326.406 4.201 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cccc(F)c1Br ZINC000156679201 1038870795 /nfs/dbraw/zinc/87/07/95/1038870795.db2.gz MXJYDCMDPBJJCY-CYBMUJFWSA-N 2 0 345.300 4.188 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@@H](CCc2ccccc2)Cc2ccccc2)CCN1C ZINC000462104071 1038908501 /nfs/dbraw/zinc/90/85/01/1038908501.db2.gz JONLIIFIIAHOBE-OIBXWCBGSA-N 2 0 336.523 4.303 20 0 EIADRP c1sc(CC[NH2+]C2CC[NH+](CC3CC3)CC2)nc1C1CCCCC1 ZINC000539262178 1038917661 /nfs/dbraw/zinc/91/76/61/1038917661.db2.gz CHILDQHXJYYHSJ-UHFFFAOYSA-N 2 0 347.572 4.197 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(-c3ccco3)cc2F)[C@@H]2CCC[C@@H]21 ZINC000552057360 1039076652 /nfs/dbraw/zinc/07/66/52/1039076652.db2.gz QDNPBNQPRRABEN-WDSOQIARSA-N 2 0 328.431 4.048 20 0 EIADRP CSc1ccccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000481187266 1039090035 /nfs/dbraw/zinc/09/00/35/1039090035.db2.gz ZAKFLJTZFYBXGZ-YLJYHZDGSA-N 2 0 340.536 4.409 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2OC(F)F)C1 ZINC000481296916 1039235679 /nfs/dbraw/zinc/23/56/79/1039235679.db2.gz BDIMYOLMVBQDEG-LSDHHAIUSA-N 2 0 348.437 4.434 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CCc3cc(Cl)ccc32)ccc1F ZINC000120965729 1039248984 /nfs/dbraw/zinc/24/89/84/1039248984.db2.gz YDOZZZKAWVGLNS-IBGZPJMESA-N 2 0 332.850 4.318 20 0 EIADRP C[NH2+]C[C@@H](C)CNCc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000414834103 1039257785 /nfs/dbraw/zinc/25/77/85/1039257785.db2.gz GXCDHLLSESCTSV-SNVBAGLBSA-N 2 0 344.311 4.062 20 0 EIADRP C[C@@H](CCc1ccc(F)cc1F)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000552239978 1039305949 /nfs/dbraw/zinc/30/59/49/1039305949.db2.gz HRVOOLJQKWGXAQ-HNNXBMFYSA-N 2 0 332.438 4.137 20 0 EIADRP CCC1(C[NH2+][C@@H](C)c2ccncc2)CC[NH+](Cc2ccccc2)CC1 ZINC000513873225 1039341265 /nfs/dbraw/zinc/34/12/65/1039341265.db2.gz VBNSWJMPWUYIGG-IBGZPJMESA-N 2 0 337.511 4.425 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1cc(C)ccc1OC ZINC000091725136 1039386887 /nfs/dbraw/zinc/38/68/87/1039386887.db2.gz XEPCZIWJAUXXFM-FQEVSTJZSA-N 2 0 344.474 4.445 20 0 EIADRP Cc1cc([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)c(C)s1 ZINC000122288509 1039637444 /nfs/dbraw/zinc/63/74/44/1039637444.db2.gz NPYWODNQWKHXPV-HNNXBMFYSA-N 2 0 332.513 4.156 20 0 EIADRP CC[N@H+](CCC1CC[NH+](CCc2csc(C)n2)CC1)CC(C)C ZINC000552641720 1039725777 /nfs/dbraw/zinc/72/57/77/1039725777.db2.gz YRNUZDIDLTZOHB-UHFFFAOYSA-N 2 0 337.577 4.074 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCc2ccccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000505465511 1039803750 /nfs/dbraw/zinc/80/37/50/1039803750.db2.gz VRNJWMOSSZGMJE-VLCRHTCISA-N 2 0 334.507 4.217 20 0 EIADRP COc1ccc2ccccc2c1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000537647606 1039805962 /nfs/dbraw/zinc/80/59/62/1039805962.db2.gz UUJYJCPSXSKQEU-GOSISDBHSA-N 2 0 338.495 4.156 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CC=C(C)CC2)cc1OC ZINC000550891637 1039814231 /nfs/dbraw/zinc/81/42/31/1039814231.db2.gz OPPBNLGRSXNMLU-LJQANCHMSA-N 2 0 346.515 4.004 20 0 EIADRP c1ccc2c(c1)C=C(C[NH+]1CCC(CCC[NH+]3CCCC3)CC1)CO2 ZINC000537650403 1039826823 /nfs/dbraw/zinc/82/68/23/1039826823.db2.gz CBGBHZLQVRAJNI-UHFFFAOYSA-N 2 0 340.511 4.050 20 0 EIADRP C[C@H](COc1cccc(F)c1)[NH2+][C@@H]1CCN(C)[C@@H](c2ccccc2)C1 ZINC000551008626 1039860815 /nfs/dbraw/zinc/86/08/15/1039860815.db2.gz YLIHBXHXVGQXAU-OZOXKJRCSA-N 2 0 342.458 4.018 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+][C@H](C)CC[NH+](C)C)CCC3)cc1 ZINC000481960136 1039911189 /nfs/dbraw/zinc/91/11/89/1039911189.db2.gz LQTKPVAXOWDTCH-WBVHZDCISA-N 2 0 343.540 4.426 20 0 EIADRP COc1ccc(CC[C@@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000481978126 1039921707 /nfs/dbraw/zinc/92/17/07/1039921707.db2.gz ZJLPEQFGKBXERU-GOSISDBHSA-N 2 0 344.543 4.403 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2nc3ccccc3n2CC)CC1 ZINC000535067177 1039933844 /nfs/dbraw/zinc/93/38/44/1039933844.db2.gz KMVGDTGKVOBGAU-UHFFFAOYSA-N 2 0 342.531 4.000 20 0 EIADRP Cc1cccnc1C(C)(C)C[NH2+]C1CC[NH+]([C@H]2CCC[C@H](C)C2)CC1 ZINC000514637712 1040073465 /nfs/dbraw/zinc/07/34/65/1040073465.db2.gz SLUWKGAHGLSIGF-PXNSSMCTSA-N 2 0 343.559 4.300 20 0 EIADRP Cc1cc(CC[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)cc(C)c1O ZINC000470139391 1040097155 /nfs/dbraw/zinc/09/71/55/1040097155.db2.gz BQGAQMGWRZTGCI-IIBYNOLFSA-N 2 0 344.543 4.184 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)[C@]1(C)CCCO1 ZINC000551268552 1040132148 /nfs/dbraw/zinc/13/21/48/1040132148.db2.gz XYHOSQDLBSAECN-LQWHRVPQSA-N 2 0 330.516 4.108 20 0 EIADRP Cc1cccc2c1CC[C@@H]2[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000482455387 1040267250 /nfs/dbraw/zinc/26/72/50/1040267250.db2.gz YMTMZFLTWBKIGT-OFNKIYASSA-N 2 0 334.507 4.137 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(F)cc2OC(F)F)CC1 ZINC000482498808 1040292624 /nfs/dbraw/zinc/29/26/24/1040292624.db2.gz CLSBGBCUBSAXLX-ZDUSSCGKSA-N 2 0 344.421 4.200 20 0 EIADRP COc1cc2c(NC3CC[NH+](C(C)(C)C)CC3)cc[nH+]c2cc1F ZINC000479373976 1040295195 /nfs/dbraw/zinc/29/51/95/1040295195.db2.gz HDIRBQDAAUVFCM-UHFFFAOYSA-N 2 0 331.435 4.057 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000482562922 1040352111 /nfs/dbraw/zinc/35/21/11/1040352111.db2.gz DYWFPQPKUIAJQF-OLZOCXBDSA-N 2 0 345.314 4.081 20 0 EIADRP Cc1cc2[nH]c(C[NH2+]C3CC[NH+](C4CCCC4)CC3)cc2c(C)c1 ZINC000479473629 1040380804 /nfs/dbraw/zinc/38/08/04/1040380804.db2.gz GJNLWXYHVKDGPK-UHFFFAOYSA-N 2 0 325.500 4.281 20 0 EIADRP C[NH+]1CCC(CC[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC000551534853 1040393927 /nfs/dbraw/zinc/39/39/27/1040393927.db2.gz QLLPIHZUFQBZBE-UHFFFAOYSA-N 2 0 349.931 4.285 20 0 EIADRP CCCCCOc1cc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)ccc1OC ZINC000666995329 1040403738 /nfs/dbraw/zinc/40/37/38/1040403738.db2.gz KGLSDPOMJRHNKK-GOSISDBHSA-N 2 0 346.515 4.029 20 0 EIADRP c1ccc(COc2ccc(C[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)cc2)cc1 ZINC000666998388 1040419260 /nfs/dbraw/zinc/41/92/60/1040419260.db2.gz QMFWLMYRXODVHL-HXUWFJFHSA-N 2 0 336.479 4.030 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cc2cc(Cl)ccc2o1 ZINC000539494271 1040468203 /nfs/dbraw/zinc/46/82/03/1040468203.db2.gz CQNZUUJZBKPNPX-CJNGLKHVSA-N 2 0 338.879 4.094 20 0 EIADRP c1ccc(C[NH+]2CCC[C@H]3C[N@H+](CCCc4ccncc4)CC[C@H]32)cc1 ZINC000462314228 1040474003 /nfs/dbraw/zinc/47/40/03/1040474003.db2.gz JBUAKLCMTLYAFJ-XZOQPEGZSA-N 2 0 349.522 4.001 20 0 EIADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(-c2ccc(F)cc2)s1 ZINC000539507852 1040499816 /nfs/dbraw/zinc/49/98/16/1040499816.db2.gz QMANIGYGNLUUIW-CQSZACIVSA-N 2 0 330.472 4.467 20 0 EIADRP CC[N@H+](CCC1CC[NH+](CCCc2ccncc2)CC1)CC(C)C ZINC000462349385 1040507047 /nfs/dbraw/zinc/50/70/47/1040507047.db2.gz SALNKYFEBSHKSD-UHFFFAOYSA-N 2 0 331.548 4.094 20 0 EIADRP CCc1ccc([C@H](C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)o1 ZINC000482881944 1040548093 /nfs/dbraw/zinc/54/80/93/1040548093.db2.gz FKBKFIPMVFZRIM-KRWDZBQOSA-N 2 0 342.483 4.167 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1c2ccccc2CCC[C@@H]1C ZINC000462540687 1040713681 /nfs/dbraw/zinc/71/36/81/1040713681.db2.gz UOGZTSJPLRPYJA-KSFYIVLOSA-N 2 0 346.478 4.379 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC000479859887 1040719766 /nfs/dbraw/zinc/71/97/66/1040719766.db2.gz NCPAJMWSNTVIRW-AWEZNQCLSA-N 2 0 331.529 4.357 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cccc(C)c2C)[C@H](C)C1 ZINC000483124220 1040720353 /nfs/dbraw/zinc/72/03/53/1040720353.db2.gz GJCOTELRKQFGFP-QFUCXCTJSA-N 2 0 332.532 4.091 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cccc(C)c2C)[C@H](C)C1 ZINC000483124218 1040720546 /nfs/dbraw/zinc/72/05/46/1040720546.db2.gz GJCOTELRKQFGFP-LMNJBCLMSA-N 2 0 332.532 4.091 20 0 EIADRP FC(F)(F)c1ccccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167959952 1040742462 /nfs/dbraw/zinc/74/24/62/1040742462.db2.gz VZWYWADNNPTXKX-ALOPSCKCSA-N 2 0 338.417 4.200 20 0 EIADRP C[C@@H](NCC(C)(C)C[NH+](C)C)c1cc(Cl)ccc1OC(F)F ZINC000479862784 1040750222 /nfs/dbraw/zinc/75/02/22/1040750222.db2.gz SFCFMPYRKUOVNG-LLVKDONJSA-N 2 0 334.838 4.180 20 0 EIADRP C[N@H+](Cc1ccnn1-c1cc[nH+]cc1)[C@H]1CCC[C@H]1c1ccccc1 ZINC000668235280 1040819948 /nfs/dbraw/zinc/81/99/48/1040819948.db2.gz HRDSXDUIDXKPBP-SFTDATJTSA-N 2 0 332.451 4.035 20 0 EIADRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(-c3ccccc3F)o2)CC1 ZINC000462752919 1040889190 /nfs/dbraw/zinc/88/91/90/1040889190.db2.gz BRLNPJUXKLDVJQ-UHFFFAOYSA-N 2 0 330.447 4.297 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](c2ccccc2F)C2CCOCC2)C1 ZINC000903090960 1040899577 /nfs/dbraw/zinc/89/95/77/1040899577.db2.gz KAKOUIHRIQXDMR-LAUBAEHRSA-N 2 0 348.506 4.003 20 0 EIADRP Cc1ccc2c(c1)CC[C@H]2[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000537938481 1040902485 /nfs/dbraw/zinc/90/24/85/1040902485.db2.gz BAICTLKMIXXNBH-VGOFRKELSA-N 2 0 338.495 4.274 20 0 EIADRP CC(C)C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1 ZINC000537955147 1040924751 /nfs/dbraw/zinc/92/47/51/1040924751.db2.gz JFXVAURZBMYVNH-BHDDXSALSA-N 2 0 344.543 4.131 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000462787622 1040934968 /nfs/dbraw/zinc/93/49/68/1040934968.db2.gz BUVFNIPWUDFUJE-VLCRHTCISA-N 2 0 344.543 4.213 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)C1CC(F)(F)C1 ZINC000898519774 1040974475 /nfs/dbraw/zinc/97/44/75/1040974475.db2.gz RBKNZMMVEHXVCZ-ZNWBIBPKSA-N 2 0 348.481 4.311 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)c1ccccn1 ZINC000898523031 1040978064 /nfs/dbraw/zinc/97/80/64/1040978064.db2.gz XLSSUQWYBOFJTM-FYZZASKESA-N 2 0 335.495 4.033 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000379740221 1040991299 /nfs/dbraw/zinc/99/12/99/1040991299.db2.gz HWPIKSPXGYGELJ-NQIIRXRSSA-N 2 0 326.459 4.389 20 0 EIADRP CC1([NH+]2CCCC2)CCC([NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)CC1 ZINC000903254159 1040991526 /nfs/dbraw/zinc/99/15/26/1040991526.db2.gz QJNSDBJFIDWOHW-PMJAUZGISA-N 2 0 341.543 4.495 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CCN1CCC(c2nc3c(s2)CCCC3)CC1 ZINC000425503117 1041016116 /nfs/dbraw/zinc/01/61/16/1041016116.db2.gz INJYSRSJDPJFIH-QGZVFWFLSA-N 2 0 347.572 4.076 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](COC)c2ccccc2)c1 ZINC000554348714 1041020213 /nfs/dbraw/zinc/02/02/13/1041020213.db2.gz DPEPFKMCAOUBPX-NRFANRHFSA-N 2 0 326.484 4.006 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2cc3c(cccc3F)[nH]2)C1 ZINC000436277033 1041022706 /nfs/dbraw/zinc/02/27/06/1041022706.db2.gz VXSUHGGWGIORDW-HZPDHXFCSA-N 2 0 331.479 4.155 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cc2c(cccc2F)[nH]1 ZINC000436283985 1041029798 /nfs/dbraw/zinc/02/97/98/1041029798.db2.gz XKBZAALXAPWZIG-UHFFFAOYSA-N 2 0 339.458 4.439 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)C1 ZINC000538060498 1041031774 /nfs/dbraw/zinc/03/17/74/1041031774.db2.gz ZOMVNJIHEARLML-PXAZEXFGSA-N 2 0 327.299 4.376 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccc(Sc2ccc(F)cc2)cc1 ZINC000538097059 1041045057 /nfs/dbraw/zinc/04/50/57/1041045057.db2.gz OHMYDKFSQMEMBG-YWZLYKJASA-N 2 0 344.499 4.407 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)c1 ZINC000436273597 1041046247 /nfs/dbraw/zinc/04/62/47/1041046247.db2.gz JAHDMXSAQCNTMJ-RTWAWAEBSA-N 2 0 338.495 4.053 20 0 EIADRP C[N@@H+]1CCC[C@H](CNc2cc[nH+]c3ccccc23)[C@H]1c1cccs1 ZINC000462880167 1041061789 /nfs/dbraw/zinc/06/17/89/1041061789.db2.gz AYCYIJGZNYDHIW-QRWLVFNGSA-N 2 0 337.492 4.213 20 0 EIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H]3CC[C@H]3C(C)(C)C)cc2)CC1 ZINC000554378065 1041065263 /nfs/dbraw/zinc/06/52/63/1041065263.db2.gz ZHPGULOQJXOICV-WOJBJXKFSA-N 2 0 330.516 4.074 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)[C@H](C)C1 ZINC000436317365 1041086896 /nfs/dbraw/zinc/08/68/96/1041086896.db2.gz UZEUBPKAFHZRKB-UWIFEVILSA-N 2 0 340.433 4.271 20 0 EIADRP CSC1(C[NH2+]Cc2ccc(C3CCCC3)cc2)CC[NH+](C)CC1 ZINC000462911045 1041090459 /nfs/dbraw/zinc/09/04/59/1041090459.db2.gz MQKYTJKVMPQCSG-UHFFFAOYSA-N 2 0 332.557 4.261 20 0 EIADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000540136654 1041179126 /nfs/dbraw/zinc/17/91/26/1041179126.db2.gz WLJCNAZRDZENAS-UTKZUKDTSA-N 2 0 335.495 4.445 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCOC3(CCCC3)C2)CC1 ZINC000540159930 1041189695 /nfs/dbraw/zinc/18/96/95/1041189695.db2.gz CNGIIIIRNUJOFB-YZGWKJHDSA-N 2 0 334.548 4.111 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000540150155 1041199312 /nfs/dbraw/zinc/19/93/12/1041199312.db2.gz CBIUQHJIFFEVLH-CVEARBPZSA-N 2 0 340.458 4.307 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](CCC(C)C)CC1)CC2 ZINC000484296563 1041199888 /nfs/dbraw/zinc/19/98/88/1041199888.db2.gz QTJXYKAAXCATCV-OAQYLSRUSA-N 2 0 330.516 4.030 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000540170828 1041213478 /nfs/dbraw/zinc/21/34/78/1041213478.db2.gz PQQFQAZQSDWNND-FHWLQOOXSA-N 2 0 348.531 4.015 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2CC[C@H](c3ccccc3)C2)cc1F ZINC000436411717 1041214811 /nfs/dbraw/zinc/21/48/11/1041214811.db2.gz FIWKADIWFHAIAG-ICSRJNTNSA-N 2 0 326.459 4.313 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]CC[C@H]2CCC[N@@H+]2C)cc1 ZINC000538259735 1041220847 /nfs/dbraw/zinc/22/08/47/1041220847.db2.gz NEMQVUHNXZRIPY-YLJYHZDGSA-N 2 0 338.495 4.497 20 0 EIADRP C[C@H](CCCC(F)(F)F)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000480327965 1041226807 /nfs/dbraw/zinc/22/68/07/1041226807.db2.gz MXDPOYCKVXSNLF-OAHLLOKOSA-N 2 0 328.422 4.493 20 0 EIADRP CC(C)CC[C@@H](C)[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538268476 1041227796 /nfs/dbraw/zinc/22/77/96/1041227796.db2.gz IPWGAYMBBALKIE-IEBWSBKVSA-N 2 0 330.516 4.389 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC(C)(C)c1c(F)cccc1Cl ZINC000540188951 1041230494 /nfs/dbraw/zinc/23/04/94/1041230494.db2.gz MXWPAJHLSJZFEN-WWGRRREGSA-N 2 0 326.887 4.075 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(OC(F)(F)F)cc1 ZINC000484476813 1041269322 /nfs/dbraw/zinc/26/93/22/1041269322.db2.gz WPKQSXCAKRUKGY-NWANDNLSSA-N 2 0 330.394 4.109 20 0 EIADRP CCO[C@H](CC[NH2+]C1CC[NH+](C2CCCCC2)CC1)C1CCCC1 ZINC000484479137 1041274408 /nfs/dbraw/zinc/27/44/08/1041274408.db2.gz WJUXPSMOQLDIFH-OAQYLSRUSA-N 2 0 336.564 4.359 20 0 EIADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cccc(OCc2ccccc2)c1 ZINC000538406156 1041302020 /nfs/dbraw/zinc/30/20/20/1041302020.db2.gz REOVHNPVSRTUFC-SFHVURJKSA-N 2 0 336.479 4.178 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@@H]1C[C@H]1c1ccccc1 ZINC000463159993 1041377533 /nfs/dbraw/zinc/37/75/33/1041377533.db2.gz IHEGZSXNECBPDX-GMAHTHKFSA-N 2 0 349.522 4.424 20 0 EIADRP COc1cc([C@H](C)[NH2+]CC[C@@H]2CCC[N@@H+]2C)ccc1OC1CCCC1 ZINC000540352022 1041391205 /nfs/dbraw/zinc/39/12/05/1041391205.db2.gz KZDFSQHVDZVDHQ-WMZOPIPTSA-N 2 0 346.515 4.152 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1cc(F)c(F)c(F)c1 ZINC000480608293 1041420324 /nfs/dbraw/zinc/42/03/24/1041420324.db2.gz HASRFIHMWRTNMT-AWEZNQCLSA-N 2 0 328.422 4.267 20 0 EIADRP CC(C)[NH+](CCCN[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C(C)C ZINC000463208586 1041420424 /nfs/dbraw/zinc/42/04/24/1041420424.db2.gz XOVOXKNCPMLHOB-IFMALSPDSA-N 3 0 345.575 4.138 20 0 EIADRP C[C@H](Nc1ccc(N2CC[C@H]([NH+](C)C)C2)cn1)c1ccc(Cl)cc1 ZINC000538557762 1041421189 /nfs/dbraw/zinc/42/11/89/1041421189.db2.gz LWMGAINMYIUUOW-KSSFIOAISA-N 2 0 344.890 4.048 20 0 EIADRP COc1cc(C)c([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1OC ZINC000480611634 1041422440 /nfs/dbraw/zinc/42/24/40/1041422440.db2.gz OPJGOJUXXAZOIY-SJLPKXTDSA-N 2 0 348.531 4.175 20 0 EIADRP COc1cc(C)c([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1OC ZINC000480615272 1041425322 /nfs/dbraw/zinc/42/53/22/1041425322.db2.gz RJIVUKVWIWPNBP-QZTJIDSGSA-N 2 0 348.531 4.317 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1cccc(OC(F)F)c1 ZINC000480604418 1041429106 /nfs/dbraw/zinc/42/91/06/1041429106.db2.gz BIXZCUMOYMXYSU-MRXNPFEDSA-N 2 0 340.458 4.451 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[N@H+](C)C[C@H]1C[C@@H]([NH3+])C1 ZINC000904337677 1041431359 /nfs/dbraw/zinc/43/13/59/1041431359.db2.gz DQJXSNHXMJNNQU-YQQAZPJKSA-N 2 0 329.513 4.157 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccccc1OC(F)F ZINC000480617297 1041434581 /nfs/dbraw/zinc/43/45/81/1041434581.db2.gz VKKPXXWLJXRPND-MRXNPFEDSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(F)cc1N(C)C ZINC000480634114 1041446768 /nfs/dbraw/zinc/44/67/68/1041446768.db2.gz ZMQNUJHQHXWMSA-SJORKVTESA-N 2 0 335.511 4.054 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Br)cc2C)C[C@H]1C ZINC000538718056 1041487169 /nfs/dbraw/zinc/48/71/69/1041487169.db2.gz RUEVPYXSJWBQJQ-RHSMWYFYSA-N 2 0 339.321 4.062 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1oc2ccccc2c1CC ZINC000540595264 1041550838 /nfs/dbraw/zinc/55/08/38/1041550838.db2.gz SAUOLNWKDYNQBO-CVEARBPZSA-N 2 0 332.488 4.003 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccc(C(F)(F)F)cc3)CC2)[C@@H](C)C1 ZINC000437073874 1041625236 /nfs/dbraw/zinc/62/52/36/1041625236.db2.gz HOMIJMQEDIWFMD-WMLDXEAASA-N 2 0 340.433 4.057 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@H]1Oc2ccccc2[C@H]1C ZINC000540984011 1041765662 /nfs/dbraw/zinc/76/56/62/1041765662.db2.gz VEULDVVLLLTERW-JLHGSKIFSA-N 2 0 342.527 4.326 20 0 EIADRP Cc1ccccc1O[C@@H]1CCCC[C@H]1[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000541078953 1041800160 /nfs/dbraw/zinc/80/01/60/1041800160.db2.gz VHTVRRZKNVAIIV-TZIWHRDSSA-N 2 0 330.516 4.147 20 0 EIADRP Cc1ccccc1O[C@H]1CCCC[C@@H]1[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000541078951 1041800688 /nfs/dbraw/zinc/80/06/88/1041800688.db2.gz VHTVRRZKNVAIIV-FPOVZHCZSA-N 2 0 330.516 4.147 20 0 EIADRP CC1(C)[C@@H](c2ccccc2)C[C@@H]1[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000464071244 1041854088 /nfs/dbraw/zinc/85/40/88/1041854088.db2.gz HDTCFAKQOWDEEG-YADHBBJMSA-N 2 0 349.522 4.470 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cccc(OC(F)(F)F)c1 ZINC000517536465 1042069607 /nfs/dbraw/zinc/06/96/07/1042069607.db2.gz LZWZECPZWIHGDB-OAHLLOKOSA-N 2 0 344.421 4.329 20 0 EIADRP CC(C)Oc1ccccc1C[NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000517537499 1042070193 /nfs/dbraw/zinc/07/01/93/1042070193.db2.gz VZJUCCNFFKJOCC-RTBURBONSA-N 2 0 332.532 4.322 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc(NC(C)=O)cc1 ZINC000541917671 1042178911 /nfs/dbraw/zinc/17/89/11/1042178911.db2.gz DBDWLGMDTQFXOB-LKUPVBHCSA-N 2 0 345.531 4.196 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2cccc(F)c2F)CCCC1 ZINC000426063597 1042239617 /nfs/dbraw/zinc/23/96/17/1042239617.db2.gz PPOGMKDSJBBIFP-RKVPGOIHSA-N 2 0 336.470 4.095 20 0 EIADRP CC(C)CC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)C(C)(C)C ZINC000518249775 1042439775 /nfs/dbraw/zinc/43/97/75/1042439775.db2.gz BLYZNYMJCPNXQS-ZCNNSNEGSA-N 2 0 338.580 4.195 20 0 EIADRP Fc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)cc1 ZINC000518285501 1042453625 /nfs/dbraw/zinc/45/36/25/1042453625.db2.gz SYJNHGLTOOPUMY-UHFFFAOYSA-N 2 0 346.877 4.481 20 0 EIADRP C[C@H](CCCC(F)(F)F)[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000414992718 1042570679 /nfs/dbraw/zinc/57/06/79/1042570679.db2.gz BZBWMARKLUDGJD-UKPHBRMFSA-N 2 0 346.412 4.230 20 0 EIADRP C[C@H]([NH2+]CCO[C@H]1CCCC[C@H]1C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492427282 1042648702 /nfs/dbraw/zinc/64/87/02/1042648702.db2.gz YRWKSXRUOHNWSJ-KIZRIRGWSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ccccc2OC(F)(F)F)C1 ZINC000518765545 1042675570 /nfs/dbraw/zinc/67/55/70/1042675570.db2.gz LFNANLHZTACJHK-HNNXBMFYSA-N 2 0 344.421 4.187 20 0 EIADRP c1ccc2c(c1)ccnc2C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000894384529 1042688688 /nfs/dbraw/zinc/68/86/88/1042688688.db2.gz LFAGGNURXPKWNS-UHFFFAOYSA-N 2 0 331.463 4.120 20 0 EIADRP COc1cccc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c1 ZINC000177213988 1042830500 /nfs/dbraw/zinc/83/05/00/1042830500.db2.gz PNYGZQWSARBTTG-KRWDZBQOSA-N 2 0 326.484 4.386 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310537054 1042839681 /nfs/dbraw/zinc/83/96/81/1042839681.db2.gz RNGFZEDVUMOLHA-QKLQHJQFSA-N 2 0 326.459 4.387 20 0 EIADRP CCC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)Cc1ccc(C)cc1 ZINC000542466573 1042911310 /nfs/dbraw/zinc/91/13/10/1042911310.db2.gz WHMUJETWDIOCOL-UHFFFAOYSA-N 2 0 334.467 4.296 20 0 EIADRP FC(F)SCc1ccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)o1 ZINC000152684115 1042944282 /nfs/dbraw/zinc/94/42/82/1042944282.db2.gz JFRKOMLXZGAPLH-UHFFFAOYSA-N 2 0 344.471 4.043 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)[C@@H](OC)c1ccccc1 ZINC000493915909 1042975660 /nfs/dbraw/zinc/97/56/60/1042975660.db2.gz GGEYUNGIIGEPJN-XMSQKQJNSA-N 2 0 340.511 4.394 20 0 EIADRP CCCc1csc(CN[C@@H](C)c2ccc(-n3ccnc3C)cc2)n1 ZINC000494152125 1043022985 /nfs/dbraw/zinc/02/29/85/1043022985.db2.gz HSSPAVDNZZIPGQ-AWEZNQCLSA-N 2 0 340.496 4.441 20 0 EIADRP C[C@@H]1CC([NH2+]C[C@@H]2CCC(F)(F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168008296 1043044986 /nfs/dbraw/zinc/04/49/86/1043044986.db2.gz XFBLKTQKRAJEJF-JFIYKMOQSA-N 2 0 336.470 4.453 20 0 EIADRP Cc1c(Cl)c(CN2CCC[C@H]([C@H]3CCC[NH2+]3)C2)nc2ccccc12 ZINC000391935675 1043081502 /nfs/dbraw/zinc/08/15/02/1043081502.db2.gz KFDFTXITQKCDBJ-DOTOQJQBSA-N 2 0 343.902 4.161 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2ccc(Oc3ccccc3)o2)CC1 ZINC000507817095 1043083620 /nfs/dbraw/zinc/08/36/20/1043083620.db2.gz VQBKJLOVSJIMMK-UHFFFAOYSA-N 2 0 328.456 4.236 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1cc2cnccc2o1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000657965814 1043223055 /nfs/dbraw/zinc/22/30/55/1043223055.db2.gz BOBQZHSXLJZENT-ZIFCJYIRSA-N 2 0 349.478 4.389 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cnc3ccccc3c2)c1 ZINC000727469236 1043228424 /nfs/dbraw/zinc/22/84/24/1043228424.db2.gz ZMHXPNUXQMESNG-UHFFFAOYSA-N 2 0 333.479 4.365 20 0 EIADRP [NH3+]C1(C[NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CCCC1 ZINC000665247087 1043231443 /nfs/dbraw/zinc/23/14/43/1043231443.db2.gz VMUXGPNZTJSSIV-HOCLYGCPSA-N 2 0 326.406 4.203 20 0 EIADRP c1ccc(C(CC[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000165941998 1043263311 /nfs/dbraw/zinc/26/33/11/1043263311.db2.gz KVWMXYLAHDLPIP-FCHUYYIVSA-N 2 0 334.507 4.425 20 0 EIADRP COc1cccc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)c1 ZINC000166714863 1043307906 /nfs/dbraw/zinc/30/79/06/1043307906.db2.gz QRQZWRHCYRVCIM-NHCUHLMSSA-N 2 0 336.479 4.079 20 0 EIADRP CCc1ccc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)cn1 ZINC000347878003 1043312404 /nfs/dbraw/zinc/31/24/04/1043312404.db2.gz LTORKPBIYZGJPH-UHFFFAOYSA-N 2 0 349.522 4.132 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)C1CCSCC1 ZINC000187121247 1043329931 /nfs/dbraw/zinc/32/99/31/1043329931.db2.gz CTKFYEROFMIZAA-OAHLLOKOSA-N 2 0 338.586 4.081 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCC[C@@H]2[C@H]2CCOC2)c1 ZINC000474029117 1043442375 /nfs/dbraw/zinc/44/23/75/1043442375.db2.gz LEEKHBHTUFICGT-BHDDXSALSA-N 2 0 344.543 4.212 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCC[C@H]2[C@H]2CCOC2)c1 ZINC000474029119 1043442418 /nfs/dbraw/zinc/44/24/18/1043442418.db2.gz LEEKHBHTUFICGT-FDFHNCONSA-N 2 0 344.543 4.212 20 0 EIADRP Nc1ccc2c(c1)CC[C@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000665272160 1043477981 /nfs/dbraw/zinc/47/79/81/1043477981.db2.gz ZPMPOKKSJQOYJG-CUDBPUKSSA-N 2 0 347.506 4.041 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1ccc(Oc2ccccc2)cn1 ZINC000521025733 1043497292 /nfs/dbraw/zinc/49/72/92/1043497292.db2.gz IVTPZZSCZLWDME-RZQQEMMASA-N 2 0 325.456 4.042 20 0 EIADRP Cc1cscc1C[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000494465826 1043500481 /nfs/dbraw/zinc/50/04/81/1043500481.db2.gz NYCQACMNNREOKP-YSIASYRMSA-N 2 0 326.509 4.057 20 0 EIADRP FC(F)(F)CCC(CCC(F)(F)F)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000665272363 1043503225 /nfs/dbraw/zinc/50/32/25/1043503225.db2.gz DBIPDLSYBMAIKH-GMXVVIOVSA-N 2 0 346.359 4.018 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1cc(Br)cs1 ZINC000494470596 1043504692 /nfs/dbraw/zinc/50/46/92/1043504692.db2.gz VZOXOUVDRKRHPT-GFCCVEGCSA-N 2 0 345.350 4.283 20 0 EIADRP C(=C\C[N@@H+]1CCC[C@H]1c1ccccn1)\C[NH+]1CCC[C@@H]1c1ccccn1 ZINC000674371429 1043646268 /nfs/dbraw/zinc/64/62/68/1043646268.db2.gz QRCNTDULJDXPFL-HENPEBFISA-N 2 0 348.494 4.007 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000665281205 1043649135 /nfs/dbraw/zinc/64/91/35/1043649135.db2.gz XBNDKGQOAVEGHH-MLGOLLRUSA-N 2 0 335.492 4.282 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000474033792 1043692280 /nfs/dbraw/zinc/69/22/80/1043692280.db2.gz LUTFVOUQTQHRJI-UZLBHIALSA-N 2 0 330.516 4.128 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccnn1-c1ccccc1 ZINC000467371191 1043766238 /nfs/dbraw/zinc/76/62/38/1043766238.db2.gz UDIJWAZCXGTAKS-LJQANCHMSA-N 2 0 340.515 4.035 20 0 EIADRP c1ccc2c(c1)[nH]c1c2C[C@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000442644720 1043795654 /nfs/dbraw/zinc/79/56/54/1043795654.db2.gz ICOCXCHUFMEHAZ-IBGZPJMESA-N 2 0 345.490 4.021 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CCc2ccccc21 ZINC000682076067 1043802829 /nfs/dbraw/zinc/80/28/29/1043802829.db2.gz JPVHBZXIFBBPNS-JOCHJYFZSA-N 2 0 335.495 4.307 20 0 EIADRP CC(C)(C)C[NH+]1CCC(C[NH2+][C@@H]2Cc3cccc(Cl)c3C2)CC1 ZINC001168707349 1043896337 /nfs/dbraw/zinc/89/63/37/1043896337.db2.gz LNVBUNMBFWMZRB-QGZVFWFLSA-N 2 0 334.935 4.155 20 0 EIADRP Cc1cc2c(c(C)c1)[C@@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CC2 ZINC000658168176 1043951911 /nfs/dbraw/zinc/95/19/11/1043951911.db2.gz ZWKNEMTZGKHLHU-QFIPXVFZSA-N 2 0 349.522 4.188 20 0 EIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]Cc3ccc4ncccc4c3)CC2)C1 ZINC000192982769 1043988980 /nfs/dbraw/zinc/98/89/80/1043988980.db2.gz RWWYCQXGMLSRCG-UWJYYQICSA-N 2 0 337.511 4.368 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000474040617 1044057169 /nfs/dbraw/zinc/05/71/69/1044057169.db2.gz UVQUMOCXRLITPC-NRFANRHFSA-N 2 0 338.495 4.269 20 0 EIADRP Cc1ccc(C)c(OC2CCN(CCC[NH+]3CCCCC3)CC2)c1 ZINC000195632439 1044152569 /nfs/dbraw/zinc/15/25/69/1044152569.db2.gz SGXXNFOHOWWQEJ-UHFFFAOYSA-N 2 0 330.516 4.023 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[N@@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000443413488 1044269461 /nfs/dbraw/zinc/26/94/61/1044269461.db2.gz MAUWNPDHZIVPBC-UHFFFAOYSA-N 2 0 328.422 4.318 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccncc1 ZINC000658319483 1044306134 /nfs/dbraw/zinc/30/61/34/1044306134.db2.gz CHDFHURGPJGCHJ-GHTZIAJQSA-N 2 0 335.495 4.035 20 0 EIADRP COCC[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1 ZINC000347930247 1044330822 /nfs/dbraw/zinc/33/08/22/1044330822.db2.gz KOMGPTOIUAIAAY-QFUCXCTJSA-N 2 0 330.516 4.007 20 0 EIADRP Brc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](C3CCC3)CC1)CC2 ZINC000282612107 1044346495 /nfs/dbraw/zinc/34/64/95/1044346495.db2.gz LAWQJWYYSNKTSH-SFHVURJKSA-N 2 0 349.316 4.043 20 0 EIADRP COc1cc([C@@H](C)[NH2+][C@H](C)C2CC[NH+](C)CC2)ccc1OCC(C)C ZINC000675775943 1044486970 /nfs/dbraw/zinc/48/69/70/1044486970.db2.gz BQFJLCIREQJPCD-IAGOWNOFSA-N 2 0 348.531 4.111 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cn(C)nc2C2CCCCC2)CC1 ZINC000543396564 1044510165 /nfs/dbraw/zinc/51/01/65/1044510165.db2.gz SSFLYHHFUURFCQ-UHFFFAOYSA-N 2 0 346.563 4.022 20 0 EIADRP C[C@H]1CC(n2ncc3cccc(C[NH3+])c32)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168022527 1044522314 /nfs/dbraw/zinc/52/23/14/1044522314.db2.gz TXBBNVBDPWLRSE-IRXDYDNUSA-N 2 0 348.494 4.109 20 0 EIADRP C[NH+](C)CC1(C[NH2+][C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)CCCC1 ZINC000494943707 1044528596 /nfs/dbraw/zinc/52/85/96/1044528596.db2.gz ZDOMUQYNKXAKRG-FXAWDEMLSA-N 2 0 348.506 4.005 20 0 EIADRP C(=C\c1ccncc1)\CN1CC[C@@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000494963874 1044558707 /nfs/dbraw/zinc/55/87/07/1044558707.db2.gz KGHHNCICSNLYRS-IZPOICSHSA-N 2 0 347.506 4.083 20 0 EIADRP C[C@@H]1C[C@@H](N2CC[C@H]([NH3+])c3ccccc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168023162 1044561780 /nfs/dbraw/zinc/56/17/80/1044561780.db2.gz VMYSCORWSVEKNN-TWWGPRNNSA-N 2 0 349.522 4.338 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+][C@H](C)C3CC[NH+](C)CC3)s2)cc1 ZINC000675926417 1044568881 /nfs/dbraw/zinc/56/88/81/1044568881.db2.gz XBEWMCCKKVICMV-OAHLLOKOSA-N 2 0 344.524 4.244 20 0 EIADRP COc1cccc(-c2ccc(C[NH2+][C@H](C)C3CC[NH+](C)CC3)cc2)c1 ZINC000675904089 1044571483 /nfs/dbraw/zinc/57/14/83/1044571483.db2.gz OMPRTQAFXAHQGH-QGZVFWFLSA-N 2 0 338.495 4.182 20 0 EIADRP CS[C@@H](C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)C(C)(C)C ZINC000543426731 1044576482 /nfs/dbraw/zinc/57/64/82/1044576482.db2.gz JIEFLLTXSNFHKC-YJBOKZPZSA-N 2 0 338.561 4.055 20 0 EIADRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(C(F)(F)F)cc2C)C1 ZINC000443644184 1044598247 /nfs/dbraw/zinc/59/82/47/1044598247.db2.gz UGHNSSSAVHEWRQ-OAHLLOKOSA-N 2 0 328.422 4.178 20 0 EIADRP C[NH+](C)C1CC[NH+](CCCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000474150986 1044695897 /nfs/dbraw/zinc/69/58/97/1044695897.db2.gz CPCSQBBZWBWAMN-UHFFFAOYSA-N 2 0 329.315 4.342 20 0 EIADRP Cc1nc([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c(C)s1 ZINC000676489976 1044769740 /nfs/dbraw/zinc/76/97/40/1044769740.db2.gz NJMMCWKYEIPOLJ-ZDUSSCGKSA-N 2 0 349.569 4.384 20 0 EIADRP Brc1ccoc1C[NH2+]CCCCCCC[NH+]1CCCC1 ZINC000735322375 1044792656 /nfs/dbraw/zinc/79/26/56/1044792656.db2.gz GEXIMXUFBUTJIR-UHFFFAOYSA-N 2 0 343.309 4.178 20 0 EIADRP CC1([NH+]2CCCC2)CCC([NH2+]Cc2cnc(-c3ccco3)s2)CC1 ZINC000922505104 1044791182 /nfs/dbraw/zinc/79/11/82/1044791182.db2.gz QTSOPCSBGVKZDM-UHFFFAOYSA-N 2 0 345.512 4.290 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CCSc3c(F)cccc32)ccc1F ZINC000178300887 1044802140 /nfs/dbraw/zinc/80/21/40/1044802140.db2.gz BHAVOENOQPYLFC-SFHVURJKSA-N 2 0 348.462 4.353 20 0 EIADRP C[C@@H]1C[C@@H](n2cnc3cccc(C[NH3+])c32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168030732 1044805225 /nfs/dbraw/zinc/80/52/25/1044805225.db2.gz WZWCNBLAHDZBBJ-XEMDLRDOSA-N 2 0 348.494 4.109 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2nc3ccc(F)cc3s2)CC1 ZINC000428890640 1044826591 /nfs/dbraw/zinc/82/65/91/1044826591.db2.gz VCAWVXAOSCQLPU-UHFFFAOYSA-N 2 0 349.519 4.283 20 0 EIADRP c1ccc([C@H]([NH2+]Cc2ccccc2C[NH+]2CCCCC2)C2CC2)nc1 ZINC000922584787 1044828894 /nfs/dbraw/zinc/82/88/94/1044828894.db2.gz AFATYZJQXXLJSX-JOCHJYFZSA-N 2 0 335.495 4.308 20 0 EIADRP C[C@@H]1CC([NH2+]C2(Cc3cccnc3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168031903 1044841255 /nfs/dbraw/zinc/84/12/55/1044841255.db2.gz DATRXQWHVYHMOA-RTBURBONSA-N 2 0 349.522 4.188 20 0 EIADRP CC(C)Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000429005191 1044993426 /nfs/dbraw/zinc/99/34/26/1044993426.db2.gz RLYVDGAKMISMQS-JOCHJYFZSA-N 2 0 338.495 4.155 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1Cc2cccc(Cl)c2C1 ZINC001168741225 1045230078 /nfs/dbraw/zinc/23/00/78/1045230078.db2.gz XLFIOEUITOUGAD-KSZLIROESA-N 2 0 332.919 4.146 20 0 EIADRP CCOc1cccc(C[NH2+]Cc2ccc(C[NH+](CC)CC)cc2)c1 ZINC000236946646 1045370738 /nfs/dbraw/zinc/37/07/38/1045370738.db2.gz SQDLZCHTPAHWMT-UHFFFAOYSA-N 2 0 326.484 4.217 20 0 EIADRP C[C@@H](CC[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000237565936 1045389093 /nfs/dbraw/zinc/38/90/93/1045389093.db2.gz REHDFNYQZCUUTD-RBBKRZOGSA-N 2 0 336.523 4.334 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cn1 ZINC000397495600 1045579026 /nfs/dbraw/zinc/57/90/26/1045579026.db2.gz AZRSEWZLSRSHES-FQEVSTJZSA-N 2 0 341.474 4.174 20 0 EIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C1CC(C(F)F)C1 ZINC000768693145 1045830755 /nfs/dbraw/zinc/83/07/55/1045830755.db2.gz WYGZTKFZZJXFBP-UHFFFAOYSA-N 2 0 334.410 4.045 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@H]3CCCOc4ccccc43)C2)cc1 ZINC000249157425 1045894056 /nfs/dbraw/zinc/89/40/56/1045894056.db2.gz XKYCQGHQBXWCFM-CTNGQTDRSA-N 2 0 336.479 4.012 20 0 EIADRP CCc1ccccc1C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001170205350 1045925256 /nfs/dbraw/zinc/92/52/56/1045925256.db2.gz KRXUEXMWGBFESP-HSZRJFAPSA-N 2 0 334.507 4.347 20 0 EIADRP CC[C@@H]1C[C@H]([N@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170194963 1045934245 /nfs/dbraw/zinc/93/42/45/1045934245.db2.gz PHMNLCQJQTZKDF-XRXFAXGQSA-N 2 0 330.516 4.025 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCCCCCOc2ccc(Cl)cc2)CC[N@@H+]1C ZINC000769418057 1045954716 /nfs/dbraw/zinc/95/47/16/1045954716.db2.gz TXKYLQFKIWMIBN-AEFFLSMTSA-N 2 0 338.923 4.352 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H](C)[C@H](C)c2nc3ccccc3s2)CC1 ZINC000161622308 1046012054 /nfs/dbraw/zinc/01/20/54/1046012054.db2.gz AGSKNECYPUYYIX-LSDHHAIUSA-N 2 0 331.529 4.252 20 0 EIADRP CCc1noc(C)c1[C@H](C)[NH2+]Cc1ccccc1C[NH+](CC)CC ZINC000769867657 1046086279 /nfs/dbraw/zinc/08/62/79/1046086279.db2.gz MUVWOVQNQWOTOL-HNNXBMFYSA-N 2 0 329.488 4.238 20 0 EIADRP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(Br)s1 ZINC000038002011 1046169234 /nfs/dbraw/zinc/16/92/34/1046169234.db2.gz BUURMSMWYOJGQA-JTQLQIEISA-N 2 0 345.350 4.470 20 0 EIADRP CSc1ccc([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1F ZINC000123634388 1046189157 /nfs/dbraw/zinc/18/91/57/1046189157.db2.gz FDZCZPTYEVMIMY-CQSZACIVSA-N 2 0 332.488 4.460 20 0 EIADRP Clc1ccc2sc(C3CC[NH+](CC4CC[NH2+]CC4)CC3)nc2c1 ZINC000262200120 1046190378 /nfs/dbraw/zinc/19/03/78/1046190378.db2.gz KIDBVMXSLGPNLO-UHFFFAOYSA-N 2 0 349.931 4.129 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(OC)cc2F)c1 ZINC000123901965 1046203062 /nfs/dbraw/zinc/20/30/62/1046203062.db2.gz HZKKXXDFZBQNAB-OAHLLOKOSA-N 2 0 330.447 4.137 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cnc(Cl)c(C)c2)CC1)CC1CC1 ZINC000770590751 1046232470 /nfs/dbraw/zinc/23/24/70/1046232470.db2.gz BQPLDBQGBQOTBY-UHFFFAOYSA-N 2 0 349.950 4.377 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)Cc1cccs1 ZINC000508692941 1046324555 /nfs/dbraw/zinc/32/45/55/1046324555.db2.gz XMTQOQCIZQMNIP-CMKODMSKSA-N 2 0 342.552 4.427 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cccc(OC(F)F)c2)C1 ZINC000125826946 1046353041 /nfs/dbraw/zinc/35/30/41/1046353041.db2.gz UOBHUIYPOZZHSX-GJZGRUSLSA-N 2 0 326.431 4.059 20 0 EIADRP C[C@@H]([NH2+]CC1(c2ccccc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508710701 1046359288 /nfs/dbraw/zinc/35/92/88/1046359288.db2.gz NRFRVNSJNRLIAS-CTNGQTDRSA-N 2 0 334.507 4.218 20 0 EIADRP C[C@@H]([NH2+]CCc1cccc(F)c1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508710053 1046366066 /nfs/dbraw/zinc/36/60/66/1046366066.db2.gz KVEZBTYQWLFUND-VQIMIIECSA-N 2 0 344.449 4.008 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000125950925 1046384879 /nfs/dbraw/zinc/38/48/79/1046384879.db2.gz TYVSRVJZVBKSAF-LSDHHAIUSA-N 2 0 326.431 4.059 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000126205953 1046462778 /nfs/dbraw/zinc/46/27/78/1046462778.db2.gz YIKSHTIBSXXEAK-ZDUSSCGKSA-N 2 0 347.503 4.250 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCCN(Cc3cccs3)C2)cc1 ZINC000126876243 1046577428 /nfs/dbraw/zinc/57/74/28/1046577428.db2.gz BGHQYWRUORUJCS-IAGOWNOFSA-N 2 0 344.524 4.320 20 0 EIADRP Fc1ccc([C@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)C2CCC2)cc1 ZINC000459396533 1046616943 /nfs/dbraw/zinc/61/69/43/1046616943.db2.gz FNZMTYHCNCBWIH-OAQYLSRUSA-N 2 0 339.458 4.321 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(-c3ccccc3F)o2)[C@H](C)C1 ZINC000536659053 1046621897 /nfs/dbraw/zinc/62/18/97/1046621897.db2.gz AQNSURGEIHJDTB-DNVCBOLYSA-N 2 0 330.447 4.248 20 0 EIADRP CCCOc1c(CN(C)[C@@H]2CC[N@H+](CC)C[C@@H]2C)cccc1OCC ZINC000536662516 1046627983 /nfs/dbraw/zinc/62/79/83/1046627983.db2.gz HKVDGMJRQYYLMW-PKOBYXMFSA-N 2 0 348.531 4.036 20 0 EIADRP CCCOc1c(CN(C)[C@H]2CC[N@H+](CC)C[C@H]2C)cccc1OCC ZINC000536662515 1046628511 /nfs/dbraw/zinc/62/85/11/1046628511.db2.gz HKVDGMJRQYYLMW-MJGOQNOKSA-N 2 0 348.531 4.036 20 0 EIADRP C[N@@H+](Cc1cccc2cc[nH]c21)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536677259 1046665312 /nfs/dbraw/zinc/66/53/12/1046665312.db2.gz GSABXYYCRSFLLN-IBGZPJMESA-N 2 0 333.479 4.122 20 0 EIADRP CCC(CC)(CNC1CC[NH+](C2CC2)CC1)[NH2+][C@@H](C)c1ccccc1 ZINC000459451215 1046680717 /nfs/dbraw/zinc/68/07/17/1046680717.db2.gz WYFFYGRJKUJCMV-SFHVURJKSA-N 2 0 343.559 4.112 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459500450 1046727984 /nfs/dbraw/zinc/72/79/84/1046727984.db2.gz BVWUAZAQYDSDMG-UHFFFAOYSA-N 2 0 349.400 4.167 20 0 EIADRP Fc1ccc(CCCCC[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459490799 1046733109 /nfs/dbraw/zinc/73/31/09/1046733109.db2.gz LETDLFMQBAIFNN-UHFFFAOYSA-N 2 0 341.474 4.192 20 0 EIADRP CC(C)[C@@H](C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)Cc1ccccc1 ZINC000459494722 1046734827 /nfs/dbraw/zinc/73/48/27/1046734827.db2.gz KFNHUSXIWNJLQO-HXUWFJFHSA-N 2 0 337.511 4.155 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)c1ccc(C(C)(C)C)cc1 ZINC000536850855 1046822032 /nfs/dbraw/zinc/82/20/32/1046822032.db2.gz GVYWMICBIGVLRD-DQLDELGASA-N 2 0 344.543 4.013 20 0 EIADRP Cc1ccc([C@@H]2CCC[C@H]2[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000536855977 1046825772 /nfs/dbraw/zinc/82/57/72/1046825772.db2.gz CVIQTDCLMNLHJN-YUVXSKOASA-N 2 0 344.543 4.110 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC(C)(C)c1c(Cl)cccc1Cl ZINC000536865828 1046831213 /nfs/dbraw/zinc/83/12/13/1046831213.db2.gz XXYXFRFIGLYFAS-WFASDCNBSA-N 2 0 329.315 4.201 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)[C@H](C)c1nc2ccccc2s1 ZINC000459728931 1046865261 /nfs/dbraw/zinc/86/52/61/1046865261.db2.gz CWEUNKCBHXIVIJ-JYJNAYRXSA-N 2 0 331.529 4.110 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@H]1c1ccccc1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000459730176 1046867288 /nfs/dbraw/zinc/86/72/88/1046867288.db2.gz LNWYHFCAVKASNX-JXYHXMIBSA-N 2 0 338.470 4.182 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1cccc(-n2ccnc2)c1 ZINC000787295359 1046970970 /nfs/dbraw/zinc/97/09/70/1046970970.db2.gz PBEGMJKWPVGMHQ-LJQANCHMSA-N 2 0 340.515 4.179 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423481775 1047040627 /nfs/dbraw/zinc/04/06/27/1047040627.db2.gz ONPLDJJYVWSHDG-YJBOKZPZSA-N 2 0 343.540 4.225 20 0 EIADRP C[NH+]1CCC2(CCC[N@@H+]2Cc2ccc(SC(F)(F)F)cc2)CC1 ZINC000788435785 1047185699 /nfs/dbraw/zinc/18/56/99/1047185699.db2.gz LVLIVIDZBURXKK-UHFFFAOYSA-N 2 0 344.446 4.359 20 0 EIADRP C[NH+]1CCC(C[N@H+](Cc2ccccc2C(F)(F)F)C2CC2)CC1 ZINC000788479268 1047197294 /nfs/dbraw/zinc/19/72/94/1047197294.db2.gz PPOWVIYOHGHFRO-UHFFFAOYSA-N 2 0 326.406 4.012 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1cc[nH]c(=O)c1 ZINC000788530257 1047227011 /nfs/dbraw/zinc/22/70/11/1047227011.db2.gz WQMDQLIXXPNGJY-IRXDYDNUSA-N 2 0 339.483 4.012 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1ccncc1F ZINC000556119577 1047473506 /nfs/dbraw/zinc/47/35/06/1047473506.db2.gz AMKZVECWNUIPEJ-LNLFQRSKSA-N 2 0 341.474 4.172 20 0 EIADRP C[C@@H]1CC[C@@H]([NH+]2CCC([NH3+])(Cc3ccc(C(F)(F)F)cc3)CC2)C1 ZINC001170119750 1047474443 /nfs/dbraw/zinc/47/44/43/1047474443.db2.gz BYJRNGOHSCWNRB-RHSMWYFYSA-N 2 0 340.433 4.230 20 0 EIADRP COC(=O)[C@@H]1CC[C@@H]([NH2+]CCC[PH+](C(C)(C)C)C(C)(C)C)C1 ZINC001170528883 1047477603 /nfs/dbraw/zinc/47/76/03/1047477603.db2.gz DICYNCMRBDQPQK-HUUCEWRRSA-N 2 0 329.465 4.387 20 0 EIADRP Cn1nccc1[C@H]1CCC[C@H]([NH2+]CCCCCCC[NH+]2CCCC2)C1 ZINC000790486953 1047595661 /nfs/dbraw/zinc/59/56/61/1047595661.db2.gz RCVYVMVWZNNMAF-PMACEKPBSA-N 2 0 346.563 4.082 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCSC2)cc1C[NH+]1CCCCC1 ZINC000790494931 1047599107 /nfs/dbraw/zinc/59/91/07/1047599107.db2.gz HHQPFBAWSPKIGF-IAGOWNOFSA-N 2 0 348.556 4.085 20 0 EIADRP C[C@H](C[NH2+][C@H]1CCN(C)[C@@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000550665020 1047809979 /nfs/dbraw/zinc/80/99/79/1047809979.db2.gz CMRGHDSDGSEBPD-FYINFDKHSA-N 2 0 344.449 4.493 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000556590216 1047830749 /nfs/dbraw/zinc/83/07/49/1047830749.db2.gz TWXKLECJMUBYKM-GMQQQROESA-N 2 0 344.543 4.289 20 0 EIADRP Cc1ccccc1C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)C1CC1 ZINC000556584449 1047831582 /nfs/dbraw/zinc/83/15/82/1047831582.db2.gz UNMYLXFIKAEQJS-QHCPKHFHSA-N 2 0 349.522 4.217 20 0 EIADRP C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556606275 1047836905 /nfs/dbraw/zinc/83/69/05/1047836905.db2.gz VQTFJENFBVQBLA-IAGOWNOFSA-N 2 0 330.516 4.074 20 0 EIADRP COc1cccc(C[N@H+]([C@H]2C[C@@H]3[C@H](C2)C3(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001170735868 1047915052 /nfs/dbraw/zinc/91/50/52/1047915052.db2.gz AODVUVOTIVNVBX-PCYWVCGRSA-N 2 0 342.527 4.202 20 0 EIADRP C[C@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000824775077 1047934374 /nfs/dbraw/zinc/93/43/74/1047934374.db2.gz YFVHBNRDGSHPJV-UAGQMJEPSA-N 2 0 341.326 4.071 20 0 EIADRP c1ccc(C[C@@H](C[NH+]2CCCC2)Nc2ccc([C@H]3CCC[NH2+]3)cc2)cc1 ZINC001170751425 1048059422 /nfs/dbraw/zinc/05/94/22/1048059422.db2.gz GGNGLCZORKHCHN-XZOQPEGZSA-N 2 0 349.522 4.230 20 0 EIADRP Clc1cc(Cl)c2c(c1)CC[C@@H](N1CCC([NH+]3CCC3)CC1)C2 ZINC001171089810 1048096947 /nfs/dbraw/zinc/09/69/47/1048096947.db2.gz BXSFNMHCZNKPHL-MRXNPFEDSA-N 2 0 339.310 4.021 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CCc2nc(C3CCCCC3)cs2)[C@H]2CCC[C@H]21 ZINC000556886249 1048107253 /nfs/dbraw/zinc/10/72/53/1048107253.db2.gz KDZMNKMJCSMBSV-ZIFCJYIRSA-N 2 0 347.572 4.196 20 0 EIADRP CCCC[NH+]1CCC(C[NH2+][C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171110836 1048225361 /nfs/dbraw/zinc/22/53/61/1048225361.db2.gz PLVMJCJKKMUTEE-FQEVSTJZSA-N 2 0 334.935 4.299 20 0 EIADRP CC(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cc(Cl)ccc2C1 ZINC001171113682 1048249887 /nfs/dbraw/zinc/24/98/87/1048249887.db2.gz VAQRJGBVGCJNMK-UFYCRDLUSA-N 2 0 334.935 4.425 20 0 EIADRP C[C@H](CC[N@@H+]1CCC[C@@]2(CC2(F)F)C1)[NH+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844437254 1048335064 /nfs/dbraw/zinc/33/50/64/1048335064.db2.gz MTLKTALOLQNCTL-BZUAXINKSA-N 2 0 348.428 4.007 20 0 EIADRP FC1(F)C[C@]12CCC[NH+](CCCC[N@H+]1CCC[C@]3(CC3(F)F)C1)C2 ZINC000844437046 1048335732 /nfs/dbraw/zinc/33/57/32/1048335732.db2.gz KUQCXMLMZFCPOB-HOTGVXAUSA-N 2 0 348.428 4.009 20 0 EIADRP FC1(F)C[C@@]12CCC[N@H+](Cc1cccc(C[NH+]3CCCCC3)c1)C2 ZINC000844443973 1048342805 /nfs/dbraw/zinc/34/28/05/1048342805.db2.gz NHGWWBBKMQMKFS-LJQANCHMSA-N 2 0 334.454 4.294 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@H]2CCc4ccccc4C2)C3)cc1 ZINC000499164508 1048371080 /nfs/dbraw/zinc/37/10/80/1048371080.db2.gz OFZVSRHICCXJAA-NEWJYFPISA-N 2 0 346.518 4.329 20 0 EIADRP c1nc(C2CC2)c(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)s1 ZINC000683825545 1048376595 /nfs/dbraw/zinc/37/65/95/1048376595.db2.gz LTVUKTYAEVNNHN-UHFFFAOYSA-N 2 0 333.545 4.109 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171138224 1048414833 /nfs/dbraw/zinc/41/48/33/1048414833.db2.gz BJMBFXVPSOYGJP-MRXNPFEDSA-N 2 0 341.326 4.315 20 0 EIADRP COc1ccc2oc(C[N@H+](C)Cc3ccc(C[NH+](C)C)cc3)cc2c1 ZINC000809738372 1048509662 /nfs/dbraw/zinc/50/96/62/1048509662.db2.gz WLLIVNVYUZASEM-UHFFFAOYSA-N 2 0 338.451 4.135 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cccc(-c3ccccn3)c2)cc1 ZINC000809738807 1048513039 /nfs/dbraw/zinc/51/30/39/1048513039.db2.gz KRHMQVMGKNEWNL-UHFFFAOYSA-N 2 0 345.490 4.442 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1cc(Cl)c(N)c(Cl)c1 ZINC000844923929 1048548135 /nfs/dbraw/zinc/54/81/35/1048548135.db2.gz ISYUSILBQILPGF-LLVKDONJSA-N 2 0 338.282 4.146 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc(Cl)c(N)c(Cl)c1 ZINC000844922741 1048549226 /nfs/dbraw/zinc/54/92/26/1048549226.db2.gz DQEPBQUSDSNHGS-SECBINFHSA-N 2 0 342.245 4.024 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)CC1 ZINC000844924475 1048550203 /nfs/dbraw/zinc/55/02/03/1048550203.db2.gz XYKHQHGAXOUBPS-OAHLLOKOSA-N 2 0 326.456 4.097 20 0 EIADRP CCc1cccc(C[NH+]2CCC3(CC[N@H+](Cc4ccoc4)C3)CC2)c1 ZINC001144322904 1048589868 /nfs/dbraw/zinc/58/98/68/1048589868.db2.gz IABCBCWBUWGDOL-UHFFFAOYSA-N 2 0 338.495 4.330 20 0 EIADRP CCc1cccc(C[NH+]2CCC3(C[NH+](Cc4ccccc4)C3)CC2)c1 ZINC001144326494 1048599883 /nfs/dbraw/zinc/59/98/83/1048599883.db2.gz CEOYLZQKRBVMDL-UHFFFAOYSA-N 2 0 334.507 4.347 20 0 EIADRP Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3ccc(C4([NH3+])CCC4)cc3)c2c1 ZINC001171167582 1048613220 /nfs/dbraw/zinc/61/32/20/1048613220.db2.gz IIVPHKHRCKLYPU-MRXNPFEDSA-N 2 0 333.479 4.167 20 0 EIADRP ClC1(Cl)C[C@H]1CCC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000846106063 1048823134 /nfs/dbraw/zinc/82/31/34/1048823134.db2.gz XEIHATLXEYNZOJ-CQSZACIVSA-N 2 0 333.347 4.347 20 0 EIADRP CC[NH+](CC)C[C@H]1CCN(Cc2ccc(Cl)c3cccnc23)C1 ZINC000076004355 1048834722 /nfs/dbraw/zinc/83/47/22/1048834722.db2.gz GZJNLPXUVROBCF-OAHLLOKOSA-N 2 0 331.891 4.052 20 0 EIADRP c1nc(C2CCCC2)sc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000134199595 1048895355 /nfs/dbraw/zinc/89/53/55/1048895355.db2.gz XQBPTUDIMCOHJZ-UHFFFAOYSA-N 2 0 333.545 4.109 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)cc1 ZINC000237343560 1048928315 /nfs/dbraw/zinc/92/83/15/1048928315.db2.gz WPLBOJYJHBQVJJ-WOJBJXKFSA-N 2 0 338.495 4.325 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccc(OC(F)F)cc1 ZINC000817948289 1049063104 /nfs/dbraw/zinc/06/31/04/1049063104.db2.gz WQBSDDBMNQOLBS-SFHVURJKSA-N 2 0 334.410 4.030 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000817948966 1049064389 /nfs/dbraw/zinc/06/43/89/1049064389.db2.gz MWQUOKXARMXLLR-VBNZEHGJSA-N 2 0 334.916 4.185 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc2cc(Cl)ccc2o1 ZINC000817947984 1049064468 /nfs/dbraw/zinc/06/44/68/1049064468.db2.gz HUFDBXMFLTXHKM-CYBMUJFWSA-N 2 0 328.843 4.438 20 0 EIADRP CCOc1cccc2cc([C@H](C)[NH2+]Cc3ccc(CC[NH3+])cc3)oc21 ZINC000817948396 1049064633 /nfs/dbraw/zinc/06/46/33/1049064633.db2.gz IWVLOSURJXRCER-HNNXBMFYSA-N 2 0 338.451 4.184 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000817950145 1049067810 /nfs/dbraw/zinc/06/78/10/1049067810.db2.gz WVYVIRIHPSGJIH-OAQYLSRUSA-N 2 0 333.479 4.145 20 0 EIADRP CC(C)c1ccc(C2(O)CCC([NH2+][C@@H](C)CCCC[NH3+])CC2)cc1 ZINC000817976212 1049075607 /nfs/dbraw/zinc/07/56/07/1049075607.db2.gz IDNQTJFIVJJQKP-RPCJCACASA-N 2 0 332.532 4.047 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc(SC(F)F)cc1 ZINC000817985446 1049079309 /nfs/dbraw/zinc/07/93/09/1049079309.db2.gz KDIUJHJTAHNEJQ-SPWCGHHHSA-N 2 0 326.456 4.040 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(SC(F)F)cc1 ZINC000817985556 1049080300 /nfs/dbraw/zinc/08/03/00/1049080300.db2.gz LZGZADYPRXRFBX-GXTWGEPZSA-N 2 0 326.456 4.327 20 0 EIADRP C[NH+]1CCC2(CCC[N@H+](Cc3cscc3C(F)(F)F)C2)CC1 ZINC000811501492 1049117203 /nfs/dbraw/zinc/11/72/03/1049117203.db2.gz ZENLTQJPHWMRHZ-UHFFFAOYSA-N 2 0 332.435 4.075 20 0 EIADRP CN(Cc1ccc(C[NH+](C)C)cc1)Cc1ccnc(Cl)c1Cl ZINC000811506572 1049121413 /nfs/dbraw/zinc/12/14/13/1049121413.db2.gz APAPGCLSUMAWGT-UHFFFAOYSA-N 2 0 338.282 4.082 20 0 EIADRP [NH3+]CCC[C@@H]([NH3+])Nc1c(-c2ccccc2)cccc1-c1ccccc1 ZINC001170898531 1049126697 /nfs/dbraw/zinc/12/66/97/1049126697.db2.gz CXJWRROXYCNSFG-NRFANRHFSA-N 2 0 331.463 4.456 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170909319 1049175561 /nfs/dbraw/zinc/17/55/61/1049175561.db2.gz SVGFFPWVVAYPCK-LXPRWKDFSA-N 2 0 334.935 4.440 20 0 EIADRP CC[NH+](CC)[C@@H](CNc1cc[nH+]c2cc(F)ccc12)c1ccco1 ZINC000078695034 1049271841 /nfs/dbraw/zinc/27/18/41/1049271841.db2.gz ZMHWQOGPFDLZFX-SFHVURJKSA-N 2 0 327.403 4.462 20 0 EIADRP C[NH+]1CCC(C2CC[NH+]([C@H]3CCc4cccc(Cl)c4C3)CC2)CC1 ZINC001170933610 1049352689 /nfs/dbraw/zinc/35/26/89/1049352689.db2.gz IJYXSTRKEWLNLM-IBGZPJMESA-N 2 0 346.946 4.251 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+]([C@H]1CCc3cccc(Cl)c3C1)CC2 ZINC001170944460 1049456265 /nfs/dbraw/zinc/45/62/65/1049456265.db2.gz PONVGJFXWQSJJI-KRWDZBQOSA-N 2 0 332.919 4.005 20 0 EIADRP CCC(CC)[NH+]1CCC([NH2+][C@@H]2CCc3cc(F)cc(F)c3C2)CC1 ZINC001170677656 1049468650 /nfs/dbraw/zinc/46/86/50/1049468650.db2.gz RFFURAHGLHPMQH-QGZVFWFLSA-N 2 0 336.470 4.065 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@@H]2CCc3c(F)cc(F)cc3C2)CC1 ZINC001171357407 1049510247 /nfs/dbraw/zinc/51/02/47/1049510247.db2.gz LPYVXVOSVYTSFN-BHIYHBOVSA-N 2 0 348.481 4.337 20 0 EIADRP Cc1cnccc1O[C@@H]1CC[N@@H+]([C@@H]2CCc3cccc(Cl)c3C2)C1 ZINC001170948040 1049515657 /nfs/dbraw/zinc/51/56/57/1049515657.db2.gz ZWBPCKOXDXKJEE-IAGOWNOFSA-N 2 0 342.870 4.054 20 0 EIADRP C[C@H]([NH2+]CCc1cccc2cccnc21)c1cccc(C[NH+](C)C)c1 ZINC000820806493 1049551720 /nfs/dbraw/zinc/55/17/20/1049551720.db2.gz JLEXLLKKHVIKIR-KRWDZBQOSA-N 2 0 333.479 4.190 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCc4nc(Cl)ccc43)CC2)CC1 ZINC000806149562 1049612402 /nfs/dbraw/zinc/61/24/02/1049612402.db2.gz VPWFZOOEXHKOPB-HTWSVDAQSA-N 2 0 347.934 4.355 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c3cccnc23)[C@H](C)C1 ZINC000081095566 1049624550 /nfs/dbraw/zinc/62/45/50/1049624550.db2.gz LMOVSLVEFVKZSF-RDTXWAMCSA-N 2 0 331.891 4.050 20 0 EIADRP FC1(F)CCC[C@H]([NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)C1 ZINC000716629321 1049701161 /nfs/dbraw/zinc/70/11/61/1049701161.db2.gz YFYJBWDGYJSGDB-VJANTYMQSA-N 2 0 334.454 4.207 20 0 EIADRP Cc1cccc2c1CC[C@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)C2 ZINC001171550180 1049752768 /nfs/dbraw/zinc/75/27/68/1049752768.db2.gz JWLXWLVPTKPJPL-QHCPKHFHSA-N 2 0 348.534 4.354 20 0 EIADRP Cc1cccc2c1CC[C@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)C2 ZINC001171559327 1049755276 /nfs/dbraw/zinc/75/52/76/1049755276.db2.gz DPKHLDVJEPUROZ-NRFANRHFSA-N 2 0 326.528 4.097 20 0 EIADRP Cc1cccc2c1CC[C@@H]([NH2+]C1CC[NH+](C[C@@H]3CC=CCC3)CC1)C2 ZINC001171563775 1049756136 /nfs/dbraw/zinc/75/61/36/1049756136.db2.gz MJMSILRNFOCPAX-DENIHFKCSA-N 2 0 338.539 4.263 20 0 EIADRP Cc1cccc2c1CC[C@H]([N@H+](C)C[C@H]1CC[NH+](Cc3ccccc3)C1)C2 ZINC001171573515 1049760799 /nfs/dbraw/zinc/76/07/99/1049760799.db2.gz IYVKHQYLIGSPFI-GGAORHGYSA-N 2 0 348.534 4.306 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CCc2ccc(C(F)(F)F)cc2)CC1(C)C ZINC001171613949 1049765687 /nfs/dbraw/zinc/76/56/87/1049765687.db2.gz RUMVUCKIFVIVMD-UHFFFAOYSA-N 2 0 342.449 4.489 20 0 EIADRP Cc1ccccc1O[C@@H]1CC[N@@H+](C2CC(C)(C)[NH+](C)C(C)(C)C2)C1 ZINC001171637380 1049779906 /nfs/dbraw/zinc/77/99/06/1049779906.db2.gz LSWMYUVGMZRBJE-GOSISDBHSA-N 2 0 330.516 4.100 20 0 EIADRP CC[N@H+](CCc1ccc(OC)cc1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171641936 1049779967 /nfs/dbraw/zinc/77/99/67/1049779967.db2.gz WQDMOBKACAYVCW-UHFFFAOYSA-N 2 0 332.532 4.211 20 0 EIADRP COc1ccc([C@@H]2CC[N@@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)C2)cc1 ZINC001171643385 1049780841 /nfs/dbraw/zinc/78/08/41/1049780841.db2.gz SFDQMQLJFYMXEY-QGZVFWFLSA-N 2 0 330.516 4.136 20 0 EIADRP Cc1ccc2c(CC[NH3+])cn([C@H]3C[C@@H](C)[N@@H+](Cc4ccccc4)C3)c2c1 ZINC001171724861 1049785623 /nfs/dbraw/zinc/78/56/23/1049785623.db2.gz DBGBJUKWAUSABI-NQIIRXRSSA-N 2 0 347.506 4.286 20 0 EIADRP Cc1ccc2c(c1)c(CC[NH3+])cn2[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171727767 1049785636 /nfs/dbraw/zinc/78/56/36/1049785636.db2.gz XPSVBZMJBISYAB-WIYYLYMNSA-N 2 0 347.506 4.286 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccc2)[C@H]2Cc3cccc(F)c3C2)CC1 ZINC001171785514 1049803732 /nfs/dbraw/zinc/80/37/32/1049803732.db2.gz OMWCBMGDLCJGSA-UFYCRDLUSA-N 2 0 338.470 4.065 20 0 EIADRP CCO[C@H](CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)C ZINC000245652588 1049812659 /nfs/dbraw/zinc/81/26/59/1049812659.db2.gz CWXFAGRQCRRPFQ-YUMYIRISSA-N 2 0 344.543 4.223 20 0 EIADRP CC(C)[NH+]1CCC(C[NH2+][C@@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001171959124 1049822595 /nfs/dbraw/zinc/82/25/95/1049822595.db2.gz QRKXZZYGHAMBLG-HNNXBMFYSA-N 2 0 342.449 4.346 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCC[NH+]1CCCC1 ZINC001171958901 1049822634 /nfs/dbraw/zinc/82/26/34/1049822634.db2.gz LBIQYOOJHCVYRB-OAHLLOKOSA-N 2 0 328.422 4.102 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001171963088 1049825477 /nfs/dbraw/zinc/82/54/77/1049825477.db2.gz GSICNBONNISNEF-CQSZACIVSA-N 2 0 340.433 4.100 20 0 EIADRP CC1(C)C[C@@H]([NH2+]C[C@@H]2CCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171967060 1049827611 /nfs/dbraw/zinc/82/76/11/1049827611.db2.gz XFXZRKVNDUCNNF-MSOLQXFVSA-N 2 0 336.470 4.455 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CC2CC(F)(F)C2)ccc1OC ZINC000813872735 1049828180 /nfs/dbraw/zinc/82/81/80/1049828180.db2.gz KFINHISYUGGLFQ-CQSZACIVSA-N 2 0 340.458 4.233 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H]2CCc3c(Cl)cccc3C2)c1 ZINC001171010711 1049829966 /nfs/dbraw/zinc/82/99/66/1049829966.db2.gz BTFQXYCYBQIYRN-SFHVURJKSA-N 2 0 328.887 4.049 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CCc2ccsc2)CC[N@@H+]1Cc1ccccc1 ZINC001171969141 1049833789 /nfs/dbraw/zinc/83/37/89/1049833789.db2.gz UBPOKTLIPPIYKJ-IBGZPJMESA-N 2 0 328.525 4.323 20 0 EIADRP CCCCOCCC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171973319 1049835953 /nfs/dbraw/zinc/83/59/53/1049835953.db2.gz XOFCXGQHVURNQG-FQEVSTJZSA-N 2 0 332.532 4.226 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@H]2CCCc3ccncc32)CC[N@@H+]1Cc1ccccc1 ZINC001171978817 1049839353 /nfs/dbraw/zinc/83/93/53/1049839353.db2.gz LXYKHVYJZMYIQL-IRLDBZIGSA-N 2 0 349.522 4.492 20 0 EIADRP COCCC1CC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171985186 1049839791 /nfs/dbraw/zinc/83/97/91/1049839791.db2.gz SSHXXVHXUKVEKV-NRFANRHFSA-N 2 0 344.543 4.178 20 0 EIADRP Cc1ccnc(CC[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172073440 1049845081 /nfs/dbraw/zinc/84/50/81/1049845081.db2.gz QYQZTXKQRYITSZ-NUNAXRQHSA-N 2 0 349.522 4.108 20 0 EIADRP c1cc(CC[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)cs1 ZINC001172064681 1049851568 /nfs/dbraw/zinc/85/15/68/1049851568.db2.gz IVKCNOYSJKXWHP-WKCHPHFGSA-N 2 0 340.536 4.466 20 0 EIADRP [NH3+]CCc1cccc(N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172065173 1049851887 /nfs/dbraw/zinc/85/18/87/1049851887.db2.gz IONNYFPKDPKCCU-WBDAEOGXSA-N 2 0 349.522 4.185 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cc(Cl)cc(C(F)(F)F)c1)C2 ZINC001172105746 1049856636 /nfs/dbraw/zinc/85/66/36/1049856636.db2.gz KARUCVQYMGEBFW-PHZGNYQRSA-N 2 0 346.824 4.464 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2C)c1ccc(C(F)(F)F)cc1 ZINC001172108353 1049857523 /nfs/dbraw/zinc/85/75/23/1049857523.db2.gz VDNJZBBOGRVKKM-SJWGOKEGSA-N 2 0 326.406 4.371 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](N[C@H](c1ccccc1)[C@@H]([NH3+])c1ccccc1)C2 ZINC001172119427 1049858035 /nfs/dbraw/zinc/85/80/35/1049858035.db2.gz ZQJMJDQJRVPUSB-USWKJHDZSA-N 2 0 349.522 4.033 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H](c1ccccc1)c1ccc(O)cc1)C2 ZINC001172118786 1049858435 /nfs/dbraw/zinc/85/84/35/1049858435.db2.gz SVLXVBSWYRCODC-KEZQHZCBSA-N 2 0 336.479 4.087 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccc(O)cc1)C2 ZINC001172118784 1049858932 /nfs/dbraw/zinc/85/89/32/1049858932.db2.gz SVLXVBSWYRCODC-IIZPIQPGSA-N 2 0 336.479 4.087 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](c1ccccc1)c1ccc(O)cc1)C2 ZINC001172118787 1049859305 /nfs/dbraw/zinc/85/93/05/1049859305.db2.gz SVLXVBSWYRCODC-XAPVIXHLSA-N 2 0 336.479 4.087 20 0 EIADRP CCCC[NH+]1CCC(C[NH2+][C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171023406 1049865224 /nfs/dbraw/zinc/86/52/24/1049865224.db2.gz WONWEOMYAWHVNB-SFHVURJKSA-N 2 0 334.935 4.299 20 0 EIADRP c1ccc2c(c1)C[C@H]([NH2+]CC1CC[NH+](CC3CCCC3)CC1)CS2 ZINC001172199294 1049869559 /nfs/dbraw/zinc/86/95/59/1049869559.db2.gz VFYNGVIEZQUZAU-FQEVSTJZSA-N 2 0 344.568 4.195 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@@H]2CCc3c(Cl)cccc3C2)C[C@@](C)(C[NH3+])C1 ZINC001171027802 1049872697 /nfs/dbraw/zinc/87/26/97/1049872697.db2.gz TUDJIGJUGNRZHS-GQIGUUNPSA-N 2 0 334.935 4.331 20 0 EIADRP [NH3+]C1(CC2CCC2)CC[NH+]([C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171030014 1049874990 /nfs/dbraw/zinc/87/49/90/1049874990.db2.gz KMHGZAPERWIIHY-KRWDZBQOSA-N 2 0 332.919 4.181 20 0 EIADRP CC[C@H](C)OCC[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001172322108 1049878484 /nfs/dbraw/zinc/87/84/84/1049878484.db2.gz RUIJTUXHWIEHBU-SVFBPWRDSA-N 2 0 332.532 4.082 20 0 EIADRP CC[C@H](C)OCC[C@@H](C)[N@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172338325 1049888188 /nfs/dbraw/zinc/88/81/88/1049888188.db2.gz YITITDVMSAJPDY-KOUHRCEDSA-N 2 0 332.532 4.352 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[NH+]1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC001172340456 1049889087 /nfs/dbraw/zinc/88/90/87/1049889087.db2.gz KBARCGNPTXHPAJ-OALUTQOASA-N 2 0 332.532 4.177 20 0 EIADRP COc1ccc(CN2CCC([NH2+][C@@H]3CC[C@@H](C)[C@@H](C)C3)CC2)cc1 ZINC001172359540 1049895238 /nfs/dbraw/zinc/89/52/38/1049895238.db2.gz KCLAXRZSLYCSBC-FUHIMQAGSA-N 2 0 330.516 4.074 20 0 EIADRP CC(C)COCC[C@@H](C)[NH+]1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC001172471174 1049908416 /nfs/dbraw/zinc/90/84/16/1049908416.db2.gz QTCZLVHHCSFROQ-LJQANCHMSA-N 2 0 332.532 4.034 20 0 EIADRP CC(C)COCC[C@@H](C)[N@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172475349 1049908793 /nfs/dbraw/zinc/90/87/93/1049908793.db2.gz IMVNEBDQPIPAAC-HXUWFJFHSA-N 2 0 346.559 4.282 20 0 EIADRP CC(C)OCC[C@@H](C)[N@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172457146 1049916458 /nfs/dbraw/zinc/91/64/58/1049916458.db2.gz RUOOBXBXJNKAKP-LJQANCHMSA-N 2 0 332.532 4.034 20 0 EIADRP [NH3+][C@H]1CC[N@H+](Cc2ccc3ccc(-c4ccccc4)nc3c2)CC[C@@H]1F ZINC001206164548 1049918139 /nfs/dbraw/zinc/91/81/39/1049918139.db2.gz KJNRYCBRSYEWMW-PMACEKPBSA-N 2 0 349.453 4.163 20 0 EIADRP CC(C)COCC[C@@H](C)[N@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172467179 1049919138 /nfs/dbraw/zinc/91/91/38/1049919138.db2.gz IVMOEAGMUDMLMZ-HMXCVIKNSA-N 2 0 332.532 4.210 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+]([C@H]2CC[C@@H](c3ccccc3)C2)C2CCOCC2)CC1 ZINC001172556403 1049932510 /nfs/dbraw/zinc/93/25/10/1049932510.db2.gz LXLDGVHWGWNVML-VMBXEPDQSA-N 2 0 342.527 4.074 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]C1CCC([NH+](C)C)CC1 ZINC001172575346 1049941441 /nfs/dbraw/zinc/94/14/41/1049941441.db2.gz HHNQRBFTWKGRRX-LRVUVFPRSA-N 2 0 344.877 4.402 20 0 EIADRP c1ccc(C[N@H+]2CC[C@@H](C[NH2+][C@H]3CC[C@@H](c4ccccc4)C3)C2)cc1 ZINC001172546726 1049946780 /nfs/dbraw/zinc/94/67/80/1049946780.db2.gz PHGFMRLCTISBTC-WWNPGLIZSA-N 2 0 334.507 4.434 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc2ccccc2n1 ZINC000246879392 1050004262 /nfs/dbraw/zinc/00/42/62/1050004262.db2.gz DXRAEQFAPDHHRN-QZTJIDSGSA-N 2 0 325.500 4.398 20 0 EIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]C[C@H]1CCCc2ccccc21 ZINC000247974869 1050038238 /nfs/dbraw/zinc/03/82/38/1050038238.db2.gz KLZAKUVVBONECR-XQFWAAQXSA-N 2 0 349.522 4.002 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000089215379 1050112013 /nfs/dbraw/zinc/11/20/13/1050112013.db2.gz MEQYLCLINIAOKW-KRWDZBQOSA-N 2 0 339.483 4.048 20 0 EIADRP CSc1ccc([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000089215222 1050112082 /nfs/dbraw/zinc/11/20/82/1050112082.db2.gz QRBIKOOJTQKAGY-MRXNPFEDSA-N 2 0 341.524 4.371 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]CCc2nc(C3CCCCC3)cs2)[C@H](C)C1 ZINC000090046501 1050152690 /nfs/dbraw/zinc/15/26/90/1050152690.db2.gz AADPSAOILARXLX-NVXWUHKLSA-N 2 0 335.561 4.053 20 0 EIADRP C[NH+]1CCC2(CC[N@@H+](C3CCC(Cc4ccccc4)CC3)C2)CC1 ZINC001172825055 1050163998 /nfs/dbraw/zinc/16/39/98/1050163998.db2.gz NVULSQMRZKAYAF-UHFFFAOYSA-N 2 0 326.528 4.206 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC001172826929 1050166240 /nfs/dbraw/zinc/16/62/40/1050166240.db2.gz YDIMWARULMEZQB-XMMPIXPASA-N 2 0 348.534 4.354 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([NH2+]CC1CC[NH+](Cc3ccccc3)CC1)CC2 ZINC001172826928 1050167237 /nfs/dbraw/zinc/16/72/37/1050167237.db2.gz YDIMWARULMEZQB-DEOSSOPVSA-N 2 0 348.534 4.354 20 0 EIADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC001206297311 1050168748 /nfs/dbraw/zinc/16/87/48/1050168748.db2.gz XOEJTDQWTDNJOQ-QFIPXVFZSA-N 2 0 338.495 4.217 20 0 EIADRP COC(=O)[C@H]1CCC[C@H]([NH2+]CCCCCCCCCCC[NH3+])CC1 ZINC001172801085 1050173030 /nfs/dbraw/zinc/17/30/30/1050173030.db2.gz UATAXXRWKDLPSM-OALUTQOASA-N 2 0 340.552 4.168 20 0 EIADRP C[C@H]1C[NH+](Cc2ccc(C[NH2+][C@H]3CCC[C@@H](C)CC3)cc2)C[C@H](C)O1 ZINC001177245564 1050173552 /nfs/dbraw/zinc/17/35/52/1050173552.db2.gz XOEYBIJLQXZKNC-GHDARCQNSA-N 2 0 344.543 4.354 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ccc(F)c3cccnc23)C1 ZINC001177289271 1050178491 /nfs/dbraw/zinc/17/84/91/1050178491.db2.gz BZVNKCWKQZBBJQ-IRXDYDNUSA-N 2 0 343.490 4.222 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)[NH2+]CCCCC[NH+]1CCCC1 ZINC001172841565 1050179147 /nfs/dbraw/zinc/17/91/47/1050179147.db2.gz LOWCSNLKSFNURD-HNNXBMFYSA-N 2 0 326.887 4.266 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2c(Cl)cccc2N(C)C)C1 ZINC001177299708 1050180757 /nfs/dbraw/zinc/18/07/57/1050180757.db2.gz ZTVCSEKEBQDAAK-INIZCTEOSA-N 2 0 337.939 4.008 20 0 EIADRP FC(F)(F)c1c[nH+]ccc1N1CCC(CCC[NH+]2CCCC2)CC1 ZINC001185888632 1050183237 /nfs/dbraw/zinc/18/32/37/1050183237.db2.gz MBIPQRDPLPSQJU-UHFFFAOYSA-N 2 0 341.421 4.193 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[N@@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001172849775 1050187867 /nfs/dbraw/zinc/18/78/67/1050187867.db2.gz PNGUXNBKNGAPCJ-CABCVRRESA-N 2 0 326.887 4.251 20 0 EIADRP C[C@@H](C[NH2+][C@H](C)Cc1c(F)cccc1Cl)CC(C)(C)CC[NH3+] ZINC001172852854 1050190514 /nfs/dbraw/zinc/19/05/14/1050190514.db2.gz VRSSJZAIHYVBHR-ZIAGYGMSSA-N 2 0 328.903 4.401 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC001172858161 1050194989 /nfs/dbraw/zinc/19/49/89/1050194989.db2.gz CVKXIXODMJWRMM-CQSZACIVSA-N 2 0 338.898 4.407 20 0 EIADRP C[C@@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1CC[C@H]([NH+](C)C)CC1 ZINC001172879506 1050219432 /nfs/dbraw/zinc/21/94/32/1050219432.db2.gz NOFHXXCMFZSXDX-BPUTZDHNSA-N 2 0 326.937 4.283 20 0 EIADRP CO[C@H]1CCC[C@@H]([N@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172928118 1050238820 /nfs/dbraw/zinc/23/88/20/1050238820.db2.gz IXZRQQUZHITUAG-NCYKPQTJSA-N 2 0 330.516 4.025 20 0 EIADRP CO[C@H]1CCC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)CC1 ZINC001177528800 1050240969 /nfs/dbraw/zinc/24/09/69/1050240969.db2.gz HSNAFYHONXEQSJ-YADHBBJMSA-N 2 0 344.543 4.500 20 0 EIADRP CCC1(C[NH2+]Cc2ccncc2F)CC[NH+](Cc2ccccc2)CC1 ZINC000449216510 1050251408 /nfs/dbraw/zinc/25/14/08/1050251408.db2.gz SSRIHEKTJJGKBJ-UHFFFAOYSA-N 2 0 341.474 4.003 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+]C/C=C\c1ccc(OCc2ccccc2)cc1 ZINC001177565838 1050253065 /nfs/dbraw/zinc/25/30/65/1050253065.db2.gz JZMOLFQHOIQYAO-JNLAIUADSA-N 2 0 338.495 4.209 20 0 EIADRP c1[nH]nc2c1cccc2C[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC001177566341 1050256112 /nfs/dbraw/zinc/25/61/12/1050256112.db2.gz SPVIDSMBNRHVHJ-UHFFFAOYSA-N 2 0 348.494 4.229 20 0 EIADRP [NH3+][C@@H]1CC[N@H+](Cc2ccc(Oc3ccc(Cl)cc3)cc2)CC[C@H]1F ZINC001206187044 1050265628 /nfs/dbraw/zinc/26/56/28/1050265628.db2.gz SPPOBVFIHDKCNA-RTBURBONSA-N 2 0 348.849 4.394 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+]C1CCC2(CCOCC2)CC1)c1ccccc1 ZINC001173039878 1050269347 /nfs/dbraw/zinc/26/93/47/1050269347.db2.gz RKJRVOCKBULWNR-FQEVSTJZSA-N 2 0 330.516 4.008 20 0 EIADRP CC(C)(C)C[N@@H+](C1CCC2(CCOCC2)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173044781 1050271058 /nfs/dbraw/zinc/27/10/58/1050271058.db2.gz WXESNGUOQORXMM-IYARVYRRSA-N 2 0 336.564 4.344 20 0 EIADRP Cc1cc(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)ccc1Cl ZINC001177669167 1050273878 /nfs/dbraw/zinc/27/38/78/1050273878.db2.gz SAIKJPVKBMDQHD-HXUWFJFHSA-N 2 0 342.914 4.303 20 0 EIADRP C[C@@H](Cc1ccc(OC(F)(F)F)cc1)[NH2+]CCCCCCC[NH3+] ZINC001173079730 1050294971 /nfs/dbraw/zinc/29/49/71/1050294971.db2.gz QQPUTSPGPAZDAS-AWEZNQCLSA-N 2 0 332.410 4.015 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccc(-c3ccccn3)cc2)CC1 ZINC001173104835 1050304946 /nfs/dbraw/zinc/30/49/46/1050304946.db2.gz XTNUCMGVGYPTGG-UHFFFAOYSA-N 2 0 337.511 4.491 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2cc(Cl)c(F)cc2F)CC1 ZINC001173104102 1050306050 /nfs/dbraw/zinc/30/60/50/1050306050.db2.gz JAFBXOJGJDHXKC-UHFFFAOYSA-N 2 0 330.850 4.361 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](c2ccncc2Cl)C2CC2)CC1 ZINC001173107042 1050306767 /nfs/dbraw/zinc/30/67/67/1050306767.db2.gz UXRYYRWOXYDRIZ-LADRWXRNSA-N 2 0 335.923 4.429 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H]2CCc3ccc(Cl)cc3C2)CC1 ZINC001173107921 1050307577 /nfs/dbraw/zinc/30/75/77/1050307577.db2.gz SCFXENUWNODRSE-IOJLRTSASA-N 2 0 334.935 4.440 20 0 EIADRP CC[NH+](CC)C1CCC(NC(=[NH2+])c2ccc(F)c(Cl)c2)CC1 ZINC001173106410 1050307674 /nfs/dbraw/zinc/30/76/74/1050307674.db2.gz OQQGAQOJPAZORG-UHFFFAOYSA-N 2 0 325.859 4.047 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CC[C@H](Oc3ccccc3C)C2)CC1 ZINC001173112171 1050309648 /nfs/dbraw/zinc/30/96/48/1050309648.db2.gz ROXHEIFSZURQTL-MHJFOBGBSA-N 2 0 330.516 4.101 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@H]2c2cccc(OC)c2)CC1 ZINC001173114314 1050310964 /nfs/dbraw/zinc/31/09/64/1050310964.db2.gz GEELUYRMOCCQSE-GRERDSQWSA-N 2 0 330.516 4.485 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC(Oc3ccc(F)cc3)CC2)CC1 ZINC001173111505 1050311044 /nfs/dbraw/zinc/31/10/44/1050311044.db2.gz GCQDFTATRRGMTG-UHFFFAOYSA-N 2 0 348.506 4.322 20 0 EIADRP [NH3+]C1(Cc2cccnc2)CC[NH+](C2CCC3(CCCCC3)CC2)CC1 ZINC001173119157 1050314601 /nfs/dbraw/zinc/31/46/01/1050314601.db2.gz YSKFQFAXJJJGCH-UHFFFAOYSA-N 2 0 341.543 4.311 20 0 EIADRP CCCC[NH+]1CCC(C[NH2+]C2CCC(Oc3ccccc3)CC2)CC1 ZINC001173199067 1050342152 /nfs/dbraw/zinc/34/21/52/1050342152.db2.gz QXKLFOAOFCZAFO-UHFFFAOYSA-N 2 0 344.543 4.478 20 0 EIADRP CCCC[C@H](CC(C)C)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC001173255841 1050380452 /nfs/dbraw/zinc/38/04/52/1050380452.db2.gz GVRKVCCOCLPPSD-OAQYLSRUSA-N 2 0 331.548 4.488 20 0 EIADRP CCc1ccc(C[C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC001173237249 1050393637 /nfs/dbraw/zinc/39/36/37/1050393637.db2.gz GPIMETLQGHZWRZ-XXBNENTESA-N 2 0 336.523 4.292 20 0 EIADRP Cc1cc(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)cc(C)c1Br ZINC001206317869 1050394891 /nfs/dbraw/zinc/39/48/91/1050394891.db2.gz KCDWYSAQOAJKQL-QGZVFWFLSA-N 2 0 339.321 4.017 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC001178249776 1050409974 /nfs/dbraw/zinc/40/99/74/1050409974.db2.gz VBTNLSRYZNJREI-INIZCTEOSA-N 2 0 342.449 4.471 20 0 EIADRP CC(C)([NH3+])CCNCCC(C)(C)[NH2+][C@H]1CCCC2(CCCCC2)C1 ZINC001173338639 1050428044 /nfs/dbraw/zinc/42/80/44/1050428044.db2.gz BODDESKZZWOBDK-SFHVURJKSA-N 2 0 337.596 4.355 20 0 EIADRP Fc1cc2c(cc1F)CC([NH2+]C1CC[NH+](CC3CCCCC3)CC1)C2 ZINC001173475442 1050459287 /nfs/dbraw/zinc/45/92/87/1050459287.db2.gz DZORWBVNWZTQTK-UHFFFAOYSA-N 2 0 348.481 4.066 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@H]1CCC[N@H+](C)CC1 ZINC001173541799 1050474644 /nfs/dbraw/zinc/47/46/44/1050474644.db2.gz DAOQWMZFJIOVAQ-HIFRSBDPSA-N 2 0 329.315 4.388 20 0 EIADRP Clc1ccc2sc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)cc2n1 ZINC001203255470 1050476092 /nfs/dbraw/zinc/47/60/92/1050476092.db2.gz WGOCOFCJDAQGAO-UHFFFAOYSA-N 2 0 349.931 4.161 20 0 EIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)s1 ZINC000092856922 1050481416 /nfs/dbraw/zinc/48/14/16/1050481416.db2.gz PJYJDVCUJAQHLB-CYBMUJFWSA-N 2 0 335.904 4.364 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]CCC[NH+]1CCCC1 ZINC001173551203 1050488762 /nfs/dbraw/zinc/48/87/62/1050488762.db2.gz ULDJBTCEXHYEBN-CQSZACIVSA-N 2 0 329.315 4.390 20 0 EIADRP CC[C@H]1CCC[C@H]1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC001178748667 1050542063 /nfs/dbraw/zinc/54/20/63/1050542063.db2.gz WDLQUCHGRLPIKM-PMACEKPBSA-N 2 0 330.516 4.077 20 0 EIADRP C[N@H+](CC1CC[NH+](C)CC1)C1CCC2(CCc3ccccc32)CC1 ZINC001173690408 1050543076 /nfs/dbraw/zinc/54/30/76/1050543076.db2.gz SHBYSDSLNQADDB-UHFFFAOYSA-N 2 0 326.528 4.087 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1nc2c(s1)CCCC2 ZINC000093398279 1050587287 /nfs/dbraw/zinc/58/72/87/1050587287.db2.gz KSBHPZQJGDIKMT-HOTGVXAUSA-N 2 0 335.561 4.185 20 0 EIADRP Clc1ccc(C[NH2+][C@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)o1 ZINC001179771854 1050766828 /nfs/dbraw/zinc/76/68/28/1050766828.db2.gz ONNNXMDUSDDZNF-SQNIBIBYSA-N 2 0 344.886 4.323 20 0 EIADRP CCCCCCOc1cccc(C[NH2+][C@@H]2CC[C@@H]3C[N@H+](C)C[C@H]23)c1 ZINC001179816794 1050785178 /nfs/dbraw/zinc/78/51/78/1050785178.db2.gz NTXGFHPXNHPHEP-HLAWJBBLSA-N 2 0 330.516 4.076 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccsc2C(F)(F)F)CC1 ZINC001180051733 1050869652 /nfs/dbraw/zinc/86/96/52/1050869652.db2.gz KFBLLTNXLJSTRQ-UHFFFAOYSA-N 2 0 334.451 4.321 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(OCC)cc2C)CC1 ZINC001180123511 1050892640 /nfs/dbraw/zinc/89/26/40/1050892640.db2.gz BGBZDPDPDFKXJV-UHFFFAOYSA-N 2 0 332.532 4.338 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@H](C)C2CCOCC2)ccc1OC ZINC000183130389 1050988692 /nfs/dbraw/zinc/98/86/92/1050988692.db2.gz HOEWWQAIHPAKRH-SJORKVTESA-N 2 0 348.531 4.003 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@H](C)C2CCOCC2)ccc1OC ZINC000183130374 1050988815 /nfs/dbraw/zinc/98/88/15/1050988815.db2.gz HOEWWQAIHPAKRH-IAGOWNOFSA-N 2 0 348.531 4.003 20 0 EIADRP Cc1nc(C)c(C[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)s1 ZINC000076866434 1051010665 /nfs/dbraw/zinc/01/06/65/1051010665.db2.gz UTKHHJLZELWXHA-UHFFFAOYSA-N 2 0 343.540 4.282 20 0 EIADRP COc1ccc(C[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)c2ccccc12 ZINC000620109491 1051026182 /nfs/dbraw/zinc/02/61/82/1051026182.db2.gz KHZHPTGZUARIME-GOSISDBHSA-N 2 0 340.511 4.450 20 0 EIADRP CCN(Cc1ccc(Cl)nc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076154974 1051116424 /nfs/dbraw/zinc/11/64/24/1051116424.db2.gz NXIQTPMSWCYOOB-IBGZPJMESA-N 2 0 343.902 4.079 20 0 EIADRP C(C[NH+]1CCC(C[NH+]2CCCCCC2)CC1)OC1CCCCCC1 ZINC001190319565 1051149425 /nfs/dbraw/zinc/14/94/25/1051149425.db2.gz VNYAKHXJOMFTJE-UHFFFAOYSA-N 2 0 336.564 4.314 20 0 EIADRP CN(Cc1ccccc1)[C@H](C[NH2+][C@H]1CS[C@H](C(C)(C)C)C1)C1CC1 ZINC001181115852 1051156093 /nfs/dbraw/zinc/15/60/93/1051156093.db2.gz ZISGUTRPKXSWMB-AQNXPRMDSA-N 2 0 346.584 4.407 20 0 EIADRP CC(C)c1ccc(CC[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC001181349098 1051215946 /nfs/dbraw/zinc/21/59/46/1051215946.db2.gz KMVCVSOXXRSHGM-QFIPXVFZSA-N 2 0 336.523 4.464 20 0 EIADRP C[C@@H](CSCCF)[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC001181454784 1051229674 /nfs/dbraw/zinc/22/96/74/1051229674.db2.gz GPYDAHLSTUCCTL-KRWDZBQOSA-N 2 0 338.536 4.099 20 0 EIADRP CCN(CCC[NH+]1CCCC1)Cc1cc(OC)cc(C(F)(F)F)c1 ZINC001181506298 1051242359 /nfs/dbraw/zinc/24/23/59/1051242359.db2.gz PCPUQUBKNUUZDN-UHFFFAOYSA-N 2 0 344.421 4.022 20 0 EIADRP CC1(C)CC[NH+](CCC[NH+]2CCC(Cc3ccccc3)CC2)CC1 ZINC001190745294 1051269326 /nfs/dbraw/zinc/26/93/26/1051269326.db2.gz WCLWWOAAOGBCFD-UHFFFAOYSA-N 2 0 328.544 4.453 20 0 EIADRP C([C@@H]1CCC2(CCCCCC2)O1)[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC001191098490 1051348740 /nfs/dbraw/zinc/34/87/40/1051348740.db2.gz CWLBBRDOYPZTJC-PMACEKPBSA-N 2 0 334.548 4.209 20 0 EIADRP C=Cc1ccc(CC[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC001181945459 1051359005 /nfs/dbraw/zinc/35/90/05/1051359005.db2.gz MFCASKALIGYAED-AUSIDOKSSA-N 2 0 334.507 4.372 20 0 EIADRP CCO[C@@H]1C[C@H]([N@H+](C)Cc2ccc(C[NH+]3CCCCC3)cc2)C1(C)C ZINC001191164592 1051372109 /nfs/dbraw/zinc/37/21/09/1051372109.db2.gz GXDZCEVPIBNRIG-LEWJYISDSA-N 2 0 344.543 4.308 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@H]3CCCCC3(F)F)CC2)C1 ZINC001182054101 1051385962 /nfs/dbraw/zinc/38/59/62/1051385962.db2.gz SDNQLPCNFSABMC-JFIYKMOQSA-N 2 0 328.491 4.445 20 0 EIADRP c1ccc([C@H]2C[C@@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)CCO2)cc1 ZINC000155269495 1051398912 /nfs/dbraw/zinc/39/89/12/1051398912.db2.gz RHVSVJWHKBVIDY-RBBKRZOGSA-N 2 0 342.527 4.293 20 0 EIADRP CO[C@H](CC(C)C)C[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001191358533 1051428305 /nfs/dbraw/zinc/42/83/05/1051428305.db2.gz MMZBVIWRHYQDJR-YADHBBJMSA-N 2 0 344.543 4.036 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](CCCOc3cccc(C(C)(C)C)c3)CC[C@@H]21 ZINC001191521354 1051471958 /nfs/dbraw/zinc/47/19/58/1051471958.db2.gz PYFYREOFWSGLPC-NQIIRXRSSA-N 2 0 344.543 4.169 20 0 EIADRP CCO[C@@H]1CN(Cc2ccccc2)C[C@H]1C[NH2+]CCC1CCCCC1 ZINC001182423535 1051542982 /nfs/dbraw/zinc/54/29/82/1051542982.db2.gz FTLDOPRCQHMNPV-FGZHOGPDSA-N 2 0 344.543 4.084 20 0 EIADRP Cc1cccc(C)c1OCCC[N@@H+](CC(C)C)CC1CC[NH+](C)CC1 ZINC001175601860 1051667459 /nfs/dbraw/zinc/66/74/59/1051667459.db2.gz VMIKGDUVRQBSOK-UHFFFAOYSA-N 2 0 346.559 4.372 20 0 EIADRP CCc1cccc(C[NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)c1 ZINC001182683868 1051672601 /nfs/dbraw/zinc/67/26/01/1051672601.db2.gz HNIRKEHWZVVIRX-VABKMULXSA-N 2 0 334.507 4.392 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]C[C@@H]3CCC[N@H+](C)C3)cs2)cs1 ZINC000158172579 1051721992 /nfs/dbraw/zinc/72/19/92/1051721992.db2.gz QRAPHEGZORWBNI-OCCSQVGLSA-N 2 0 335.542 4.172 20 0 EIADRP CC[N@H+](CCC1CC[NH+](CCCOC(C)(C)C)CC1)CC(C)C ZINC001192490638 1051745430 /nfs/dbraw/zinc/74/54/30/1051745430.db2.gz RNIFOIWSTACPHX-UHFFFAOYSA-N 2 0 326.569 4.272 20 0 EIADRP C[C@@]1(C[NH3+])CCCCN(Cc2cccc(C(F)(F)F)c2Cl)C1 ZINC001206550059 1051757282 /nfs/dbraw/zinc/75/72/82/1051757282.db2.gz UMTOOMKURDMAEJ-HNNXBMFYSA-N 2 0 334.813 4.310 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]C2CCN(c3ccccc3)CC2)C1 ZINC000158582501 1051760519 /nfs/dbraw/zinc/76/05/19/1051760519.db2.gz RJRZWPSACDTMKH-PMACEKPBSA-N 2 0 343.559 4.003 20 0 EIADRP COC1(C[C@H](C)[NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CCC1 ZINC001183145735 1051792666 /nfs/dbraw/zinc/79/26/66/1051792666.db2.gz MZYQDAUMPRTUMQ-IBGZPJMESA-N 2 0 344.543 4.226 20 0 EIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H]3CCO[C@H]3c3ccccc3)CC2)C1 ZINC001183312256 1051824657 /nfs/dbraw/zinc/82/46/57/1051824657.db2.gz HDCXIZBFLRTFFU-UPZYVNNASA-N 2 0 342.527 4.149 20 0 EIADRP C[C@]1([NH3+])CCC[N@H+](Cc2ccc3cc(Br)ccc3c2)CC1 ZINC001205274274 1051863784 /nfs/dbraw/zinc/86/37/84/1051863784.db2.gz UPMQIGPKBUNHOA-SFHVURJKSA-N 2 0 347.300 4.306 20 0 EIADRP C[C@@]1(c2ccccc2)CC[C@@H]([NH2+]C2CCC(C)([NH+]3CCC3)CC2)C1 ZINC001184135538 1051953383 /nfs/dbraw/zinc/95/33/83/1051953383.db2.gz RMDCHYCIIHSBON-PWAJEDTMSA-N 2 0 326.528 4.493 20 0 EIADRP C[C@H](Cc1ccc(-c2ccccc2)cc1)[NH2+][C@@H]1CC[C@@H]2C[N@H+](C)C[C@H]12 ZINC001184386272 1052001956 /nfs/dbraw/zinc/00/19/56/1052001956.db2.gz AMWFWTLGJPVKGC-OCYFJXFZSA-N 2 0 334.507 4.214 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000165888596 1052079568 /nfs/dbraw/zinc/07/95/68/1052079568.db2.gz JRFKXJJDDMJNPE-QZTJIDSGSA-N 2 0 326.484 4.347 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccc(-c2nc3ccccc3[nH]2)cc1 ZINC000167510981 1052120541 /nfs/dbraw/zinc/12/05/41/1052120541.db2.gz PEXOPKSNMZTDDZ-XFQAVAEZSA-N 2 0 348.494 4.048 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cccc(C)c1Br ZINC001177093144 1052229404 /nfs/dbraw/zinc/22/94/04/1052229404.db2.gz NYSOGUMAKVRGSU-OAHLLOKOSA-N 2 0 341.337 4.358 20 0 EIADRP COc1cc(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)ccc1Cl ZINC000623356753 1052631273 /nfs/dbraw/zinc/63/12/73/1052631273.db2.gz FLMPSYQYPSDHGE-UHFFFAOYSA-N 2 0 346.902 4.479 20 0 EIADRP CO[C@H](C[NH2+][C@@H](C)c1ccc(-n2ccnc2C)cc1)c1ccccc1 ZINC000178458215 1052706046 /nfs/dbraw/zinc/70/60/46/1052706046.db2.gz YHSQQJFIAILUPY-HRAATJIYSA-N 2 0 335.451 4.219 20 0 EIADRP Clc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000623755267 1052779163 /nfs/dbraw/zinc/77/91/63/1052779163.db2.gz ABWLZIDAEWAULR-VCBZYWHSSA-N 2 0 343.902 4.415 20 0 EIADRP Cc1csc([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)n1 ZINC000623880877 1052829781 /nfs/dbraw/zinc/82/97/81/1052829781.db2.gz WWOOBUNKQQCVMJ-CQSZACIVSA-N 2 0 335.542 4.076 20 0 EIADRP Cc1csc([C@H](C)[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)n1 ZINC000623924196 1052838813 /nfs/dbraw/zinc/83/88/13/1052838813.db2.gz VLRCZIRXESRYOW-JENIJYKNSA-N 2 0 343.540 4.403 20 0 EIADRP Clc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@H]1CCc2nc[nH]c2C1 ZINC000623985992 1052844297 /nfs/dbraw/zinc/84/42/97/1052844297.db2.gz IFNFDZVLIMEYDW-SJCJKPOMSA-N 2 0 340.858 4.069 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(F)cc1C(F)(F)F ZINC000623972177 1052846015 /nfs/dbraw/zinc/84/60/15/1052846015.db2.gz UINDQOICBIGTAK-GFCCVEGCSA-N 2 0 344.396 4.370 20 0 EIADRP CC(C)c1cccc([C@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)c1 ZINC000624010428 1052851920 /nfs/dbraw/zinc/85/19/20/1052851920.db2.gz OPODTKZKZPWEFF-SFHVURJKSA-N 2 0 344.543 4.352 20 0 EIADRP Cc1cccc([C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C(C)C)c1 ZINC000624010497 1052851995 /nfs/dbraw/zinc/85/19/95/1052851995.db2.gz QPJLFLNLHSNDHS-QFIPXVFZSA-N 2 0 344.543 4.173 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCCC[C@H]2Sc2ccc(F)cc2)C1 ZINC000624008965 1052855293 /nfs/dbraw/zinc/85/52/93/1052855293.db2.gz LWIFCDRUTWPOJY-IWKCEXAMSA-N 2 0 336.520 4.159 20 0 EIADRP C[C@H]([NH2+]CCSc1ccc(F)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185706586 1053021001 /nfs/dbraw/zinc/02/10/01/1053021001.db2.gz DKESLWHYHAKWCM-JKSUJKDBSA-N 2 0 336.520 4.160 20 0 EIADRP CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000381131100 1053054541 /nfs/dbraw/zinc/05/45/41/1053054541.db2.gz KHCIPDQMARXAJU-UYAOXDASSA-N 2 0 338.495 4.258 20 0 EIADRP Fc1cccc(C2CC([NH2+]C[C@H]3CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC000381147886 1053054957 /nfs/dbraw/zinc/05/49/57/1053054957.db2.gz IYYDCRYYIZFSRP-HOHBBMLPSA-N 2 0 338.470 4.183 20 0 EIADRP Clc1cccc(C[NH+]2CCC3(C[NH+](Cc4ccccc4)C3)CC2)c1 ZINC001203800852 1053087694 /nfs/dbraw/zinc/08/76/94/1053087694.db2.gz GNFIRUGXWRALFD-UHFFFAOYSA-N 2 0 340.898 4.438 20 0 EIADRP c1ccc(CC2CC[NH+](CCC[N@@H+]3CCC[C@H](C4CC4)C3)CC2)cc1 ZINC001194806912 1053108143 /nfs/dbraw/zinc/10/81/43/1053108143.db2.gz NWYZQTHOQDFEJR-QHCPKHFHSA-N 2 0 340.555 4.453 20 0 EIADRP c1ccc(C[C@@H]2CCC[C@H]2[NH2+]C2CC[NH+](C3CCCCC3)CC2)nc1 ZINC000850387301 1053158169 /nfs/dbraw/zinc/15/81/69/1053158169.db2.gz QQGGLMOQBNZEKR-PGRDOPGGSA-N 2 0 341.543 4.180 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cc2ccccc2[nH]1 ZINC000775628275 1053220205 /nfs/dbraw/zinc/22/02/05/1053220205.db2.gz QSTOMFVCZAVHFI-QUCCMNQESA-N 2 0 347.506 4.383 20 0 EIADRP Cc1cc(F)ccc1[C@@H](C)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000850514254 1053275541 /nfs/dbraw/zinc/27/55/41/1053275541.db2.gz LUDYRXPJDBXXIB-QGZVFWFLSA-N 2 0 341.474 4.092 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)C1 ZINC000339070113 1053320673 /nfs/dbraw/zinc/32/06/73/1053320673.db2.gz WPWCKUPRTRSTIP-IIZPIQPGSA-N 2 0 344.543 4.112 20 0 EIADRP COc1ccc(CC[C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000764963356 1053397833 /nfs/dbraw/zinc/39/78/33/1053397833.db2.gz NRHJYGAQVXGWIT-MOPGFXCFSA-N 2 0 332.532 4.261 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1cnn(-c2ccccc2)c1 ZINC000764965134 1053402344 /nfs/dbraw/zinc/40/23/44/1053402344.db2.gz URPKBSGTXBHZTN-MOPGFXCFSA-N 2 0 340.515 4.178 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)cc2)cs1 ZINC000339072185 1053476561 /nfs/dbraw/zinc/47/65/61/1053476561.db2.gz UQOGSYJIWKPCHE-JVPBZIDWSA-N 2 0 341.524 4.396 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccnc(Cl)c1 ZINC000765327367 1053504088 /nfs/dbraw/zinc/50/40/88/1053504088.db2.gz OTHXRPWERPQDGU-MRXNPFEDSA-N 2 0 343.902 4.298 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](C)c1cccc(F)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000765360754 1053516396 /nfs/dbraw/zinc/51/63/96/1053516396.db2.gz SHQMWRMNRHXVFX-IAGOWNOFSA-N 2 0 344.474 4.220 20 0 EIADRP C[C@H]([NH2+]Cc1cnc2c(F)cccc2c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000865523485 1053534195 /nfs/dbraw/zinc/53/41/95/1053534195.db2.gz CFQLRQRFCUOGFV-YJBOKZPZSA-N 2 0 341.474 4.117 20 0 EIADRP c1ccc(CN2CC[C@@H]([NH2+]CC[C@H]3CCCS3)CC23CC3)cc1 ZINC000865725616 1053578429 /nfs/dbraw/zinc/57/84/29/1053578429.db2.gz NCPJRROVXDZHGU-RTBURBONSA-N 2 0 330.541 4.059 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)c(C)o1 ZINC000120945761 1053650179 /nfs/dbraw/zinc/65/01/79/1053650179.db2.gz XUWSXIPTBNBLLA-UHFFFAOYSA-N 2 0 338.451 4.411 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](c1ccccn1)C(C)C ZINC000866218887 1053653639 /nfs/dbraw/zinc/65/36/39/1053653639.db2.gz AQSPITXNTSIETD-OAQYLSRUSA-N 2 0 325.500 4.410 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](C)CCc2cncc3ccccc32)CC1 ZINC000866218599 1053654477 /nfs/dbraw/zinc/65/44/77/1053654477.db2.gz SRAIDHZLSGLRCT-KRWDZBQOSA-N 2 0 325.500 4.020 20 0 EIADRP CC(C)[C@H]([NH2+]C[C@@H]1CCCN(Cc2cccs2)C1)c1ccccn1 ZINC000866250510 1053665019 /nfs/dbraw/zinc/66/50/19/1053665019.db2.gz CXGHKKDMMLKPRJ-PXNSSMCTSA-N 2 0 343.540 4.342 20 0 EIADRP C[C@H](CCc1cncc2ccccc21)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000866349633 1053699520 /nfs/dbraw/zinc/69/95/20/1053699520.db2.gz LFMASZIULVYMML-QGZVFWFLSA-N 2 0 337.511 4.020 20 0 EIADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H](CCc2ccccc2)c2ccccn2)C1 ZINC000866372467 1053708141 /nfs/dbraw/zinc/70/81/41/1053708141.db2.gz GXFDBBBDCSNYRZ-IFMALSPDSA-N 2 0 337.511 4.077 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+](Cc1cccc(C(F)(F)F)c1)CC2 ZINC001196799982 1053756669 /nfs/dbraw/zinc/75/66/69/1053756669.db2.gz ZGYJJEBYDDGDIK-UHFFFAOYSA-N 2 0 326.406 4.013 20 0 EIADRP COCCC[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ccc(F)cc1 ZINC000866517579 1053765093 /nfs/dbraw/zinc/76/50/93/1053765093.db2.gz IWRRGHLGPGCEMA-IOJLRTSASA-N 2 0 336.495 4.146 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@@H](c2ccc(F)cc2)c2ccccn2)CC1 ZINC000866517375 1053765106 /nfs/dbraw/zinc/76/51/06/1053765106.db2.gz IBJUMCDNSJHPNA-CKHPTIKVSA-N 2 0 341.474 4.163 20 0 EIADRP CC(C)C1=[NH+]CCc2ccc(N3C[C@@H](CC[NH3+])c4ccccc43)cc21 ZINC001168547225 1053785381 /nfs/dbraw/zinc/78/53/81/1053785381.db2.gz BMTFZKNXFARAMC-QGZVFWFLSA-N 2 0 333.479 4.272 20 0 EIADRP Cc1ccccc1OCCC[N@H+]1CCC[C@@H]1CC[NH+]1CCC(C)CC1 ZINC001196936795 1053808228 /nfs/dbraw/zinc/80/82/28/1053808228.db2.gz URXHYNOHPVLKGT-OAQYLSRUSA-N 2 0 344.543 4.350 20 0 EIADRP C[N@H+](CCCC[NH+]1CCCCC1)Cc1cccc(F)c1OC(F)F ZINC001197284817 1053875852 /nfs/dbraw/zinc/87/58/52/1053875852.db2.gz MHNLPZHYIINFKN-UHFFFAOYSA-N 2 0 344.421 4.125 20 0 EIADRP COC1CCC(CC[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)CC1 ZINC000542665991 1054032055 /nfs/dbraw/zinc/03/20/55/1054032055.db2.gz TXPRUQQTVLPDKM-SDEKRAFDSA-N 2 0 336.564 4.214 20 0 EIADRP Cc1cnc(Cl)c(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c1 ZINC000921629663 1054192671 /nfs/dbraw/zinc/19/26/71/1054192671.db2.gz NNHWQTXBYANKFR-UHFFFAOYSA-N 2 0 349.931 4.107 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2ccsc2C(F)(F)F)CC1 ZINC001203918207 1054287621 /nfs/dbraw/zinc/28/76/21/1054287621.db2.gz SEDVRWFXHYLRAC-UHFFFAOYSA-N 2 0 332.435 4.264 20 0 EIADRP Fc1ccc(/C=C\C[NH2+]C[C@@H](c2ccccc2)N2CCCC2)c(F)c1 ZINC001198967720 1054314584 /nfs/dbraw/zinc/31/45/84/1054314584.db2.gz BZNJKGZGBBDBFQ-AVKJRPAMSA-N 2 0 342.433 4.405 20 0 EIADRP CC(C)Oc1cccc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c1 ZINC001199045743 1054331351 /nfs/dbraw/zinc/33/13/51/1054331351.db2.gz RFURNQVTEIMNSL-UHFFFAOYSA-N 2 0 338.495 4.359 20 0 EIADRP CC[C@H](CCC(F)(F)F)[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000872032511 1054350302 /nfs/dbraw/zinc/35/03/02/1054350302.db2.gz VICIDGYXKIORFS-ZWKOTPCHSA-N 2 0 342.449 4.262 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCOC4(CCCC4)C3)CC2)CC1 ZINC000872051989 1054364165 /nfs/dbraw/zinc/36/41/65/1054364165.db2.gz LXXZWIRGCZYEOS-IOJLRTSASA-N 2 0 334.548 4.111 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2nccc3ccccc32)C1 ZINC001199319396 1054390789 /nfs/dbraw/zinc/39/07/89/1054390789.db2.gz AUOGENWNZUVIEQ-QZTJIDSGSA-N 2 0 325.500 4.083 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc(OC(F)F)c(F)c1 ZINC001199336158 1054394174 /nfs/dbraw/zinc/39/41/74/1054394174.db2.gz IDTFXUFRASPOAM-AWEZNQCLSA-N 2 0 344.421 4.171 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1Cc1c[nH]c2c1cccc2F ZINC001137059308 1054442818 /nfs/dbraw/zinc/44/28/18/1054442818.db2.gz WGYKMZXCPJAWTJ-IRXDYDNUSA-N 2 0 329.463 4.146 20 0 EIADRP COc1c(C)cc([C@@H](C)[NH2+]Cc2cccc3c2CC[NH2+]C3)cc1Cl ZINC000873235558 1054512171 /nfs/dbraw/zinc/51/21/71/1054512171.db2.gz ONYMQSCCSSFUAE-CQSZACIVSA-N 2 0 344.886 4.154 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1csc(-c2ccccc2F)n1 ZINC000873260461 1054516695 /nfs/dbraw/zinc/51/66/95/1054516695.db2.gz ARLNWNHJQLBHJE-APIJFGDWSA-N 2 0 345.487 4.130 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]C[C@H]2C[C@H]3CC[C@@H](C2)[NH2+]3)sc1Br ZINC000873261601 1054516786 /nfs/dbraw/zinc/51/67/86/1054516786.db2.gz PKITYJYXWJRODN-FVCCEPFGSA-N 2 0 343.334 4.000 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(SC(F)F)cc1 ZINC000873259964 1054516865 /nfs/dbraw/zinc/51/68/65/1054516865.db2.gz POVHQNMSXKPFSH-RJZRQDKASA-N 2 0 326.456 4.183 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+][C@@H](C)C3CC[NH2+]CC3)cs2)cs1 ZINC000873270842 1054520653 /nfs/dbraw/zinc/52/06/53/1054520653.db2.gz BJBWMVSZTQTLST-RYUDHWBXSA-N 2 0 335.542 4.219 20 0 EIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]CC(C)(C)CC(C)C)CC1 ZINC001200933680 1054582589 /nfs/dbraw/zinc/58/25/89/1054582589.db2.gz ZPXIHTVNXLKZHC-UHFFFAOYSA-N 2 0 345.575 4.381 20 0 EIADRP C[C@H]1C[C@H](CC[NH2+]Cc2nc3ccccc3o2)C[N@@H+]1Cc1ccccc1 ZINC001201492512 1054818836 /nfs/dbraw/zinc/81/88/36/1054818836.db2.gz QHDZOIDOAGCAKO-HKUYNNGSSA-N 2 0 349.478 4.218 20 0 EIADRP CCC[C@@H](C)C[NH+]1CCC2(CCC[N@@H+]2Cc2c(C)noc2C)CC1 ZINC001201542837 1054836586 /nfs/dbraw/zinc/83/65/86/1054836586.db2.gz MBKIDMCAEUYYGY-MRXNPFEDSA-N 2 0 333.520 4.158 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001201609242 1054863920 /nfs/dbraw/zinc/86/39/20/1054863920.db2.gz FEKULCPALOKNJL-DHIUTWEWSA-N 2 0 334.507 4.073 20 0 EIADRP c1ccc(CCC[N@@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001201681701 1054874123 /nfs/dbraw/zinc/87/41/23/1054874123.db2.gz CIZQLBIMNVMSIZ-BJKOFHAPSA-N 2 0 348.534 4.463 20 0 EIADRP CSCCC[N@@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3cccs3)[C@H]2C1 ZINC001201680826 1054874302 /nfs/dbraw/zinc/87/43/02/1054874302.db2.gz ODLXIDZCYDFOOY-SZMVWBNQSA-N 2 0 338.586 4.034 20 0 EIADRP Cc1oc(C(C)(C)C)cc1C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC001201665331 1054879697 /nfs/dbraw/zinc/87/96/97/1054879697.db2.gz ZIHPHAKEVDCAPX-UHFFFAOYSA-N 2 0 341.499 4.287 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(-c2cccnc2)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001201946717 1054962605 /nfs/dbraw/zinc/96/26/05/1054962605.db2.gz KTXXNFWZQKJBLR-AVRDEDQJSA-N 2 0 349.522 4.491 20 0 EIADRP CCO[P@@](C)(=O)CC[C@@H](C)[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000877075630 1055013766 /nfs/dbraw/zinc/01/37/66/1055013766.db2.gz DGWCOEIUYMHAEC-HXPZTIBPSA-N 2 0 344.480 4.096 20 0 EIADRP Cc1c(C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)ccnc1F ZINC000862251172 1055033503 /nfs/dbraw/zinc/03/35/03/1055033503.db2.gz WUAJQRXHWSJKNB-MRXNPFEDSA-N 2 0 333.495 4.006 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@H]2CCC(F)(F)C2)ccc1OC ZINC000777242762 1055042795 /nfs/dbraw/zinc/04/27/95/1055042795.db2.gz PUKMSKRYMGGYAY-PBHICJAKSA-N 2 0 340.458 4.375 20 0 EIADRP CCO[P@](C)(=O)CC[C@H](C)[NH2+]C[C@H]1CCC[N@@H+]1C1CCCCC1 ZINC000877495658 1055065847 /nfs/dbraw/zinc/06/58/47/1055065847.db2.gz GQOIFDCLTZLKMR-XAEMIUIASA-N 2 0 344.480 4.096 20 0 EIADRP CCO[P@](C)(=O)CC[C@@H](C)[NH2+]C[C@H]1CCC[N@@H+]1C1CCCCC1 ZINC000877495657 1055066600 /nfs/dbraw/zinc/06/66/00/1055066600.db2.gz GQOIFDCLTZLKMR-UQNRQAKVSA-N 2 0 344.480 4.096 20 0 EIADRP Clc1ccc(CNCc2ccccc2C[NH+]2CCCCC2)nc1 ZINC000776255409 1055089429 /nfs/dbraw/zinc/08/94/29/1055089429.db2.gz WLRXEAXRPXUTCI-UHFFFAOYSA-N 2 0 329.875 4.011 20 0 EIADRP C[C@@]1(C[NH2+]C/C=C/c2ccc(F)cc2)CC[N@H+](Cc2ccccc2)C1 ZINC001202221002 1055093018 /nfs/dbraw/zinc/09/30/18/1055093018.db2.gz XUTUWIFFHNUYMW-PABBZOGXSA-N 2 0 338.470 4.341 20 0 EIADRP CCO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)C1 ZINC001202288318 1055124874 /nfs/dbraw/zinc/12/48/74/1055124874.db2.gz AZEBTNZZKJDQHO-FGZHOGPDSA-N 2 0 344.543 4.356 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)c1cccnc1 ZINC000112528582 1055236044 /nfs/dbraw/zinc/23/60/44/1055236044.db2.gz XLAUUHRRRAYEAO-QRVBRYPASA-N 2 0 337.511 4.410 20 0 EIADRP C[C@H](Cc1ccccn1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000655834518 1055702341 /nfs/dbraw/zinc/70/23/41/1055702341.db2.gz PHQMRUPKEOVFJT-RLLPEYFOSA-N 2 0 349.522 4.045 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C1(Cc2ccccc2)CCCC1 ZINC000542708646 1055853022 /nfs/dbraw/zinc/85/30/22/1055853022.db2.gz JZMRPCINDNTVTF-UHFFFAOYSA-N 2 0 346.478 4.221 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2ncc(-c3ccc(Cl)cc3)o2)CC1 ZINC000056524968 1055877787 /nfs/dbraw/zinc/87/77/87/1055877787.db2.gz CTBWJHGMKLMCFY-UHFFFAOYSA-N 2 0 347.890 4.159 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)C1CCC(C(F)(F)F)CC1 ZINC000474615809 1055924936 /nfs/dbraw/zinc/92/49/36/1055924936.db2.gz GUJOESSHLKXSHG-IUDNXUCKSA-N 2 0 332.454 4.208 20 0 EIADRP Brc1ccc(C2([NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)CCC2)cc1 ZINC000180439622 1058612302 /nfs/dbraw/zinc/61/23/02/1058612302.db2.gz ZEUIZNQQZUQMGP-DLBZAZTESA-N 2 0 349.316 4.045 20 0 EIADRP COc1ccc(Cl)cc1C[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000742691867 1058724686 /nfs/dbraw/zinc/72/46/86/1058724686.db2.gz UMOJIFZJOMRZGL-UHFFFAOYSA-N 2 0 346.902 4.479 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cccc3cnccc32)CC1 ZINC000183057043 1059905537 /nfs/dbraw/zinc/90/55/37/1059905537.db2.gz RWHQZKKDCUXQHT-UHFFFAOYSA-N 2 0 325.500 4.179 20 0 EIADRP C[C@@H](CC[NH2+]Cc1ccc2cnccc2c1)[N@H+](C)Cc1ccccc1 ZINC000379641188 1060141875 /nfs/dbraw/zinc/14/18/75/1060141875.db2.gz CVVAESXBXDFIRZ-SFHVURJKSA-N 2 0 333.479 4.235 20 0 EIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]C[C@@H](C)CC(C)C)CC1 ZINC001168813922 1060417844 /nfs/dbraw/zinc/41/78/44/1060417844.db2.gz UEBDFBMEYNUMEX-ZWKOTPCHSA-N 2 0 349.538 4.300 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)cc1OC ZINC000766512027 1060484683 /nfs/dbraw/zinc/48/46/83/1060484683.db2.gz HYIZVDKKHSYCBZ-IPJUCJBFSA-N 2 0 346.515 4.152 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C(C)(C)Cc1cccc(C(F)(F)F)c1)C2 ZINC001169117086 1060647240 /nfs/dbraw/zinc/64/72/40/1060647240.db2.gz VQNPHJXISQCSPG-BJWYYQGGSA-N 2 0 340.433 4.241 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1(CC3CCC3)CCC(F)(F)CC1)C2 ZINC001169109321 1060657880 /nfs/dbraw/zinc/65/78/80/1060657880.db2.gz ASXZUBOCIGBJRG-BJWYYQGGSA-N 2 0 326.475 4.340 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+][C@H]3C[C@H]4CC[C@@H](C3)[N@H+]4C)cc2)cc1 ZINC001169107463 1060657960 /nfs/dbraw/zinc/65/79/60/1060657960.db2.gz HJXNNMLGTVNXAC-WKCHPHFGSA-N 2 0 336.479 4.077 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CC[C@H](c3ccc(C(F)(F)F)cc3)C1)C2 ZINC001169147651 1060666550 /nfs/dbraw/zinc/66/65/50/1060666550.db2.gz VSUPYEFXNMBVGX-DZJNRPSUSA-N 2 0 338.417 4.120 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](n1cc(C3CC[NH2+]CC3)c3c1cccc3F)C2 ZINC001169154749 1060670912 /nfs/dbraw/zinc/67/09/12/1060670912.db2.gz UDYQRYKLEYSFEY-FVQHAEBGSA-N 2 0 341.474 4.045 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](n1cc(C3CC[NH2+]CC3)c3cccc(F)c31)C2 ZINC001169155159 1060671202 /nfs/dbraw/zinc/67/12/02/1060671202.db2.gz YTWVTIBMNRDQBY-FVQHAEBGSA-N 2 0 341.474 4.045 20 0 EIADRP CC[N@H+](Cc1cccc(C(F)(F)F)c1)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169154947 1060671686 /nfs/dbraw/zinc/67/16/86/1060671686.db2.gz VBBSRQTUACIPOC-BJWYYQGGSA-N 2 0 326.406 4.153 20 0 EIADRP CC[NH+](CC)Cc1cncc(N2CCC[C@@H]([NH3+])c3cc(C)ccc32)c1 ZINC001169689404 1060900503 /nfs/dbraw/zinc/90/05/03/1060900503.db2.gz DNSSUJMYVSAVLL-HXUWFJFHSA-N 2 0 338.499 4.164 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1ccc([C@@H]2CC[N@@H+](C)C2)cc1 ZINC001169690537 1060903148 /nfs/dbraw/zinc/90/31/48/1060903148.db2.gz WSWYFEDAXUMUDI-WIYYLYMNSA-N 2 0 335.495 4.346 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H](CC1CC1)c1ccccc1 ZINC000532206133 1032091902 /nfs/dbraw/zinc/09/19/02/1032091902.db2.gz FFYYCJOHXFVIPM-OAQYLSRUSA-N 2 0 338.495 4.258 20 0 EIADRP CC(C)=CCOc1ccc(CC[C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000532225968 1032103148 /nfs/dbraw/zinc/10/31/48/1032103148.db2.gz GIPOACTXIFXJGR-CTNGQTDRSA-N 2 0 344.543 4.284 20 0 EIADRP CN(Cc1ccoc1)Cc1ccc(F)c(CN(C)Cc2ccoc2)c1 ZINC000450291404 1032404100 /nfs/dbraw/zinc/40/41/00/1032404100.db2.gz VDMJTTLPRGDVQT-UHFFFAOYSA-N 2 0 342.414 4.276 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)c1ccc(-n2ccnc2)cc1)COCc1ccccc1 ZINC000389899376 1032427247 /nfs/dbraw/zinc/42/72/47/1032427247.db2.gz ARXSPZCSYSOHDD-OALUTQOASA-N 2 0 349.478 4.376 20 0 EIADRP Cc1cc(C)c([C@H](C)[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c(C)c1 ZINC000532989240 1032429498 /nfs/dbraw/zinc/42/94/98/1032429498.db2.gz KUPWHGIWCFJLAQ-FQEVSTJZSA-N 2 0 344.543 4.250 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)C1CC(F)(F)C1 ZINC000529543736 1032434212 /nfs/dbraw/zinc/43/42/12/1032434212.db2.gz NDWNDUSWBSNAGA-BQFCYCMXSA-N 2 0 336.470 4.311 20 0 EIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CC(F)(F)C1 ZINC000529543575 1032434691 /nfs/dbraw/zinc/43/46/91/1032434691.db2.gz BHJSBXRGCIBYFW-AQXGTKIOSA-N 2 0 334.454 4.205 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccsc1 ZINC000177890480 1032523767 /nfs/dbraw/zinc/52/37/67/1032523767.db2.gz KCJAFKGVPRKVAG-ZACQAIPSSA-N 2 0 344.524 4.208 20 0 EIADRP CC(C)C1CCC([NH+]2CCN(C[C@H]3CCCC[N@@H+]3C(C)C)CC2)CC1 ZINC000450485713 1032527783 /nfs/dbraw/zinc/52/77/83/1032527783.db2.gz KAPCNXWYAVYFAG-LZBANZJXSA-N 2 0 349.607 4.082 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccccc1F ZINC000180151975 1032593500 /nfs/dbraw/zinc/59/35/00/1032593500.db2.gz YUZMMWKNNIBHHE-HXUWFJFHSA-N 2 0 330.447 4.007 20 0 EIADRP C[C@@H]1CCN(Cc2ccc(C(F)(F)F)s2)C[C@@H]1n1ccnc1 ZINC000432732336 1032618721 /nfs/dbraw/zinc/61/87/21/1032618721.db2.gz ULUNTBFRAKJAHD-YPMHNXCESA-N 2 0 329.391 4.047 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(C(F)(F)F)s2)CC1 ZINC000432737313 1032631545 /nfs/dbraw/zinc/63/15/45/1032631545.db2.gz CFSBMLNFPBMXNF-UHFFFAOYSA-N 2 0 334.451 4.321 20 0 EIADRP CC[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1F ZINC000180808675 1032644008 /nfs/dbraw/zinc/64/40/08/1032644008.db2.gz ZCMREIDIDJVVMW-FQEVSTJZSA-N 2 0 327.447 4.178 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2nc3ccc(F)cc3s2)CC1 ZINC000432743334 1032669047 /nfs/dbraw/zinc/66/90/47/1032669047.db2.gz YOFFDOSDZJVICM-UHFFFAOYSA-N 2 0 349.519 4.379 20 0 EIADRP COc1cc(-c2ccccc2)ccc1C[NH2+]CCC1CC[NH+](C)CC1 ZINC000512400361 1032669449 /nfs/dbraw/zinc/66/94/49/1032669449.db2.gz DYAWUDOZFAHUIX-UHFFFAOYSA-N 2 0 338.495 4.184 20 0 EIADRP CCC[C@H]([NH2+]Cc1cccc(CN2CCOCC2)c1)c1ccccc1 ZINC000163679831 1032676013 /nfs/dbraw/zinc/67/60/13/1032676013.db2.gz ALOMFHSNBXAENC-QFIPXVFZSA-N 2 0 338.495 4.150 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643545977 1018895601 /nfs/dbraw/zinc/89/56/01/1018895601.db2.gz GPYFHMGWGNZZQJ-RHSMWYFYSA-N 2 0 341.524 4.444 20 0 EIADRP Cc1nccn1CCCC[N@@H+](C)Cc1cccc(Cl)c1Cl ZINC000179394884 1019721327 /nfs/dbraw/zinc/72/13/27/1019721327.db2.gz AIIMQGKZFPEJHO-UHFFFAOYSA-N 2 0 326.271 4.411 20 0 EIADRP CCC[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccccn1 ZINC000179464476 1019737345 /nfs/dbraw/zinc/73/73/45/1019737345.db2.gz QVLZORFDHMRFNJ-OAQYLSRUSA-N 2 0 337.511 4.425 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc(CSC(F)F)o1 ZINC000120620042 1019897842 /nfs/dbraw/zinc/89/78/42/1019897842.db2.gz CGAZTZKONSVHGM-CQSZACIVSA-N 2 0 346.487 4.480 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2ccc(CSC(F)F)o2)CC1 ZINC000120622843 1019909625 /nfs/dbraw/zinc/90/96/25/1019909625.db2.gz FCFMVFIMJLUSCI-UHFFFAOYSA-N 2 0 346.487 4.337 20 0 EIADRP C[C@@H]1CC(C[N@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)C[C@@H](C)O1 ZINC001209390761 1020244445 /nfs/dbraw/zinc/24/44/45/1020244445.db2.gz NBRQFKHBKRMXKK-RTBURBONSA-N 2 0 344.543 4.034 20 0 EIADRP Fc1ccc(C2(C[NH2+]C3CC[NH+](CC4CC4)CC3)CCCC2)c(F)c1 ZINC000547931589 1020894783 /nfs/dbraw/zinc/89/47/83/1020894783.db2.gz MQHVOADZWKVKDJ-UHFFFAOYSA-N 2 0 348.481 4.241 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCCc3c(Cl)sc(Cl)c32)C1 ZINC000655806715 1020973251 /nfs/dbraw/zinc/97/32/51/1020973251.db2.gz ZTWHBRSXVQJRAB-JFGNBEQYSA-N 2 0 333.328 4.362 20 0 EIADRP Cc1cc(OCCC[C@H](C)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)ccc1Cl ZINC000655804039 1020974992 /nfs/dbraw/zinc/97/49/92/1020974992.db2.gz MYHWQPXKZLYAJF-YESZJQIVSA-N 2 0 338.923 4.126 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655806301 1020976484 /nfs/dbraw/zinc/97/64/84/1020976484.db2.gz UPKLAQBGGZFADF-UNEWFSDZSA-N 2 0 329.513 4.109 20 0 EIADRP C[C@@H](NCc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1ccncc1F ZINC000340469443 1021073334 /nfs/dbraw/zinc/07/33/34/1021073334.db2.gz JRMTVAAEYVEIHA-DLBZAZTESA-N 2 0 341.474 4.303 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCCc3ccc(O)cc32)C1 ZINC000340471529 1021079296 /nfs/dbraw/zinc/07/92/96/1021079296.db2.gz XWTNGHHCUSWIKV-FVJLSDCUSA-N 2 0 330.516 4.117 20 0 EIADRP C([C@@H]1CCC[N@H+](CC2([C@H]3CCCCO3)CCC2)C1)[NH+]1CCCCCC1 ZINC001167326740 1021130014 /nfs/dbraw/zinc/13/00/14/1021130014.db2.gz PZNQJMKXBZEGJD-LEWJYISDSA-N 2 0 348.575 4.314 20 0 EIADRP COc1cc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)ccc1OCC(C)C ZINC000892509666 1021309791 /nfs/dbraw/zinc/30/97/91/1021309791.db2.gz AEHSIOMRCUGANN-UXDRXVOSSA-N 2 0 346.515 4.006 20 0 EIADRP Cc1ccncc1CCC[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000584496445 1021330879 /nfs/dbraw/zinc/33/08/79/1021330879.db2.gz DSVRDBQJQDJYCU-FQEVSTJZSA-N 2 0 343.559 4.299 20 0 EIADRP CC(C)[C@H](C[NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000613259813 1021833571 /nfs/dbraw/zinc/83/35/71/1021833571.db2.gz FRQRHRMNZZQREP-QFIPXVFZSA-N 2 0 340.511 4.156 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc3c(c2)CCO3)c1 ZINC000177977868 1021837424 /nfs/dbraw/zinc/83/74/24/1021837424.db2.gz VIYSAWJWQVKZMK-QGZVFWFLSA-N 2 0 338.495 4.313 20 0 EIADRP COc1ccccc1[C@@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccccc1 ZINC000089554973 1021932919 /nfs/dbraw/zinc/93/29/19/1021932919.db2.gz LDWRYKZKUPTYLC-JTSKRJEESA-N 2 0 338.495 4.105 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccc(SCC(F)F)cc1 ZINC000414170135 1022020876 /nfs/dbraw/zinc/02/08/76/1022020876.db2.gz BRWLMMLYWXWXTK-LSDHHAIUSA-N 2 0 342.499 4.426 20 0 EIADRP CC[C@H]([NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccccc1 ZINC000414219528 1022190431 /nfs/dbraw/zinc/19/04/31/1022190431.db2.gz HQBRQJILMDJNJI-UTKZUKDTSA-N 2 0 326.484 4.429 20 0 EIADRP C[N@@H+]1CCCC[C@@H](C[NH2+]C(CCC(F)(F)F)CCC(F)(F)F)C1 ZINC000926754622 1022279627 /nfs/dbraw/zinc/27/96/27/1022279627.db2.gz PUCXLWZOUPOOIN-LBPRGKRZSA-N 2 0 348.375 4.362 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)cnc1F ZINC000892580204 1022309989 /nfs/dbraw/zinc/30/99/89/1022309989.db2.gz HZBCECIVGMFNNI-KRWDZBQOSA-N 2 0 341.474 4.193 20 0 EIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3cnc(-c4cccs4)s3)C2)CC1 ZINC000580636680 1022331557 /nfs/dbraw/zinc/33/15/57/1022331557.db2.gz ZNZWOZQUOSBSNF-OAHLLOKOSA-N 2 0 347.553 4.035 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc(C[NH+](C)C)cc2)ccc1C(F)(F)F ZINC000414258812 1022336698 /nfs/dbraw/zinc/33/66/98/1022336698.db2.gz MERACLNMIXXKNU-UHFFFAOYSA-N 2 0 336.401 4.365 20 0 EIADRP CCOc1ccccc1C1=CCN(CC[C@@H]2CCCC[N@@H+]2C)CC1 ZINC000472591796 1022630622 /nfs/dbraw/zinc/63/06/22/1022630622.db2.gz YQLXOWQJPCZVPG-IBGZPJMESA-N 2 0 328.500 4.049 20 0 EIADRP Cc1ccc(CC[NH2+]C2CCN([C@@H](C)c3ccncc3)CC2)cc1C ZINC000893201408 1022670944 /nfs/dbraw/zinc/67/09/44/1022670944.db2.gz UYFDQOYFUWOXFH-IBGZPJMESA-N 2 0 337.511 4.056 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@H]2CN(C)Cc3ccccc32)cc1 ZINC000378407578 1022805014 /nfs/dbraw/zinc/80/50/14/1022805014.db2.gz YAGSJCRJZJWUMT-AOMKIAJQSA-N 2 0 346.478 4.018 20 0 EIADRP c1ccc(C(CC[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c2ccccc2)cc1 ZINC000647550195 1022811691 /nfs/dbraw/zinc/81/16/91/1022811691.db2.gz FKXCDZUSDOGYMA-BHDDXSALSA-N 2 0 334.507 4.186 20 0 EIADRP COc1ccc([C@@H](C)[NH2+][C@@H](C)CSC)cc1C[NH+]1CCCCC1 ZINC000182995977 1022838739 /nfs/dbraw/zinc/83/87/39/1022838739.db2.gz RIBHBZONMAPQAY-JKSUJKDBSA-N 2 0 336.545 4.083 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](C)[C@H]1c1ccccc1)c1ccc(Cl)nc1 ZINC000378513142 1022853040 /nfs/dbraw/zinc/85/30/40/1022853040.db2.gz AGOMEDHCRQTWOU-FNHZYXHNSA-N 2 0 329.875 4.079 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C2C[C@@H](C)O[C@H](C)C2)ccc1OC ZINC000183421095 1022863304 /nfs/dbraw/zinc/86/33/04/1022863304.db2.gz MPNRSFOMGIPNAS-ZACQAIPSSA-N 2 0 348.531 4.144 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2c[nH]nc2-c2ccccc2)c1 ZINC000065976566 1022874242 /nfs/dbraw/zinc/87/42/42/1022874242.db2.gz JPGMODMBVBRUSZ-UHFFFAOYSA-N 2 0 348.494 4.207 20 0 EIADRP Cn1ccnc1C[C@H]([NH2+]Cc1ccc(C2CC2)cc1)c1ccccc1 ZINC000656503606 1023073808 /nfs/dbraw/zinc/07/38/08/1023073808.db2.gz PSHSXGHSGWBTSJ-NRFANRHFSA-N 2 0 331.463 4.371 20 0 EIADRP Cn1ccnc1C[C@@H]([NH2+]Cc1ccc(C2CC2)cc1)c1ccccc1 ZINC000656503607 1023074537 /nfs/dbraw/zinc/07/45/37/1023074537.db2.gz PSHSXGHSGWBTSJ-OAQYLSRUSA-N 2 0 331.463 4.371 20 0 EIADRP Cc1cc(C[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)ccc1Cl ZINC000581397617 1023105761 /nfs/dbraw/zinc/10/57/61/1023105761.db2.gz DTEXWEKBSDKFMK-INIZCTEOSA-N 2 0 346.902 4.440 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1cncc(F)c1 ZINC000156191754 1023135539 /nfs/dbraw/zinc/13/55/39/1023135539.db2.gz ILVWQLCTZKDODH-IRXDYDNUSA-N 2 0 341.474 4.446 20 0 EIADRP C[N@H+](CCCOc1ccc(C(C)(C)C)cc1)C[C@@H]1CCC[NH+](C)C1 ZINC000605421259 1023269072 /nfs/dbraw/zinc/26/90/72/1023269072.db2.gz WVTBJLWGTAWXJN-GOSISDBHSA-N 2 0 332.532 4.027 20 0 EIADRP Cc1cc(F)ncc1C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000892742191 1023359944 /nfs/dbraw/zinc/35/99/44/1023359944.db2.gz PIWZFYVKHVAENO-UHFFFAOYSA-N 2 0 341.474 4.195 20 0 EIADRP COc1cccc(SCC[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000660257464 1023396513 /nfs/dbraw/zinc/39/65/13/1023396513.db2.gz TZZSCRKNKKBFNG-IRXDYDNUSA-N 2 0 348.556 4.030 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000415040642 1023404497 /nfs/dbraw/zinc/40/44/97/1023404497.db2.gz PAUSTLLBVYWYPS-VJUNAUMWSA-N 2 0 326.406 4.059 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1ccc(C(F)(F)F)s1)c1ccccc1 ZINC000415049963 1023408207 /nfs/dbraw/zinc/40/82/07/1023408207.db2.gz HYUUPUUAQRPHTG-AWEZNQCLSA-N 2 0 328.403 4.337 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1csc(Br)c1)c1ccccc1 ZINC000415058144 1023410734 /nfs/dbraw/zinc/41/07/34/1023410734.db2.gz SRQJJWOAZBNATI-AWEZNQCLSA-N 2 0 339.302 4.080 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cnc(-c2ccsc2)s1)c1ccccc1 ZINC000415056731 1023410809 /nfs/dbraw/zinc/41/08/09/1023410809.db2.gz QMFOIOVMHDXVBF-QGZVFWFLSA-N 2 0 343.521 4.441 20 0 EIADRP COc1ccc(C[C@@H](C)C[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1F ZINC000415057567 1023410868 /nfs/dbraw/zinc/41/08/68/1023410868.db2.gz RQUQIJZXASCAKQ-OXQOHEQNSA-N 2 0 344.474 4.083 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ncc(-c2ccccc2)s1)c1ccccc1 ZINC000415057229 1023412075 /nfs/dbraw/zinc/41/20/75/1023412075.db2.gz RLRLXHBFOQFQQW-GOSISDBHSA-N 2 0 337.492 4.380 20 0 EIADRP COc1cc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)ccc1OC(C)C ZINC000415065495 1023412191 /nfs/dbraw/zinc/41/21/91/1023412191.db2.gz MXRDBFCJWFZGAT-LJQANCHMSA-N 2 0 342.483 4.052 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+]C3CCC(C[NH3+])CC3)s2)cc1 ZINC000415100877 1023444591 /nfs/dbraw/zinc/44/45/91/1023444591.db2.gz IHRLWWIEHCOFIL-UHFFFAOYSA-N 2 0 330.497 4.031 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccc(F)c(Br)c1 ZINC000019915206 1023453493 /nfs/dbraw/zinc/45/34/93/1023453493.db2.gz YPZQPISOTXFGNS-CYBMUJFWSA-N 2 0 345.300 4.188 20 0 EIADRP C[C@]1(C[NH2+]Cc2cccc3cc[nH]c32)CC[N@H+](Cc2ccccc2)C1 ZINC000310970410 1023495279 /nfs/dbraw/zinc/49/52/79/1023495279.db2.gz DERVVDQDYSFKTG-JOCHJYFZSA-N 2 0 333.479 4.170 20 0 EIADRP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)C1 ZINC000684369839 1023539976 /nfs/dbraw/zinc/53/99/76/1023539976.db2.gz BYKOLPKQRJCXQU-DZFGPLHGSA-N 2 0 330.516 4.108 20 0 EIADRP CC[NH+](CC)Cc1cc(NCCC[N@@H+]2CCCC[C@H]2C)ccc1OC ZINC001167754258 1023635699 /nfs/dbraw/zinc/63/56/99/1023635699.db2.gz QBYHBCZDTDKEAF-GOSISDBHSA-N 2 0 347.547 4.213 20 0 EIADRP C[C@H]1C[N@H+](C[C@H](C[NH+](C)Cc2ccccc2)c2ccccc2)C[C@H]1C ZINC001167483563 1023740126 /nfs/dbraw/zinc/74/01/26/1023740126.db2.gz XGHBKCQKOSKYBZ-MZKRTTBSSA-N 2 0 336.523 4.490 20 0 EIADRP C[C@@H]1C[NH+](C[C@@H](C[N@H+](C)Cc2ccccc2)c2ccccc2)C[C@H]1C ZINC001167483566 1023740453 /nfs/dbraw/zinc/74/04/53/1023740453.db2.gz XGHBKCQKOSKYBZ-TXTKFYIRSA-N 2 0 336.523 4.490 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000500426884 1023822329 /nfs/dbraw/zinc/82/23/29/1023822329.db2.gz HEAJOVMDEXPFDW-DYXWJJEUSA-N 2 0 329.532 4.065 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](CCC(=O)c2ccccc2)CC1 ZINC000543870375 1023874989 /nfs/dbraw/zinc/87/49/89/1023874989.db2.gz VEDSTCBNVWBALP-UHFFFAOYSA-N 2 0 330.516 4.093 20 0 EIADRP Cc1ccc2ncc(C[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)cc2c1 ZINC000662729624 1023973482 /nfs/dbraw/zinc/97/34/82/1023973482.db2.gz CWMOXWHAGKMTOZ-UHFFFAOYSA-N 2 0 325.500 4.095 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(Cn2ccnc2)cc1)[C@@H]1C[C@H]1c1ccccc1 ZINC000549523868 1024117214 /nfs/dbraw/zinc/11/72/14/1024117214.db2.gz YWZWGBUXEDMORZ-HSQYWUDLSA-N 2 0 331.463 4.213 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)CCCOc2ccc(Cl)c(C)c2)C1 ZINC000510653329 1024175350 /nfs/dbraw/zinc/17/53/50/1024175350.db2.gz RERWBZBBXGVHGA-SJORKVTESA-N 2 0 338.923 4.127 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000510699560 1024250253 /nfs/dbraw/zinc/25/02/53/1024250253.db2.gz BZSMHBUQTFDQRG-WBVHZDCISA-N 2 0 342.449 4.348 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CCN(C)[C@@H](C)C1 ZINC000510737091 1024378674 /nfs/dbraw/zinc/37/86/74/1024378674.db2.gz RVTIFRMEUHRMFC-JKIFEVAISA-N 2 0 328.422 4.099 20 0 EIADRP Clc1ccc([C@@H]2c3ccsc3CCN2CCn2ccnc2)cc1 ZINC000661788562 1024508158 /nfs/dbraw/zinc/50/81/58/1024508158.db2.gz QABNDDXVGAKZBJ-GOSISDBHSA-N 2 0 343.883 4.246 20 0 EIADRP Cc1ccc(-c2ncc(C[NH+]3CCC(CC[NH+](C)C)CC3)s2)cc1 ZINC000092381386 1024799452 /nfs/dbraw/zinc/79/94/52/1024799452.db2.gz DJGUVBXXKYFPPU-UHFFFAOYSA-N 2 0 343.540 4.282 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)o1 ZINC000548482336 1024826214 /nfs/dbraw/zinc/82/62/14/1024826214.db2.gz GDXCIRCCZXLUCZ-DSKINZAPSA-N 2 0 340.511 4.409 20 0 EIADRP CC[NH+](CC)CCOC1CC[NH+]([C@H](C)c2cccc(Cl)c2)CC1 ZINC000342105002 1025258905 /nfs/dbraw/zinc/25/89/05/1025258905.db2.gz XZYSKNFIVMDDGL-MRXNPFEDSA-N 2 0 338.923 4.224 20 0 EIADRP COc1cc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)ccc1SC ZINC000663466983 1025401476 /nfs/dbraw/zinc/40/14/76/1025401476.db2.gz CIPIPSTWEQQFFB-RDJZCZTQSA-N 2 0 348.556 4.190 20 0 EIADRP C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)o1 ZINC000066973468 1025625852 /nfs/dbraw/zinc/62/58/52/1025625852.db2.gz YNZCPCWBIXTZNS-OXJNMPFZSA-N 2 0 342.483 4.023 20 0 EIADRP c1cncc([C@@H]2CCC[C@@H]([NH2+]C3CC[NH+](CC4CCCC4)CC3)C2)c1 ZINC000500449338 1025694966 /nfs/dbraw/zinc/69/49/66/1025694966.db2.gz YXMRQDFBHAFWKO-DENIHFKCSA-N 2 0 341.543 4.352 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC001167833351 1025784117 /nfs/dbraw/zinc/78/41/17/1025784117.db2.gz APSSOASVHKWFRF-IRLDBZIGSA-N 2 0 345.575 4.093 20 0 EIADRP CCCOc1ccccc1[C@@H](CC(C)C)[NH2+]CCn1ccnc1C ZINC000342318645 1025845089 /nfs/dbraw/zinc/84/50/89/1025845089.db2.gz FDKPAACXIQYMDI-LJQANCHMSA-N 2 0 329.488 4.357 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+]Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000415023765 1025857178 /nfs/dbraw/zinc/85/71/78/1025857178.db2.gz NOZXJOJVTFVAAG-LLVKDONJSA-N 2 0 343.418 4.046 20 0 EIADRP COCc1csc(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c1 ZINC000657308310 1025862430 /nfs/dbraw/zinc/86/24/30/1025862430.db2.gz QADGKIPMVNSQTI-UHFFFAOYSA-N 2 0 332.513 4.025 20 0 EIADRP COc1ccc(CC[C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000415060636 1025863829 /nfs/dbraw/zinc/86/38/29/1025863829.db2.gz XCYZFLSCWBVMSK-UWJYYQICSA-N 2 0 326.484 4.086 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1cnn(C)c1 ZINC000157653585 1025904298 /nfs/dbraw/zinc/90/42/98/1025904298.db2.gz WXIFTLYPYRJPKO-LAUBAEHRSA-N 2 0 340.515 4.035 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CCCOc3cc4c(cc32)CCC4)C1 ZINC000431333251 1025910393 /nfs/dbraw/zinc/91/03/93/1025910393.db2.gz MWJLVVBLPPQEQJ-UWJYYQICSA-N 2 0 342.527 4.099 20 0 EIADRP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1cccc(OC(F)F)c1 ZINC000319783453 1025923002 /nfs/dbraw/zinc/92/30/02/1025923002.db2.gz GVGYZWIQMXHPNC-CABCVRRESA-N 2 0 326.431 4.203 20 0 EIADRP C[C@H]1C[N@H+](CCC[NH2+][C@@H](c2ccc(F)cc2)C2CCCC2)CCCO1 ZINC000432433115 1025971687 /nfs/dbraw/zinc/97/16/87/1025971687.db2.gz ZORANQBABCGQMQ-LAUBAEHRSA-N 2 0 348.506 4.148 20 0 EIADRP COCc1csc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000657332570 1026143355 /nfs/dbraw/zinc/14/33/55/1026143355.db2.gz JECCWGWXCHPPLG-UHFFFAOYSA-N 2 0 332.513 4.025 20 0 EIADRP [NH3+]CCCCCCCCCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167974222 1026186144 /nfs/dbraw/zinc/18/61/44/1026186144.db2.gz ROLPZWMBMXOBRX-FRIKZZABSA-N 3 0 349.607 4.451 20 0 EIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3cccc4cc[nH]c43)C2)CC1 ZINC000512164659 1026194009 /nfs/dbraw/zinc/19/40/09/1026194009.db2.gz DBUNJRVFSADZPT-SFHVURJKSA-N 2 0 325.500 4.112 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]CC3=CC[N@H+](C)CC3)cs2)cs1 ZINC000344291994 1026220010 /nfs/dbraw/zinc/22/00/10/1026220010.db2.gz NLUHAWMUNJNWLH-LBPRGKRZSA-N 2 0 333.526 4.093 20 0 EIADRP COCCCC[N@@H+]1CC(C)(C)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664836025 1026306251 /nfs/dbraw/zinc/30/62/51/1026306251.db2.gz IJXJNOVMCUGQTR-NRFANRHFSA-N 2 0 344.543 4.036 20 0 EIADRP CC(C)O[C@@H](C[NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccccc1 ZINC000638734637 1026323327 /nfs/dbraw/zinc/32/33/27/1026323327.db2.gz LRWFUSGISWNALD-NRFANRHFSA-N 2 0 330.516 4.149 20 0 EIADRP Fc1cc(F)c2c(c1)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3CC1CC1)CCC2 ZINC001167981777 1026368185 /nfs/dbraw/zinc/36/81/85/1026368185.db2.gz JQDDEAPOSTWEQS-KVSYXXJQSA-N 2 0 346.465 4.337 20 0 EIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000279499972 1026461499 /nfs/dbraw/zinc/46/14/99/1026461499.db2.gz MNBSVWZKAPDWHM-IGGJEDBVSA-N 2 0 330.516 4.005 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2c(C)nn(C(C)(C)C)c2C)CC1 ZINC000506883988 1026487546 /nfs/dbraw/zinc/48/75/46/1026487546.db2.gz IXVLECYSWQCHHO-UHFFFAOYSA-N 2 0 348.579 4.199 20 0 EIADRP C[NH+](C)CC1CC[NH+](Cc2ccccc2OCc2ccccc2)CC1 ZINC000506928439 1026532420 /nfs/dbraw/zinc/53/24/20/1026532420.db2.gz RNUGFEOCMOODQC-UHFFFAOYSA-N 2 0 338.495 4.039 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3cc4ccncc4s3)CC2)CC1 ZINC000657416957 1026577477 /nfs/dbraw/zinc/57/74/77/1026577477.db2.gz YDEYRJRZEOFUCV-UHFFFAOYSA-N 2 0 343.540 4.429 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+]C2CCC([NH3+])CC2)cc1OCCC ZINC000261609887 1026695900 /nfs/dbraw/zinc/69/59/00/1026695900.db2.gz DMQMBEJEVCVDMV-ZLPCBKJTSA-N 2 0 334.504 4.185 20 0 EIADRP Fc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1-c1cccs1 ZINC000391397339 1026752278 /nfs/dbraw/zinc/75/22/78/1026752278.db2.gz NGACIKXWBJKFLW-HZPDHXFCSA-N 2 0 330.472 4.271 20 0 EIADRP CC(C)n1cc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCCCC3)c2)cn1 ZINC000663807715 1026766720 /nfs/dbraw/zinc/76/67/20/1026766720.db2.gz QTOCGXWAEQYVSV-GOSISDBHSA-N 2 0 340.515 4.301 20 0 EIADRP C[C@H](CNc1cc[nH+]c2cc(F)ccc12)[N@@H+]1CCc2sccc2C1 ZINC000500461718 1026773360 /nfs/dbraw/zinc/77/33/60/1026773360.db2.gz XQSOXTHJGRRBGR-CYBMUJFWSA-N 2 0 341.455 4.294 20 0 EIADRP CCN1CCC([NH2+][C@H](C)c2ccc(SC(F)F)c(OC)c2)CC1 ZINC000159316570 1026810189 /nfs/dbraw/zinc/81/01/89/1026810189.db2.gz NRWXODRRGURMJH-GFCCVEGCSA-N 2 0 344.471 4.145 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)cc1OC ZINC000507479678 1026810314 /nfs/dbraw/zinc/81/03/14/1026810314.db2.gz ORTDBGMKBBDOKJ-KRWDZBQOSA-N 2 0 348.531 4.257 20 0 EIADRP CCSCC[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12 ZINC000507531758 1026829266 /nfs/dbraw/zinc/82/92/66/1026829266.db2.gz RKMVCTMSPFKVBF-MTFMMBMASA-N 2 0 332.557 4.018 20 0 EIADRP FC(F)(F)c1ccc(Cl)c(CN[C@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000370988519 1026832794 /nfs/dbraw/zinc/83/27/94/1026832794.db2.gz QZGHZZNQGMKOFO-KBPBESRZSA-N 2 0 332.797 4.075 20 0 EIADRP CC1CC[NH+](Cc2ccc(C[NH2+][C@@H]3CCCc4cccnc43)cc2)CC1 ZINC000684954054 1026889303 /nfs/dbraw/zinc/88/93/03/1026889303.db2.gz OWRILNHQHCONCI-JOCHJYFZSA-N 2 0 349.522 4.481 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2csc(-c3ccccc3F)n2)CC1 ZINC000077482511 1027157894 /nfs/dbraw/zinc/15/78/94/1027157894.db2.gz NHVYEPXWEIQEDF-UHFFFAOYSA-N 2 0 347.503 4.113 20 0 EIADRP Cc1ccc2[nH+]ccc(NC3CC[NH+](Cc4ccccn4)CC3)c2c1 ZINC000302106884 1027219494 /nfs/dbraw/zinc/21/94/94/1027219494.db2.gz ACMBCQIKYSINGM-UHFFFAOYSA-N 2 0 332.451 4.015 20 0 EIADRP Cc1cc2c(cn1)[C@@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C1)CC2 ZINC001168037449 1027254288 /nfs/dbraw/zinc/25/42/88/1027254288.db2.gz YNXQNUNCCVXXKE-OXHIVJRSSA-N 2 0 349.522 4.409 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CCN(C)C2CCCCC2)cc1OC ZINC000474629209 1027336299 /nfs/dbraw/zinc/33/62/99/1027336299.db2.gz CSVUBWNXCXJIII-SJORKVTESA-N 2 0 348.531 4.050 20 0 EIADRP CN1CC[C@@H]([NH2+][C@H]2CCCN(C)c3ccccc32)C[C@@H]1c1ccccc1 ZINC000453348353 1027417728 /nfs/dbraw/zinc/41/77/28/1027417728.db2.gz GCYYCWMHUNINKH-UNWVZKJWSA-N 2 0 349.522 4.383 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1Cl ZINC000112517474 1027581097 /nfs/dbraw/zinc/58/10/97/1027581097.db2.gz YOYCDGRUTBEDHD-CQSZACIVSA-N 2 0 332.875 4.261 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1 ZINC000120976689 1027637796 /nfs/dbraw/zinc/63/77/96/1027637796.db2.gz PWNQXWOBYRYNTI-HNNXBMFYSA-N 2 0 330.447 4.137 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)C1CCSCC1 ZINC000474879488 1027711921 /nfs/dbraw/zinc/71/19/21/1027711921.db2.gz QSEBCSBXVSYDQW-BJLQDIEVSA-N 2 0 346.584 4.408 20 0 EIADRP c1cn(Cc2ccccc2C[NH2+]Cc2csc3ccccc23)cn1 ZINC000078887915 1027713756 /nfs/dbraw/zinc/71/37/56/1027713756.db2.gz MWORTRKIXGRMFM-UHFFFAOYSA-N 2 0 333.460 4.436 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)CC1 ZINC000474885765 1027738413 /nfs/dbraw/zinc/73/84/13/1027738413.db2.gz WETZLQWNPZLEMK-VHDGCEQUSA-N 2 0 326.937 4.358 20 0 EIADRP FC(F)(F)CCC(CCC(F)(F)F)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000657706269 1027761280 /nfs/dbraw/zinc/76/12/80/1027761280.db2.gz KYOPEPAYXVVQLE-OLZOCXBDSA-N 2 0 346.359 4.256 20 0 EIADRP Fc1ccccc1[C@@H]1CCC[N@@H+]1C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995700 1027797848 /nfs/dbraw/zinc/79/78/48/1027797848.db2.gz OKIOBKOBZDXGBS-APZTZJSISA-N 2 0 328.475 4.368 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc(-c4ccsc4)cc3)CC[C@H]21 ZINC001167648116 1027843314 /nfs/dbraw/zinc/84/33/14/1027843314.db2.gz RIYKVYBVUJUIQP-AZUAARDMSA-N 2 0 326.509 4.331 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(C(F)(F)F)cn2)CC1 ZINC000583039830 1027878864 /nfs/dbraw/zinc/87/88/64/1027878864.db2.gz SGTGVJSFRSOOIC-UHFFFAOYSA-N 2 0 343.437 4.044 20 0 EIADRP C[C@H](c1ccccn1)[N@H+](C)CCCCC[NH+](C)[C@@H](C)c1ccccn1 ZINC000091702933 1027899827 /nfs/dbraw/zinc/89/98/27/1027899827.db2.gz ZQYBDWGAHIUQIV-KDURUIRLSA-N 2 0 340.515 4.333 20 0 EIADRP CC[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccc(OC)c(OC)c1 ZINC000324070183 1028096890 /nfs/dbraw/zinc/09/68/90/1028096890.db2.gz XZRNXHPXCYTZHJ-FUHWJXTLSA-N 2 0 334.504 4.009 20 0 EIADRP c1ccc2c(c1)cccc2OCC[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000523452281 1028105724 /nfs/dbraw/zinc/10/57/24/1028105724.db2.gz HOQUMLOSRGCCQA-HXUWFJFHSA-N 2 0 338.495 4.169 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](CCOCc2ccccc2)CC1 ZINC001167658442 1028221274 /nfs/dbraw/zinc/22/12/74/1028221274.db2.gz HHLNWLBGEJYKFL-HXUWFJFHSA-N 2 0 344.543 4.180 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)Cc1csc2ccccc12 ZINC000346138107 1028274392 /nfs/dbraw/zinc/27/43/92/1028274392.db2.gz RPSJEAREZVHKNX-UHFFFAOYSA-N 2 0 348.475 4.422 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](Cc1ccc(C)c(C)c1)C1CC1 ZINC000346204204 1028329363 /nfs/dbraw/zinc/32/93/63/1028329363.db2.gz PKXKWKNMKQAAMC-UHFFFAOYSA-N 2 0 346.478 4.357 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3cc(F)c(OC)cc32)c1 ZINC000281088740 1028371980 /nfs/dbraw/zinc/37/19/80/1028371980.db2.gz AGCFFFBCBCPGFW-HXUWFJFHSA-N 2 0 342.458 4.063 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)C1CCCCCC1 ZINC000346551093 1028512116 /nfs/dbraw/zinc/51/21/16/1028512116.db2.gz GUQFBHBVROZHIH-GOSISDBHSA-N 2 0 344.543 4.092 20 0 EIADRP Cc1cc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)c2ccccc2n1 ZINC000524081076 1028631163 /nfs/dbraw/zinc/63/11/63/1028631163.db2.gz KHAFNZXMOVQFEK-UHFFFAOYSA-N 2 0 325.500 4.095 20 0 EIADRP Cc1ccc(C[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)cc1Cl ZINC000443988669 1028710105 /nfs/dbraw/zinc/71/01/05/1028710105.db2.gz IWOCNHFCQKDOCV-UHFFFAOYSA-N 2 0 346.902 4.269 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2cnc(C(F)(F)F)s2)CC1 ZINC000444004262 1028725886 /nfs/dbraw/zinc/72/58/86/1028725886.db2.gz QJHUGZDLVDFFEU-UHFFFAOYSA-N 2 0 349.466 4.010 20 0 EIADRP CC(C)O[C@H](C[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1 ZINC000428325951 1028883988 /nfs/dbraw/zinc/88/39/88/1028883988.db2.gz OMVAWMLDOVTIHS-RCZSKKKRSA-N 2 0 344.543 4.395 20 0 EIADRP CC(C)C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000647302036 1028991244 /nfs/dbraw/zinc/99/12/44/1028991244.db2.gz PKUBGQGLNVZYJC-IFMALSPDSA-N 2 0 337.511 4.281 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC1 ZINC000650745831 1029074424 /nfs/dbraw/zinc/07/44/24/1029074424.db2.gz OTHMKBWOOOUHCO-SFHVURJKSA-N 2 0 346.421 4.096 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000650746078 1029082617 /nfs/dbraw/zinc/08/26/17/1029082617.db2.gz VNIPSWVIAWBGSE-SFHVURJKSA-N 2 0 332.850 4.287 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]Cc2ccccc2C[NH2+]C)cc1 ZINC000650756035 1029183554 /nfs/dbraw/zinc/18/35/54/1029183554.db2.gz SAMNUBKMCIJHIY-QGZVFWFLSA-N 2 0 326.484 4.436 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@H+](C)C[C@@H]1CCC[NH2+]C1 ZINC000469980252 1029206601 /nfs/dbraw/zinc/20/66/01/1029206601.db2.gz DVHXQSPCKUADKV-JKSUJKDBSA-N 2 0 329.513 4.111 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCSCc2cccc3ccccc32)CC[N@@H+]1C ZINC000151159421 1029217526 /nfs/dbraw/zinc/21/75/26/1029217526.db2.gz QMXJVMOVDKUQIQ-APWZRJJASA-N 2 0 328.525 4.145 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000650758117 1029219417 /nfs/dbraw/zinc/21/94/17/1029219417.db2.gz JOJUZLHPKJEUQB-ZDUSSCGKSA-N 2 0 338.373 4.155 20 0 EIADRP CCc1ncc(C[NH+]2CCC(CC[N@@H+](CC)CC3CC3)CC2)s1 ZINC000536141233 1029254065 /nfs/dbraw/zinc/25/40/65/1029254065.db2.gz PPXXLBPDSCCPSA-UHFFFAOYSA-N 2 0 335.561 4.040 20 0 EIADRP Cc1ccc(-c2ncc(C[NH2+]CC3CC[NH+](C4CC4)CC3)s2)cc1 ZINC000278475783 1029301834 /nfs/dbraw/zinc/30/18/34/1029301834.db2.gz IKGSLVLEZQPTHJ-UHFFFAOYSA-N 2 0 341.524 4.083 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000475191018 1029387264 /nfs/dbraw/zinc/38/72/64/1029387264.db2.gz ICPYSCVDVOEZAI-VBNZEHGJSA-N 2 0 338.948 4.358 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc(-n2ccnc2)cc1 ZINC000158191397 1029388419 /nfs/dbraw/zinc/38/84/19/1029388419.db2.gz KKFYVVSBUCAJKF-IBGZPJMESA-N 2 0 340.515 4.035 20 0 EIADRP COCCC1(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)CCCCC1 ZINC000475269209 1029478037 /nfs/dbraw/zinc/47/80/37/1029478037.db2.gz MSANAWAJAARJPF-NRFANRHFSA-N 2 0 344.543 4.085 20 0 EIADRP C[C@@H](CCc1ccc(F)cc1)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475270422 1029487296 /nfs/dbraw/zinc/48/72/96/1029487296.db2.gz SEXAYVRXHQITJI-RXVVDRJESA-N 2 0 340.486 4.259 20 0 EIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)c1 ZINC000158563995 1029523136 /nfs/dbraw/zinc/52/31/36/1029523136.db2.gz OLGXFWKXISFRPE-KURKYZTESA-N 2 0 345.531 4.054 20 0 EIADRP CCCC[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)c1ccc(F)cc1 ZINC000133028731 1029544014 /nfs/dbraw/zinc/54/40/14/1029544014.db2.gz KGEINMZDFLTEKZ-DYESRHJHSA-N 2 0 348.506 4.148 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CS1 ZINC000655710803 1029571015 /nfs/dbraw/zinc/57/10/15/1029571015.db2.gz FSTUBCMALRSBBL-RNINOARNSA-N 2 0 330.541 4.056 20 0 EIADRP Cc1ccc([C@@H]([NH2+]CCCC[N@@H+]2CCC[C@@H]2CO)C2CCCC2)cc1 ZINC000446820468 1029588714 /nfs/dbraw/zinc/58/87/14/1029588714.db2.gz CWETZLZQBMBPDW-YADHBBJMSA-N 2 0 344.543 4.053 20 0 EIADRP C[C@@H]1CC([N@@H+]2CCC[C@@H](C(F)F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168064285 1029625722 /nfs/dbraw/zinc/62/57/22/1029625722.db2.gz PSUSMUZAAHPBMS-JFIYKMOQSA-N 2 0 336.470 4.405 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(C(F)F)nc1 ZINC000657838548 1029721915 /nfs/dbraw/zinc/72/19/15/1029721915.db2.gz VOJBHEFZJPIAHQ-LSDHHAIUSA-N 2 0 325.447 4.324 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(F)c(Br)c1 ZINC000584365104 1029767167 /nfs/dbraw/zinc/76/71/67/1029767167.db2.gz GPCKLESISZXWSR-XGNXJENSSA-N 2 0 343.284 4.112 20 0 EIADRP Cc1cc(N2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c2cc(F)ccc2[nH+]1 ZINC000301793063 1029809359 /nfs/dbraw/zinc/80/93/59/1029809359.db2.gz RQKBFVPMNMBWAL-MGPUTAFESA-N 2 0 339.458 4.135 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccc(Br)c(Cl)c1 ZINC000657859407 1029845964 /nfs/dbraw/zinc/84/59/64/1029845964.db2.gz TYXZNJUTBXJNEN-LLVKDONJSA-N 2 0 333.701 4.095 20 0 EIADRP C[C@H]([NH2+][C@H]1c2ccccc2C[C@H]1C)c1ccc(OCC[NH+](C)C)cc1 ZINC000089613782 1029850755 /nfs/dbraw/zinc/85/07/55/1029850755.db2.gz CDQUDJXWYJOLAG-HYFFOGBASA-N 2 0 338.495 4.211 20 0 EIADRP C[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc3occc3c2)[C@@H]1c1cccs1 ZINC000375751891 1029865134 /nfs/dbraw/zinc/86/51/34/1029865134.db2.gz YBYZZMBGUXNQDJ-QFBILLFUSA-N 2 0 326.465 4.277 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)c(F)c1)c1cc2ccccc2o1 ZINC000090919859 1029866188 /nfs/dbraw/zinc/86/61/88/1029866188.db2.gz CQEIPNABZOKHRA-AWEZNQCLSA-N 2 0 326.415 4.484 20 0 EIADRP CC(C)C[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)c1ccccc1 ZINC000090522558 1029867113 /nfs/dbraw/zinc/86/71/13/1029867113.db2.gz JFXVAURZBMYVNH-FKBYEOEOSA-N 2 0 344.543 4.131 20 0 EIADRP CC(C)c1nn(-c2ccccc2)cc1C[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000092071305 1029899374 /nfs/dbraw/zinc/89/93/74/1029899374.db2.gz GLXJQNKNNCDEJH-QGZVFWFLSA-N 2 0 349.482 4.098 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1ccc(F)cn1 ZINC000092721144 1029932687 /nfs/dbraw/zinc/93/26/87/1029932687.db2.gz UHKFBXZKFLEUAW-QGZVFWFLSA-N 2 0 341.474 4.303 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1sc(C)nc1C ZINC000170972816 1029968651 /nfs/dbraw/zinc/96/86/51/1029968651.db2.gz HIBFFHSEOOMYOS-AWEZNQCLSA-N 2 0 331.529 4.453 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H]2CCCc3c4cc(C)ccc4[nH]c32)CC1 ZINC000204974971 1030127200 /nfs/dbraw/zinc/12/72/00/1030127200.db2.gz OEEMLHHQHZVGKA-HXUWFJFHSA-N 2 0 325.500 4.318 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(-c2ccncc2)cc1 ZINC000447569703 1030153137 /nfs/dbraw/zinc/15/31/37/1030153137.db2.gz QFKNPBHQNOZMGY-KRWDZBQOSA-N 2 0 335.495 4.274 20 0 EIADRP CCOc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1OCC ZINC000447570764 1030155283 /nfs/dbraw/zinc/15/52/83/1030155283.db2.gz VKGAMLMKQJOJDB-MRXNPFEDSA-N 2 0 346.515 4.009 20 0 EIADRP CC(C)[C@H](CSc1ccccc1)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447571345 1030157648 /nfs/dbraw/zinc/15/76/48/1030157648.db2.gz JWIGFXWMRVKDNW-FQEVSTJZSA-N 2 0 332.557 4.267 20 0 EIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)(C)C(F)F ZINC000657879101 1030164071 /nfs/dbraw/zinc/16/40/71/1030164071.db2.gz JOCHOVNGLQUEEO-MIGBEJBISA-N 2 0 336.470 4.451 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)nc1 ZINC000179112939 1030167747 /nfs/dbraw/zinc/16/77/47/1030167747.db2.gz YMALFSJHDGNNBQ-INIZCTEOSA-N 2 0 343.902 4.298 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(OC(C)(C)C)cc1 ZINC000447565129 1030174499 /nfs/dbraw/zinc/17/44/99/1030174499.db2.gz IWSISBJZQDKZSI-MRXNPFEDSA-N 2 0 330.516 4.389 20 0 EIADRP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447574058 1030180794 /nfs/dbraw/zinc/18/07/94/1030180794.db2.gz UKRWDHOAPZBXNU-AWEZNQCLSA-N 2 0 336.907 4.264 20 0 EIADRP C[C@H](CC(F)(F)F)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447601977 1030218825 /nfs/dbraw/zinc/21/88/25/1030218825.db2.gz RBPKUHFFCRJILV-MXASKKJJSA-N 2 0 326.406 4.113 20 0 EIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2ccc(F)c(F)c2)CC1 ZINC000530329388 1030318789 /nfs/dbraw/zinc/31/87/89/1030318789.db2.gz XQBLYLKXRKAWKH-YWZLYKJASA-N 2 0 336.470 4.140 20 0 EIADRP CCc1ccc(-c2ccc(C[N@@H+]3CC[C@@H](c4nccn4C)C3)o2)cc1 ZINC000685463265 1030344433 /nfs/dbraw/zinc/34/44/33/1030344433.db2.gz NCEAJZXDRDQHBE-GOSISDBHSA-N 2 0 335.451 4.232 20 0 EIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]Cc2ccc(F)nc2)cc1 ZINC000188985473 1030434126 /nfs/dbraw/zinc/43/41/26/1030434126.db2.gz QZKPXAUQNDSCDX-UHFFFAOYSA-N 2 0 349.453 4.239 20 0 EIADRP C[C@H](CCSc1ccccc1)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000431607620 1030474748 /nfs/dbraw/zinc/47/47/48/1030474748.db2.gz IIYDPFJVKASULJ-IEBWSBKVSA-N 2 0 332.557 4.221 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCOc2ccc3ccccc3c2)C[C@@H]1C ZINC000530662942 1030619315 /nfs/dbraw/zinc/61/93/15/1030619315.db2.gz RXDWRDXVDHATOU-FXAWDEMLSA-N 2 0 326.484 4.023 20 0 EIADRP Cc1cn2c(n1)[C@H](C[NH2+]Cc1cnc(C3CCCCC3)s1)CCC2 ZINC000530735741 1030693579 /nfs/dbraw/zinc/69/35/79/1030693579.db2.gz JQONMNRFQIPVDO-INIZCTEOSA-N 2 0 344.528 4.363 20 0 EIADRP Cc1cn2c(n1)[C@@H](C[NH2+]Cc1cnc(C3CCCCC3)s1)CCC2 ZINC000530735742 1030694367 /nfs/dbraw/zinc/69/43/67/1030694367.db2.gz JQONMNRFQIPVDO-MRXNPFEDSA-N 2 0 344.528 4.363 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(C(F)F)nc1 ZINC000657969666 1030705880 /nfs/dbraw/zinc/70/58/80/1030705880.db2.gz SXQAHJCPXGNHDC-DZKIICNBSA-N 2 0 337.458 4.323 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000398133010 1030712493 /nfs/dbraw/zinc/71/24/93/1030712493.db2.gz KDLIBUYHNUNNGB-UTKZUKDTSA-N 2 0 333.479 4.168 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2[nH]ccc2c1 ZINC000398179850 1030728931 /nfs/dbraw/zinc/72/89/31/1030728931.db2.gz WUURNDQBGOEJMI-DYESRHJHSA-N 2 0 333.479 4.168 20 0 EIADRP Cc1cc(C[NH2+][C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cc(C)c1O ZINC000398182641 1030733140 /nfs/dbraw/zinc/73/31/40/1030733140.db2.gz KKMMTTGOQHOVJI-RXVVDRJESA-N 2 0 338.495 4.009 20 0 EIADRP c1cc2ccc(C[NH2+]Cc3ccc(C[NH+]4CCCCC4)cc3)cc2[nH]1 ZINC000527632495 1030787177 /nfs/dbraw/zinc/78/71/77/1030787177.db2.gz OWPKAAJWNMZGCC-UHFFFAOYSA-N 2 0 333.479 4.444 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(Br)c(Cl)c1 ZINC000658047190 1030805256 /nfs/dbraw/zinc/80/52/56/1030805256.db2.gz OVYJPCUFLMMXJW-GMXVVIOVSA-N 2 0 345.712 4.093 20 0 EIADRP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658067898 1030813817 /nfs/dbraw/zinc/81/38/17/1030813817.db2.gz RJMRUUGYJIPIMG-DYESRHJHSA-N 2 0 342.527 4.024 20 0 EIADRP CCC[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccccc1 ZINC000658068516 1030815385 /nfs/dbraw/zinc/81/53/85/1030815385.db2.gz FOYZLAKTLWANHT-NRFANRHFSA-N 2 0 330.516 4.008 20 0 EIADRP Brc1ccc(/C=C/CC[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000527741683 1030838278 /nfs/dbraw/zinc/83/82/78/1030838278.db2.gz AEKFDMYGDLWECB-PESVTJQDSA-N 2 0 349.316 4.069 20 0 EIADRP c1ccc(C([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccccc2)cc1 ZINC000448546100 1030851528 /nfs/dbraw/zinc/85/15/28/1030851528.db2.gz URQBKNFPWRWZRE-UHFFFAOYSA-N 2 0 343.474 4.430 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CCC2 ZINC000658168740 1030866017 /nfs/dbraw/zinc/86/60/17/1030866017.db2.gz YFOPRLCRJFSGNX-QHCPKHFHSA-N 2 0 349.522 4.269 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)s1 ZINC000658168741 1030866595 /nfs/dbraw/zinc/86/65/95/1030866595.db2.gz YGVHGQVWWQPWAS-INIZCTEOSA-N 2 0 329.513 4.014 20 0 EIADRP Cc1nccn1-c1ccc(C[NH2+][C@@H](c2cccc(C)c2)C(C)C)cn1 ZINC000527849624 1030891246 /nfs/dbraw/zinc/89/12/46/1030891246.db2.gz MOJQYVNBJSIQHK-OAQYLSRUSA-N 2 0 334.467 4.371 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCN1C1CCCCC1)c1cnc2ccsc2c1 ZINC000527949017 1030962978 /nfs/dbraw/zinc/96/29/78/1030962978.db2.gz NQICBPAWJMESSN-RHSMWYFYSA-N 2 0 329.513 4.354 20 0 EIADRP C[C@H]([NH2+][C@@H](c1ccccn1)C1CCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000527964479 1031007807 /nfs/dbraw/zinc/00/78/07/1031007807.db2.gz KSCRHKLTRJXPFS-AVCGJXAMSA-N 2 0 349.522 4.423 20 0 EIADRP C[C@H](Cc1coc2ccccc12)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658352634 1031021080 /nfs/dbraw/zinc/02/10/80/1031021080.db2.gz HGGONILKYVXWEM-MRXNPFEDSA-N 2 0 326.484 4.075 20 0 EIADRP c1ccc2c(c1)OC1(CCC1)C[C@H]2[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658355531 1031024843 /nfs/dbraw/zinc/02/48/43/1031024843.db2.gz JKSSHWZUOKIPSN-HXUWFJFHSA-N 2 0 340.511 4.145 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccc(OC(F)F)cc1 ZINC000658354977 1031025651 /nfs/dbraw/zinc/02/56/51/1031025651.db2.gz AEUZWWYPMQKBEK-CQSZACIVSA-N 2 0 338.442 4.061 20 0 EIADRP C[C@H](NC(C)(C)C[NH2+][C@@H]1CCc2cccnc2CC1)c1ccccc1 ZINC000421840421 1031036302 /nfs/dbraw/zinc/03/63/02/1031036302.db2.gz ZBOFTRMWXUKRCM-FXAWDEMLSA-N 2 0 337.511 4.048 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3c[nH]c4ccccc34)CC2)C1 ZINC000532442230 1031069561 /nfs/dbraw/zinc/06/95/61/1031069561.db2.gz MUPBXMMTFOEKQR-XLIONFOSSA-N 2 0 339.527 4.343 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2c[nH]c3ccccc23)CC1 ZINC000532441706 1031070872 /nfs/dbraw/zinc/07/08/72/1031070872.db2.gz CJZVIYWCAXKUPU-VGOFRKELSA-N 2 0 339.527 4.343 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]CCC[NH+]2CCCC2)cc1 ZINC000532454363 1031089405 /nfs/dbraw/zinc/08/94/05/1031089405.db2.gz UBJVEHSEDJIFEM-GOSISDBHSA-N 2 0 338.495 4.499 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)C1CCOCC1 ZINC000532459776 1031106422 /nfs/dbraw/zinc/10/64/22/1031106422.db2.gz IVSHHGSSUUXKFV-PGRDOPGGSA-N 2 0 344.543 4.213 20 0 EIADRP COc1cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)ccc1C ZINC000532469189 1031148484 /nfs/dbraw/zinc/14/84/84/1031148484.db2.gz MPCNBZGDBIKGNO-WIYYLYMNSA-N 2 0 338.495 4.004 20 0 EIADRP Cc1nc(CNCc2ccc(C[NH+]3CCCCC3)cc2)sc1C ZINC000892471115 1031173498 /nfs/dbraw/zinc/17/34/98/1031173498.db2.gz ZPYWNVNVRSQOFN-UHFFFAOYSA-N 2 0 329.513 4.036 20 0 EIADRP CCC[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)C1CCCC1 ZINC000449057035 1031409784 /nfs/dbraw/zinc/40/97/84/1031409784.db2.gz AIZUCXHAQQEEDB-QFIPXVFZSA-N 2 0 344.543 4.092 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2cc3cccnc3o2)C1 ZINC000449081956 1031437732 /nfs/dbraw/zinc/43/77/32/1031437732.db2.gz JEHKNPJIMDAVFH-KRWDZBQOSA-N 2 0 349.478 4.350 20 0 EIADRP c1cc(C[NH+]2CCCCCC2)ccc1C[NH2+][C@H]1CCOC2(CCC2)C1 ZINC000449104535 1031444836 /nfs/dbraw/zinc/44/48/36/1031444836.db2.gz GFDARGBCIIWAIU-NRFANRHFSA-N 2 0 342.527 4.254 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CCc2c[nH]c3ccccc23)CCN1Cc1ccccc1 ZINC000531677776 1031470527 /nfs/dbraw/zinc/47/05/27/1031470527.db2.gz ZTALYEMLJCXDEL-RXVVDRJESA-N 2 0 347.506 4.353 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H](CC2CC2)c2ccccc2)c1 ZINC000531699637 1031483156 /nfs/dbraw/zinc/48/31/56/1031483156.db2.gz PGHIURSQFRFCCC-QFIPXVFZSA-N 2 0 338.495 4.258 20 0 EIADRP CC[C@@H]([NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1)c1ccncc1 ZINC000449165041 1031502737 /nfs/dbraw/zinc/50/27/37/1031502737.db2.gz SPNOMXKDMWCKSH-XMSQKQJNSA-N 2 0 337.511 4.218 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@H]2c2ccccc2C(F)(F)F)C1 ZINC000584479621 1031504504 /nfs/dbraw/zinc/50/45/04/1031504504.db2.gz AVAGVMNGRUWTBC-RMRKRWHISA-N 2 0 326.406 4.201 20 0 EIADRP CC[C@H]([NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1)c1ccncc1 ZINC000449165039 1031504808 /nfs/dbraw/zinc/50/48/08/1031504808.db2.gz SPNOMXKDMWCKSH-GCJKJVERSA-N 2 0 337.511 4.218 20 0 EIADRP C1CCC(OC2CCC([NH2+]C3CC[NH+](C4CCCC4)CC3)CC2)C1 ZINC000449189926 1031509099 /nfs/dbraw/zinc/50/90/99/1031509099.db2.gz VSCAMOFRUVVZIQ-UHFFFAOYSA-N 2 0 334.548 4.253 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3ccnn3C3CCCC3)CC2)CC1 ZINC000449199203 1031542553 /nfs/dbraw/zinc/54/25/53/1031542553.db2.gz FJDVRERNUPZHBF-UHFFFAOYSA-N 2 0 344.547 4.131 20 0 EIADRP COCC1CCC([NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000449216233 1031548793 /nfs/dbraw/zinc/54/87/93/1031548793.db2.gz QQJAFAMENNRVIF-DWOCFRCJSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@H]1C[C@H](CC[NH2+]Cc2cc3cccnc3o2)C[N@@H+]1Cc1ccccc1 ZINC000449217116 1031551568 /nfs/dbraw/zinc/55/15/68/1031551568.db2.gz WZNDHCAMSUOETM-HKUYNNGSSA-N 2 0 349.478 4.218 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@@H]2Cc3cccc(O)c3C2)CC1 ZINC000449282785 1031596999 /nfs/dbraw/zinc/59/69/99/1031596999.db2.gz IVSQZKCJAGPBRZ-GOSISDBHSA-N 2 0 344.543 4.128 20 0 EIADRP COCC1CCC([NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000449338107 1031655957 /nfs/dbraw/zinc/65/59/57/1031655957.db2.gz RNKCRZBIFMILQM-ATKRNPRHSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@H]2CCCC2(F)F)CC1 ZINC000449499638 1031808164 /nfs/dbraw/zinc/80/81/64/1031808164.db2.gz UBLTZIMEGXNGML-SJLPKXTDSA-N 2 0 336.470 4.107 20 0 EIADRP Cc1cccnc1CC[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449505982 1031814852 /nfs/dbraw/zinc/81/48/52/1031814852.db2.gz ZURVQQUKQZWYDJ-UHFFFAOYSA-N 2 0 331.548 4.201 20 0 EIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449559854 1031846898 /nfs/dbraw/zinc/84/68/98/1031846898.db2.gz CXMRKXCMXSQNML-DXJOGWAWSA-N 2 0 340.433 4.241 20 0 EIADRP FC1(F)CCC[C@H]1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000453326564 1031852601 /nfs/dbraw/zinc/85/26/01/1031852601.db2.gz YIXCVSIIRZKKQN-OKYOBFRVSA-N 2 0 334.454 4.207 20 0 EIADRP Cc1ccc(C)c([C@@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c1 ZINC000531960730 1031877922 /nfs/dbraw/zinc/87/79/22/1031877922.db2.gz DAJPMKHGCOYNOC-LJQANCHMSA-N 2 0 340.511 4.485 20 0 EIADRP C[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@H]1C)c1c(Cl)cccc1Cl ZINC000531963658 1031883606 /nfs/dbraw/zinc/88/36/06/1031883606.db2.gz LNNLFEFSMYYNES-BRXULGCHSA-N 2 0 329.315 4.415 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000531970874 1031902968 /nfs/dbraw/zinc/90/29/68/1031902968.db2.gz ZDINZSKSVGJXEE-MELADBBJSA-N 2 0 345.314 4.081 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000531972414 1031910462 /nfs/dbraw/zinc/91/04/62/1031910462.db2.gz RIVLNIKSUXKXEW-UTKZUKDTSA-N 2 0 344.449 4.180 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cc1 ZINC000531972876 1031911523 /nfs/dbraw/zinc/91/15/23/1031911523.db2.gz BEMRBFRKIGSERO-MOPGFXCFSA-N 2 0 332.532 4.433 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(F)cc1Br ZINC000453399782 1031934590 /nfs/dbraw/zinc/93/45/90/1031934590.db2.gz LJTFZCLXEUWCLE-LBPRGKRZSA-N 2 0 343.284 4.113 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453417577 1031950933 /nfs/dbraw/zinc/95/09/33/1031950933.db2.gz XVEGFGIYBKHQFZ-CABCVRRESA-N 2 0 331.529 4.252 20 0 EIADRP C[N@H+](CCCC[NH2+][C@@H](c1cc2ccccc2o1)c1cccnc1)C1CC1 ZINC000453418465 1031951454 /nfs/dbraw/zinc/95/14/54/1031951454.db2.gz YEGAECCSMHKKMO-JOCHJYFZSA-N 2 0 349.478 4.381 20 0 EIADRP FC1(F)CC(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000453416158 1031952197 /nfs/dbraw/zinc/95/21/97/1031952197.db2.gz JYGYILBCTVHSHX-LDLYASANSA-N 2 0 334.454 4.207 20 0 EIADRP CCCc1ncc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)o1 ZINC000453392579 1031958176 /nfs/dbraw/zinc/95/81/76/1031958176.db2.gz QZCUAJAZAPKAIF-UHFFFAOYSA-N 2 0 341.499 4.160 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]CCCC[N@@H+](C)C1CC1 ZINC000453393312 1031961379 /nfs/dbraw/zinc/96/13/79/1031961379.db2.gz FYFHRPJKTLUNNH-FQEVSTJZSA-N 2 0 325.500 4.318 20 0 EIADRP C[C@H]([NH2+]CCc1c(F)cccc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000544424364 1032053521 /nfs/dbraw/zinc/05/35/21/1032053521.db2.gz LGDLBJZRLUBRJV-GJZGRUSLSA-N 2 0 338.898 4.264 20 0 EIADRP CSCCCC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000512633896 1033569636 /nfs/dbraw/zinc/56/96/36/1033569636.db2.gz AWGPDSDOTGQSFS-SLFFLAALSA-N 2 0 332.557 4.020 20 0 EIADRP FC(F)(F)c1ccccc1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC000500887317 1033902630 /nfs/dbraw/zinc/90/26/30/1033902630.db2.gz IFVUPPPWKOGVKU-UHFFFAOYSA-N 2 0 328.422 4.451 20 0 EIADRP Cc1cc(OCC[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)ccc1C(C)C ZINC000513128812 1034604660 /nfs/dbraw/zinc/60/46/60/1034604660.db2.gz SUFTXTGLRFNHLD-DFNIBXOVSA-N 2 0 330.516 4.054 20 0 EIADRP C[N@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+]([C@H]3C[C@H]4C[C@H]4C3)C[C@H]21 ZINC001167934136 1034710193 /nfs/dbraw/zinc/71/01/93/1034710193.db2.gz GVMRSHOMCRAQES-NGDUPAHQSA-N 2 0 330.541 4.079 20 0 EIADRP Cc1ccc(C[N@@H+]2CCCC3(CC[NH+]([C@@H]4C[C@H]5C[C@H]5C4)CC3)C2)cc1 ZINC001167941590 1034809435 /nfs/dbraw/zinc/80/94/35/1034809435.db2.gz QKTNVACZNILHEQ-KOUNCHBCSA-N 2 0 338.539 4.472 20 0 EIADRP c1ccc(C(C[NH2+]C2CC([NH+]3CCCCC3)C2)c2ccccc2)cc1 ZINC000513381585 1034898764 /nfs/dbraw/zinc/89/87/64/1034898764.db2.gz SEEKJZJTRBZMCW-UHFFFAOYSA-N 2 0 334.507 4.425 20 0 EIADRP COc1cccc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000513510914 1035005813 /nfs/dbraw/zinc/00/58/13/1035005813.db2.gz GNHOOBOTGVCYPJ-NQIIRXRSSA-N 2 0 338.495 4.086 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000509927397 1035011488 /nfs/dbraw/zinc/01/14/88/1035011488.db2.gz PEMNIHHGUWXXOG-GCFJHJGGSA-N 2 0 344.543 4.338 20 0 EIADRP C/C(=C/c1ccc(Cl)cc1)C[NH2+]C[C@H]1CCCn2cc(C)nc21 ZINC000513526803 1035020649 /nfs/dbraw/zinc/02/06/49/1035020649.db2.gz QFNJNVYAEMNPIM-OOXMNIKJSA-N 2 0 329.875 4.415 20 0 EIADRP CCc1nc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cs1 ZINC000513546756 1035028766 /nfs/dbraw/zinc/02/87/66/1035028766.db2.gz ZPSJVNKCPWTJRS-WMZOPIPTSA-N 2 0 343.540 4.096 20 0 EIADRP Cc1ccccc1[C@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)C(C)(C)C ZINC000500985354 1035337460 /nfs/dbraw/zinc/33/74/60/1035337460.db2.gz RREMORLBRPOSRM-NRFANRHFSA-N 2 0 345.575 4.088 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CCCc2cccc(C(F)(F)F)c2)[C@@H]2CCC[C@@H]21 ZINC000513712193 1035425714 /nfs/dbraw/zinc/42/57/14/1035425714.db2.gz AJPCAEFOAIROLQ-BZSNNMDCSA-N 2 0 340.433 4.100 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000501380183 1035430225 /nfs/dbraw/zinc/43/02/25/1035430225.db2.gz CUIZLRKKNOWIDT-IPJDOKCGSA-N 2 0 338.417 4.183 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000501384133 1035435870 /nfs/dbraw/zinc/43/58/70/1035435870.db2.gz WRWVEMQVKNAFDD-RCLSDMTESA-N 2 0 329.532 4.065 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]CCC1CC[NH+](C)CC1 ZINC000501420472 1035441657 /nfs/dbraw/zinc/44/16/57/1035441657.db2.gz MKWCBPITWFENJW-SQFISAMPSA-N 2 0 340.433 4.430 20 0 EIADRP C[C@@H]([NH3+])C1CC[NH+](Cc2nc(-c3ccccc3Cl)cs2)CC1 ZINC000420284106 1035497077 /nfs/dbraw/zinc/49/70/77/1035497077.db2.gz CJDZGVIEFPBXKH-GFCCVEGCSA-N 2 0 335.904 4.023 20 0 EIADRP c1cc(CCC[N@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)cs1 ZINC000420301652 1035503429 /nfs/dbraw/zinc/50/34/29/1035503429.db2.gz ARBIWFLXENFELI-SFHVURJKSA-N 2 0 346.565 4.387 20 0 EIADRP CC(C)n1c2ccccc2nc1[C@H]1CCC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000420307236 1035504158 /nfs/dbraw/zinc/50/41/58/1035504158.db2.gz BILYTKVVPVAZCR-FXAWDEMLSA-N 2 0 340.515 4.144 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CCC[C@@H]([C@H]2CC[NH2+]C2)C1 ZINC000420327454 1035531108 /nfs/dbraw/zinc/53/11/08/1035531108.db2.gz LDPLGFBKDPYTHZ-VNQPRFMTSA-N 2 0 326.406 4.088 20 0 EIADRP CSCC1(CC[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000595067415 1035551290 /nfs/dbraw/zinc/55/12/90/1035551290.db2.gz ILNPRTXKAGURLZ-HKUYNNGSSA-N 2 0 332.557 4.020 20 0 EIADRP C[N@H+](Cc1ccc(F)c(-c2cccs2)c1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000470010037 1035555023 /nfs/dbraw/zinc/55/50/23/1035555023.db2.gz VZDZTJIXOWZWMB-XYPWUTKMSA-N 2 0 330.472 4.269 20 0 EIADRP CC[C@H](c1ccc(Cl)cc1)[NH+]1CCC([C@@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000420394530 1035566887 /nfs/dbraw/zinc/56/68/87/1035566887.db2.gz RURRJJRNZRHTMW-OTWHNJEPSA-N 2 0 336.907 4.009 20 0 EIADRP CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000595051393 1035571152 /nfs/dbraw/zinc/57/11/52/1035571152.db2.gz OWCXXNVTKRYHTI-KRWDZBQOSA-N 2 0 340.964 4.078 20 0 EIADRP CCOc1ccc(C[NH+]2CCC(CCC[NH+](C)C)CC2)cc1OCC ZINC000501794444 1035606082 /nfs/dbraw/zinc/60/60/82/1035606082.db2.gz LFGWKXKFPTULHU-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP CCS[C@@H]1CCC[C@H]1[NH2+]C/C=C/C[NH2+][C@H]1CCC[C@H]1SCC ZINC000595484660 1035682673 /nfs/dbraw/zinc/68/26/73/1035682673.db2.gz MSXHEYCDOLYHMV-VLBSHIBISA-N 2 0 342.618 4.070 20 0 EIADRP C[C@H](C[N@@H+]1CCC[C@H]([NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000501951050 1035754480 /nfs/dbraw/zinc/75/44/80/1035754480.db2.gz OBQYKHKYSRXORP-PBHICJAKSA-N 2 0 328.422 4.225 20 0 EIADRP CC(C)[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1F ZINC000668517367 1036050133 /nfs/dbraw/zinc/05/01/33/1036050133.db2.gz YRDFKRJAKBWTFK-FQEVSTJZSA-N 2 0 327.447 4.176 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2)cc1OC ZINC000571682777 1036116249 /nfs/dbraw/zinc/11/62/49/1036116249.db2.gz WKQJLLKKCVYEAL-INIZCTEOSA-N 2 0 342.483 4.184 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000502511881 1036269913 /nfs/dbraw/zinc/26/99/13/1036269913.db2.gz VAAXEDHSRBNMKX-HZPDHXFCSA-N 2 0 340.458 4.103 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421373067 1036322366 /nfs/dbraw/zinc/32/23/66/1036322366.db2.gz MGIZYLUYOURTPO-RWBZWWBESA-N 2 0 342.449 4.489 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2ccc(-c3c(F)cccc3F)o2)CC1 ZINC000421376965 1036329336 /nfs/dbraw/zinc/32/93/36/1036329336.db2.gz SHUBESZOGKXWOD-UHFFFAOYSA-N 2 0 334.410 4.187 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2ccc(Cl)cc2Br)CC1 ZINC000421376006 1036330817 /nfs/dbraw/zinc/33/08/17/1036330817.db2.gz QWTZYQNFFJUOPY-UHFFFAOYSA-N 2 0 345.712 4.065 20 0 EIADRP COCC[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000502696883 1036512520 /nfs/dbraw/zinc/51/25/20/1036512520.db2.gz MFQOATVOKHOPOL-YADHBBJMSA-N 2 0 344.543 4.357 20 0 EIADRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000502697628 1036514911 /nfs/dbraw/zinc/51/49/11/1036514911.db2.gz PHMFSEYJZSACGQ-FCHUYYIVSA-N 2 0 344.543 4.213 20 0 EIADRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000502725584 1036587730 /nfs/dbraw/zinc/58/77/30/1036587730.db2.gz XUVKLZSTDGHCGE-XQBPLPMBSA-N 2 0 344.543 4.213 20 0 EIADRP COC1([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCC1 ZINC000421829856 1036788111 /nfs/dbraw/zinc/78/81/11/1036788111.db2.gz JALFRUNWCQLYIF-LBFURVHYSA-N 2 0 342.527 4.119 20 0 EIADRP CC(C)[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000613258912 1036811170 /nfs/dbraw/zinc/81/11/70/1036811170.db2.gz PIVJHXCCELJWNO-OAQYLSRUSA-N 2 0 344.474 4.253 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2cc3ccc(F)cc3[nH]2)CC1 ZINC000486717794 1036823472 /nfs/dbraw/zinc/82/34/72/1036823472.db2.gz ASRJZKNJRZVZPH-UHFFFAOYSA-N 2 0 331.479 4.155 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2[nH]nc3ccccc32)C1 ZINC000589641075 1036857351 /nfs/dbraw/zinc/85/73/51/1036857351.db2.gz DCXROIPUOQRBNE-KRWDZBQOSA-N 2 0 348.494 4.085 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1[nH]nc2ccccc21 ZINC000589641373 1036857832 /nfs/dbraw/zinc/85/78/32/1036857832.db2.gz JBKFLTDUTOWVOI-QGZVFWFLSA-N 2 0 348.494 4.227 20 0 EIADRP c1ccc2c(c1)n[nH]c2C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000589647164 1036858609 /nfs/dbraw/zinc/85/86/09/1036858609.db2.gz JVPPUQOQLVPGHP-UHFFFAOYSA-N 2 0 348.494 4.229 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CC3CCC(F)(F)CC3)CC2)C1 ZINC000503053483 1036889934 /nfs/dbraw/zinc/88/99/34/1036889934.db2.gz VCACOMPIALAVEO-QAPCUYQASA-N 2 0 328.491 4.445 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CC2CCC(F)(F)CC2)CC1 ZINC000503079226 1036895814 /nfs/dbraw/zinc/89/58/14/1036895814.db2.gz UXCGXKKSNLMOQA-QAPCUYQASA-N 2 0 328.491 4.445 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]C/C=C\c2ccncc2)C1 ZINC000486935524 1036907931 /nfs/dbraw/zinc/90/79/31/1036907931.db2.gz JKOJRLHJEKUGPQ-OCTSTCLRSA-N 2 0 335.495 4.117 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+]C[C@H]2CCSC2)C1 ZINC000486982921 1036935581 /nfs/dbraw/zinc/93/55/81/1036935581.db2.gz VJVFQPOHCWERLG-FGTMMUONSA-N 2 0 332.557 4.007 20 0 EIADRP C(=C\c1ccccc1)\C[NH+]1CCN(c2cc[nH+]c3ccccc32)CC1 ZINC000599435370 1037012772 /nfs/dbraw/zinc/01/27/72/1037012772.db2.gz OOXVVPARYVYMMO-TWGQIWQCSA-N 2 0 329.447 4.070 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]CCc1cc2ccccc2s1 ZINC000572971923 1037088087 /nfs/dbraw/zinc/08/80/87/1037088087.db2.gz TURODSYVNQUEDW-UHFFFAOYSA-N 2 0 348.475 4.123 20 0 EIADRP Cc1oc(-c2ccsc2)nc1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000590786136 1037165325 /nfs/dbraw/zinc/16/53/25/1037165325.db2.gz BKERSVKGMIBVBD-UHFFFAOYSA-N 2 0 347.528 4.264 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)C1 ZINC000467304072 1037230560 /nfs/dbraw/zinc/23/05/60/1037230560.db2.gz BLDHUPDKXFMSMF-RTWAWAEBSA-N 2 0 337.511 4.268 20 0 EIADRP C[C@H]([NH2+]CCCCCC[NH2+][C@@H](C)c1ccccn1)c1ccccn1 ZINC000272805854 1037298652 /nfs/dbraw/zinc/29/86/52/1037298652.db2.gz FSTMHKPPVDQEPB-ROUUACIJSA-N 2 0 326.488 4.038 20 0 EIADRP c1cc(N2CCC(C[NH2+]C3CCC4(CCCC4)CC3)CC2)cc[nH+]1 ZINC000573194785 1037380965 /nfs/dbraw/zinc/38/09/65/1037380965.db2.gz GBLJZRGZILDSSI-UHFFFAOYSA-N 2 0 327.516 4.391 20 0 EIADRP Cc1csc([C@H](C)C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000273470320 1037474331 /nfs/dbraw/zinc/47/43/31/1037474331.db2.gz RXDDCUHYKATPNV-MDZRGWNJSA-N 2 0 343.540 4.055 20 0 EIADRP CC[NH+](CC)CC1CC[NH+]([C@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC000488376853 1037553197 /nfs/dbraw/zinc/55/31/97/1037553197.db2.gz PSDMMJPSXWXXKA-OAHLLOKOSA-N 2 0 340.458 4.403 20 0 EIADRP CC[N@H+](Cc1cnc(CC(C)C)s1)Cc1ccc(C[NH+](C)C)cc1 ZINC000573486927 1037566215 /nfs/dbraw/zinc/56/62/15/1037566215.db2.gz ATERJIAALWFRGP-UHFFFAOYSA-N 2 0 345.556 4.425 20 0 EIADRP COc1c(C)cnc(CN2CCC([N@H+](C)CCCC(C)C)CC2)c1C ZINC000573526518 1037574706 /nfs/dbraw/zinc/57/47/06/1037574706.db2.gz IYMWYSHWRAPOOT-UHFFFAOYSA-N 2 0 347.547 4.039 20 0 EIADRP C[N@H+](CC1CC1)C[C@@H]1CCN(CCc2cc(Cl)ccc2Cl)C1 ZINC000488469421 1037617047 /nfs/dbraw/zinc/61/70/47/1037617047.db2.gz ZJDCQLKPMPRJKZ-HNNXBMFYSA-N 2 0 341.326 4.200 20 0 EIADRP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000513787594 1037714218 /nfs/dbraw/zinc/71/42/18/1037714218.db2.gz BLMGIIJUIBCZBP-GGPKGHCWSA-N 2 0 340.511 4.430 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC(C)(C)c1ccc(Cl)cc1 ZINC000422734213 1037808777 /nfs/dbraw/zinc/80/87/77/1037808777.db2.gz SJCJTKZTEVKKAC-ZDUSSCGKSA-N 2 0 331.891 4.131 20 0 EIADRP CC[C@H](C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1 ZINC000422718437 1037814327 /nfs/dbraw/zinc/81/43/27/1037814327.db2.gz PQZPWPJFTNGKOH-ZNLUXHQJSA-N 2 0 336.479 4.026 20 0 EIADRP c1ccc([C@H]([NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C2CCC2)cc1 ZINC000422720701 1037816571 /nfs/dbraw/zinc/81/65/71/1037816571.db2.gz SYWFMSDALGPUJK-AKIFATBCSA-N 2 0 348.490 4.373 20 0 EIADRP c1ccc2c(c1)cccc2CSCC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000592468522 1037818317 /nfs/dbraw/zinc/81/83/17/1037818317.db2.gz BCCNLYCVSSMECD-MISYRCLQSA-N 2 0 340.536 4.051 20 0 EIADRP C[C@H](C[C@H]1CCCCC[NH2+]1)NC1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000422740253 1037821413 /nfs/dbraw/zinc/82/14/13/1037821413.db2.gz BJZHZMNFODVQQN-WOIUINJBSA-N 2 0 343.559 4.112 20 0 EIADRP Cc1[nH]c2c(cc(C)cc2C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)c1C ZINC000422746699 1037824574 /nfs/dbraw/zinc/82/45/74/1037824574.db2.gz WYOQVTUGDJZLBG-YSIASYRMSA-N 2 0 325.500 4.103 20 0 EIADRP CCC(CC)(CN[C@H](C)c1c[nH+]ccc1N)[NH2+][C@@H](C)c1ccccc1 ZINC000422773357 1037831275 /nfs/dbraw/zinc/83/12/75/1037831275.db2.gz YMRSGMWLXFLHJH-DLBZAZTESA-N 2 0 340.515 4.054 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](c1ccc(F)cc1)C(C)(C)C ZINC000422788102 1037834246 /nfs/dbraw/zinc/83/42/46/1037834246.db2.gz VESUDZWLVGQYRW-AUUYWEPGSA-N 2 0 329.463 4.426 20 0 EIADRP COc1ccc([C@H]([NH2+][C@H](C)CCC[NH3+])c2ccccc2Cl)c(C)c1 ZINC000422797010 1037834293 /nfs/dbraw/zinc/83/42/93/1037834293.db2.gz KWNOHSFJYVDNBS-QRWLVFNGSA-N 2 0 346.902 4.463 20 0 EIADRP c1csc([C@H]([NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C2CC2)c1 ZINC000422796660 1037835645 /nfs/dbraw/zinc/83/56/45/1037835645.db2.gz KCJYFCAMMFELOX-AHRSYUTCSA-N 2 0 340.492 4.045 20 0 EIADRP Cc1ccc([C@@H]2OCCC[C@@H]2C[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000422804651 1037837453 /nfs/dbraw/zinc/83/74/53/1037837453.db2.gz HZLWWIINTYYVGC-YCZSINBZSA-N 2 0 336.479 4.197 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1ccc(-c2cccnc2)cc1 ZINC000422824156 1037841570 /nfs/dbraw/zinc/84/15/70/1037841570.db2.gz NEHBIGDDJWABGV-HZPDHXFCSA-N 2 0 346.478 4.323 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(-c2cccnc2)cc1 ZINC000422824157 1037842292 /nfs/dbraw/zinc/84/22/92/1037842292.db2.gz NEHBIGDDJWABGV-JKSUJKDBSA-N 2 0 346.478 4.323 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CN[C@H]3C[C@H]([NH3+])c4ccccc43)cc2)C1 ZINC000422866968 1037848924 /nfs/dbraw/zinc/84/89/24/1037848924.db2.gz RGZOJHFOMMLFJE-VSDWSMLSSA-N 2 0 349.522 4.153 20 0 EIADRP Fc1cccc2c1SCC[C@@H]2[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000422844723 1037850529 /nfs/dbraw/zinc/85/05/29/1037850529.db2.gz MWFIJMMHMDEMJQ-RNJTYBCJSA-N 2 0 334.504 4.263 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC1(c2ccc(Cl)cc2)CCC1 ZINC000422912839 1037866279 /nfs/dbraw/zinc/86/62/79/1037866279.db2.gz WZVLLQXQOAEWKB-CQSZACIVSA-N 2 0 343.902 4.275 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)ccc1F ZINC000422921445 1037868378 /nfs/dbraw/zinc/86/83/78/1037868378.db2.gz PUVDPGSUIITNAQ-NYSBEXSLSA-N 2 0 340.442 4.041 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C(c1cccs1)c1cccs1 ZINC000422923112 1037871112 /nfs/dbraw/zinc/87/11/12/1037871112.db2.gz REMTWIIPRQCQQR-ZDUSSCGKSA-N 2 0 343.521 4.412 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1ccc(Br)cc1 ZINC000422943513 1037883361 /nfs/dbraw/zinc/88/33/61/1037883361.db2.gz KOJJMGYTDFNCMK-KDOFPFPSSA-N 2 0 347.300 4.256 20 0 EIADRP Clc1cccc(CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)c1Cl ZINC000422948274 1037884442 /nfs/dbraw/zinc/88/44/42/1037884442.db2.gz QZZAVQPQRLXNAH-NUEKZKHPSA-N 2 0 327.299 4.046 20 0 EIADRP c1cc(OC2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000422946884 1037885400 /nfs/dbraw/zinc/88/54/00/1037885400.db2.gz PQJBYDREJBWYIK-PWRODBHTSA-N 2 0 328.500 4.018 20 0 EIADRP CC[C@H](CSc1ccccc1)[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000423007455 1037899439 /nfs/dbraw/zinc/89/94/39/1037899439.db2.gz XSKZFQIKNBYPPR-GOEBONIOSA-N 2 0 329.513 4.070 20 0 EIADRP FC(F)(F)c1ccccc1[C@@H]1CCC[C@@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423023322 1037906114 /nfs/dbraw/zinc/90/61/14/1037906114.db2.gz JMLQYNVXSFFPOS-YSVFJMGKSA-N 2 0 338.417 4.214 20 0 EIADRP C[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423028933 1037909465 /nfs/dbraw/zinc/90/94/65/1037909465.db2.gz UCSFGSNXRYRQOC-JPVDLGIESA-N 2 0 348.490 4.156 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H]1CCCOc2c(Cl)cccc21 ZINC000423035790 1037919017 /nfs/dbraw/zinc/91/90/17/1037919017.db2.gz ZGZJIJROBQNUGC-ACJLOTCBSA-N 2 0 345.874 4.067 20 0 EIADRP Cc1oc2ccccc2c1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423044935 1037922977 /nfs/dbraw/zinc/92/29/77/1037922977.db2.gz CHQWWVLWCQWXAJ-SIKLNZKXSA-N 2 0 348.446 4.087 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000423057837 1037927857 /nfs/dbraw/zinc/92/78/57/1037927857.db2.gz AYOWQYPJSQOIPL-MEDUHNTESA-N 2 0 343.284 4.146 20 0 EIADRP [NH3+]CC1CCC([NH2+]CCc2c[nH]c3cc(Cl)cc(Cl)c23)CC1 ZINC000423080848 1037944748 /nfs/dbraw/zinc/94/47/48/1037944748.db2.gz SXFOVBLDBPPFMG-UHFFFAOYSA-N 2 0 340.298 4.124 20 0 EIADRP Clc1cccc(Cl)c1C1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCC1 ZINC000423081598 1037944997 /nfs/dbraw/zinc/94/49/97/1037944997.db2.gz DEMDZEBJXJKZDW-PBWFPOADSA-N 2 0 339.310 4.288 20 0 EIADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000423087599 1037951323 /nfs/dbraw/zinc/95/13/23/1037951323.db2.gz PYDOCJKNCVBRGD-SKRQURTPSA-N 2 0 326.459 4.010 20 0 EIADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@@H](c2ccccc2F)C1 ZINC000423097631 1037957017 /nfs/dbraw/zinc/95/70/17/1037957017.db2.gz QXHVHTRDELUGMF-VZRKHXGSSA-N 2 0 326.459 4.010 20 0 EIADRP Cc1ccc(C(C)(C)C[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)c(C)c1 ZINC000423131806 1037961783 /nfs/dbraw/zinc/96/17/83/1037961783.db2.gz OLHPKNCVUJKKBK-MRXNPFEDSA-N 2 0 325.500 4.094 20 0 EIADRP Fc1ccc2[nH]cc(CCC[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)c2c1 ZINC000423116362 1037964802 /nfs/dbraw/zinc/96/48/02/1037964802.db2.gz POQGUTCSGFOAIY-YSIASYRMSA-N 2 0 343.490 4.140 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423127849 1037973864 /nfs/dbraw/zinc/97/38/64/1037973864.db2.gz PSHKXABLJGFXBU-XJUOHMSHSA-N 2 0 348.490 4.218 20 0 EIADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]C[C@H](OCC1CC1)c1ccc(Cl)cc1 ZINC000423107709 1037982558 /nfs/dbraw/zinc/98/25/58/1037982558.db2.gz QBBBNQWTQFSEFG-QYZOEREBSA-N 2 0 336.907 4.057 20 0 EIADRP COCC[C@H]([NH2+]C1CCC(C[NH3+])CC1)c1ccc(Cl)c(Cl)c1 ZINC000423113108 1037989265 /nfs/dbraw/zinc/98/92/65/1037989265.db2.gz YLAIBHGDYKUQPA-AJUCZRQESA-N 2 0 345.314 4.178 20 0 EIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CCCC[C@H]3OC(F)F)CC2)C1 ZINC000503919233 1037997300 /nfs/dbraw/zinc/99/73/00/1037997300.db2.gz FUWJOMXSGYWPGO-DZJNRPSUSA-N 2 0 344.490 4.170 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423147601 1038000075 /nfs/dbraw/zinc/00/00/75/1038000075.db2.gz SHNAGIBRPMWFGG-DZKIICNBSA-N 2 0 329.875 4.099 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1F ZINC000423145671 1038000232 /nfs/dbraw/zinc/00/02/32/1038000232.db2.gz LYCFIIBPQGFCAV-QFIXIFRTSA-N 2 0 340.442 4.041 20 0 EIADRP CCCCOc1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)cc1OCC ZINC000503919095 1038000691 /nfs/dbraw/zinc/00/06/91/1038000691.db2.gz FHIJRXDGGYUCPQ-UHFFFAOYSA-N 2 0 348.531 4.086 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+]CC(C)(C)c1ccc(Br)cc1Cl ZINC000423139578 1038013054 /nfs/dbraw/zinc/01/30/54/1038013054.db2.gz VODZIKUCNXZLNM-NSHDSACASA-N 2 0 347.728 4.097 20 0 EIADRP Brc1ccc2c(c1)CCCC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423214432 1038058868 /nfs/dbraw/zinc/05/88/68/1038058868.db2.gz MMSOAJHEAWDAAB-ONYGOOLBSA-N 2 0 349.316 4.089 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000423231090 1038070426 /nfs/dbraw/zinc/07/04/26/1038070426.db2.gz KRZHYXAKEWUKSU-CTWPCTMYSA-N 2 0 332.850 4.428 20 0 EIADRP CC1(C)C[C@@H]([NH2+]C2CCC([NH3+])CC2)c2cc(Br)ccc21 ZINC000423242121 1038076453 /nfs/dbraw/zinc/07/64/53/1038076453.db2.gz YNXSVORBHGCHRR-SEEARECTSA-N 2 0 337.305 4.031 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423257444 1038084573 /nfs/dbraw/zinc/08/45/73/1038084573.db2.gz JKCRYWZIPAHXKD-UKRRQHHQSA-N 2 0 347.503 4.298 20 0 EIADRP CC(C)CCn1cccc1C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000606469123 1038091772 /nfs/dbraw/zinc/09/17/72/1038091772.db2.gz PJWBOABWVORGEN-UHFFFAOYSA-N 2 0 339.527 4.420 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCc3c2cccc3Br)cc1 ZINC000423293479 1038094843 /nfs/dbraw/zinc/09/48/43/1038094843.db2.gz RMIRBKIBTIKEHS-KPZWWZAWSA-N 2 0 345.284 4.246 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCCOc3cc4c(cc32)CCC4)cc1 ZINC000423293337 1038094891 /nfs/dbraw/zinc/09/48/91/1038094891.db2.gz QZURVEFUAMXDHG-BTYIYWSLSA-N 2 0 336.479 4.199 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(Br)cc2)cc1 ZINC000423291674 1038095729 /nfs/dbraw/zinc/09/57/29/1038095729.db2.gz JIVDCMMZFGBHIA-STQMWFEESA-N 2 0 333.273 4.320 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2CCCOc3cc4c(cc32)CCC4)cc1 ZINC000423293339 1038095951 /nfs/dbraw/zinc/09/59/51/1038095951.db2.gz QZURVEFUAMXDHG-VFNWGFHPSA-N 2 0 336.479 4.199 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+][C@H]3CCCC[C@H]3C[NH3+])cs2)cs1 ZINC000423273774 1038099870 /nfs/dbraw/zinc/09/98/70/1038099870.db2.gz JIVDAJPVLUZTRN-WHOFXGATSA-N 2 0 335.542 4.348 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+][C@H]3CCCC[C@@H]3C[NH3+])cs2)cs1 ZINC000423273772 1038101871 /nfs/dbraw/zinc/10/18/71/1038101871.db2.gz JIVDAJPVLUZTRN-LNSITVRQSA-N 2 0 335.542 4.348 20 0 EIADRP C[C@H]([NH2+]C[C@]1(C)CCC[NH2+]C1)c1ccc(SCC(F)F)cc1 ZINC000423319202 1038112407 /nfs/dbraw/zinc/11/24/07/1038112407.db2.gz DDDQROOXXRIYOK-SUMWQHHRSA-N 2 0 328.472 4.084 20 0 EIADRP CSc1cccc([C@@H]([NH2+]CCCC[NH3+])c2cc(F)ccc2F)c1 ZINC000423319481 1038113279 /nfs/dbraw/zinc/11/32/79/1038113279.db2.gz FMAGGHNGGDAWTO-GOSISDBHSA-N 2 0 336.451 4.105 20 0 EIADRP CC(C)[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc2[nH]c(=O)oc2c1 ZINC000423295373 1038119988 /nfs/dbraw/zinc/11/99/88/1038119988.db2.gz WWHARKLOLPUNCD-ORAYPTAESA-N 2 0 339.439 4.040 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC2=CC[NH2+]CC2)CCC3)cc1 ZINC000423346441 1038138447 /nfs/dbraw/zinc/13/84/47/1038138447.db2.gz PGNPVPBCDFGWIX-KRWDZBQOSA-N 2 0 339.508 4.005 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423333007 1038150160 /nfs/dbraw/zinc/15/01/60/1038150160.db2.gz PSEZMBOEQNABFS-HNNXBMFYSA-N 2 0 343.540 4.083 20 0 EIADRP FC(F)(F)c1ccc([C@H]2CCCC[C@H]2[NH2+]CC2=CC[NH2+]CC2)cc1 ZINC000423349637 1038163067 /nfs/dbraw/zinc/16/30/67/1038163067.db2.gz XGPCEGGAXONKMC-QZTJIDSGSA-N 2 0 338.417 4.241 20 0 EIADRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)c1 ZINC000423368426 1038187041 /nfs/dbraw/zinc/18/70/41/1038187041.db2.gz ZUGSKMJOWMXQJM-ZDUSSCGKSA-N 2 0 332.394 4.050 20 0 EIADRP Clc1ccc([C@H]2CC[C@@H]([NH2+]Cc3ccc4c(c3)C[NH2+]C4)C2)cc1 ZINC000423370773 1038191497 /nfs/dbraw/zinc/19/14/97/1038191497.db2.gz FWAFVZJMMTZTNL-OXJNMPFZSA-N 2 0 326.871 4.369 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000489659951 1038196326 /nfs/dbraw/zinc/19/63/26/1038196326.db2.gz QUEGCTGZMHRPRK-UHFFFAOYSA-N 2 0 338.495 4.039 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]Cc2cccc3c2CCCN3)cc1 ZINC000423421614 1038207973 /nfs/dbraw/zinc/20/79/73/1038207973.db2.gz YDSKUUXWQSBTOE-MRXNPFEDSA-N 2 0 346.478 4.390 20 0 EIADRP COCc1cc([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)ccc1OC ZINC000157884050 1038211256 /nfs/dbraw/zinc/21/12/56/1038211256.db2.gz JYKDDURBPKHUOP-ROUUACIJSA-N 2 0 348.531 4.147 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](c1ccc(Br)s1)C1CC1 ZINC000423425092 1038212369 /nfs/dbraw/zinc/21/23/69/1038212369.db2.gz GODIAHARTIIRBH-HZMBPMFUSA-N 2 0 331.323 4.069 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000423446803 1038224836 /nfs/dbraw/zinc/22/48/36/1038224836.db2.gz ZCJNAFYAASLWCP-XJKSGUPXSA-N 2 0 347.503 4.434 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](c1ccc(Br)cc1F)C1CC1 ZINC000423447662 1038228619 /nfs/dbraw/zinc/22/86/19/1038228619.db2.gz ZWKPXWXFQOHHDB-MEDUHNTESA-N 2 0 343.284 4.146 20 0 EIADRP FC(F)(F)c1cccc([C@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)C2CC2)c1 ZINC000423436924 1038235610 /nfs/dbraw/zinc/23/56/10/1038235610.db2.gz MBHVSJOIYUNMPZ-RCCFBDPRSA-N 2 0 338.417 4.134 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423441526 1038237852 /nfs/dbraw/zinc/23/78/52/1038237852.db2.gz PFSDGGWVNMIUQL-UQASEVPWSA-N 2 0 339.527 4.202 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cc(F)cc(F)c1 ZINC000423460853 1038239853 /nfs/dbraw/zinc/23/98/53/1038239853.db2.gz BOISRHFKXJDRCV-JOTOCRJQSA-N 2 0 348.412 4.148 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1cccc(Br)c1 ZINC000423458982 1038239898 /nfs/dbraw/zinc/23/98/98/1038239898.db2.gz QTLSNIILDKDVMH-RDTXWAMCSA-N 2 0 347.300 4.256 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000423462748 1038240011 /nfs/dbraw/zinc/24/00/11/1038240011.db2.gz FAHORMJWIMWGMX-QEJZJMRPSA-N 2 0 347.503 4.426 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H](C)CCC[NH3+])CCC3)cc1 ZINC000423458983 1038240865 /nfs/dbraw/zinc/24/08/65/1038240865.db2.gz QTVWHLBHAIEAKU-GDBMZVCRSA-N 2 0 329.513 4.213 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H](c2ccc(Br)s2)C2CC2)C1 ZINC000423465284 1038242159 /nfs/dbraw/zinc/24/21/59/1038242159.db2.gz HOQGAPGVQPHXBK-HCKVZZMMSA-N 2 0 343.334 4.069 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H](c2ccc(Br)s2)C2CC2)C1 ZINC000423465286 1038243347 /nfs/dbraw/zinc/24/33/47/1038243347.db2.gz HOQGAPGVQPHXBK-JVLSTEMRSA-N 2 0 343.334 4.069 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1csc(-c2ccccc2F)n1 ZINC000423468195 1038244492 /nfs/dbraw/zinc/24/44/92/1038244492.db2.gz JOGMSOGZHRKHGX-MELADBBJSA-N 2 0 333.476 4.117 20 0 EIADRP Cc1cc([C@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)sc1Br ZINC000423478378 1038250129 /nfs/dbraw/zinc/25/01/29/1038250129.db2.gz LDUDOLWHLCPGMG-NWDGAFQWSA-N 2 0 331.323 4.002 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423481771 1038252453 /nfs/dbraw/zinc/25/24/53/1038252453.db2.gz ONPLDJJYVWSHDG-CRAIPNDOSA-N 2 0 343.540 4.225 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)C1 ZINC000423499687 1038255271 /nfs/dbraw/zinc/25/52/71/1038255271.db2.gz ICMMAGCJAGHOHU-ZCPGHIKRSA-N 2 0 326.406 4.059 20 0 EIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1nc2c(s1)CCCC2 ZINC000423504565 1038258457 /nfs/dbraw/zinc/25/84/57/1038258457.db2.gz NNBTXWXLDBTOBA-HOCLYGCPSA-N 2 0 329.513 4.153 20 0 EIADRP CC[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(Br)cc1 ZINC000423484936 1038259647 /nfs/dbraw/zinc/25/96/47/1038259647.db2.gz RJSCFFGKYUPBAJ-HZPDHXFCSA-N 2 0 325.294 4.022 20 0 EIADRP CC[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccccc1Br ZINC000423487794 1038261436 /nfs/dbraw/zinc/26/14/36/1038261436.db2.gz URGOQUVSLKEHSA-BBRMVZONSA-N 2 0 325.294 4.022 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@H]1CC[C@H](C[NH3+])C1 ZINC000423489312 1038262597 /nfs/dbraw/zinc/26/25/97/1038262597.db2.gz FXFZOMLJXFDSNT-QRTARXTBSA-N 2 0 329.513 4.205 20 0 EIADRP CC[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cccc(Br)c1 ZINC000423488767 1038262735 /nfs/dbraw/zinc/26/27/35/1038262735.db2.gz VRIQQEVUVFQXJS-HZPDHXFCSA-N 2 0 325.294 4.022 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000423496254 1038264459 /nfs/dbraw/zinc/26/44/59/1038264459.db2.gz GGWSAGJGXRCVAU-DKSSEZFCSA-N 2 0 346.421 4.094 20 0 EIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1N(C)C ZINC000423513983 1038271566 /nfs/dbraw/zinc/27/15/66/1038271566.db2.gz WCAYHBXRBMDFFY-DNVCBOLYSA-N 2 0 329.463 4.023 20 0 EIADRP [NH3+]CCC[C@H]([NH2+][C@H]1CCc2cc(F)c(F)c(F)c21)c1ccccc1 ZINC000423522248 1038275467 /nfs/dbraw/zinc/27/54/67/1038275467.db2.gz UHTDRJNJVYIIJV-HOTGVXAUSA-N 2 0 334.385 4.161 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423536172 1038286816 /nfs/dbraw/zinc/28/68/16/1038286816.db2.gz GXXXGXNXEKODPP-OAHLLOKOSA-N 2 0 341.524 4.387 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C1(Cc2ccc(Cl)cc2)CCC1 ZINC000574747780 1038323710 /nfs/dbraw/zinc/32/37/10/1038323710.db2.gz GPNBFJYLIVQSCH-OAHLLOKOSA-N 2 0 343.902 4.318 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc(F)cn1 ZINC000490167389 1038367391 /nfs/dbraw/zinc/36/73/91/1038367391.db2.gz IQIKMEXWJJQZEN-SFHVURJKSA-N 2 0 347.503 4.235 20 0 EIADRP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+][C@@H]1CC[C@@H]2CCC[C@H]2C1 ZINC000608064840 1038479782 /nfs/dbraw/zinc/47/97/82/1038479782.db2.gz WPEXXMIUKUWHKG-PCCBWWKXSA-N 2 0 342.527 4.220 20 0 EIADRP C[C@@H](C[NH2+][C@@H](Cc1ccncc1)c1cccs1)C[NH+]1CCCCC1 ZINC000424274427 1038782293 /nfs/dbraw/zinc/78/22/93/1038782293.db2.gz YWRZGXKYYUYJQQ-HKUYNNGSSA-N 2 0 343.540 4.139 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2csc(-c3cccc(Cl)c3)n2)CC1 ZINC001168312209 1038791477 /nfs/dbraw/zinc/79/14/77/1038791477.db2.gz LFQYVSQKZKDUGO-UHFFFAOYSA-N 2 0 349.931 4.426 20 0 EIADRP c1ccc(CC[C@@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000480763298 1038804447 /nfs/dbraw/zinc/80/44/47/1038804447.db2.gz MJCOBARYOHFAJA-NFBKMPQASA-N 2 0 334.507 4.434 20 0 EIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1C[C@H]1Cc1ccccc1 ZINC000539088421 1038830735 /nfs/dbraw/zinc/83/07/35/1038830735.db2.gz SHKGEYDSSOOHOU-TWHAJKEOSA-N 2 0 334.507 4.118 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CCOc2ccccc2-c2ccccc2)[C@@H](C)C1 ZINC000539093783 1038834458 /nfs/dbraw/zinc/83/44/58/1038834458.db2.gz TWODIFIATSLHCX-RXVVDRJESA-N 2 0 338.495 4.052 20 0 EIADRP FC(F)(F)c1cccc([C@@H]([NH2+]CCC[NH+]2CCCC2)C2CC2)c1 ZINC000539162541 1038865276 /nfs/dbraw/zinc/86/52/76/1038865276.db2.gz BPAVSYPJIUOKND-KRWDZBQOSA-N 2 0 326.406 4.232 20 0 EIADRP COc1ccc([C@H]([NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)C2CC2)cc1 ZINC000539215679 1038887076 /nfs/dbraw/zinc/88/70/76/1038887076.db2.gz BZBQSDINQUHZDR-DYESRHJHSA-N 2 0 330.516 4.104 20 0 EIADRP C[C@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1cccs1 ZINC000539298517 1038925012 /nfs/dbraw/zinc/92/50/12/1038925012.db2.gz RBNAOEWERDFUDY-KRWDZBQOSA-N 2 0 344.524 4.116 20 0 EIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]C1Cc2ccccc2C1 ZINC000462112800 1038929029 /nfs/dbraw/zinc/92/90/29/1038929029.db2.gz TYTVONACLXFKJF-UHFFFAOYSA-N 2 0 346.474 4.169 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cccc3c[nH]nc32)CC1 ZINC000537622147 1038984497 /nfs/dbraw/zinc/98/44/97/1038984497.db2.gz PCKDETAKCLGPRW-KRWDZBQOSA-N 2 0 340.515 4.039 20 0 EIADRP COc1cc(Cl)c(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1Cl ZINC000414805539 1038987760 /nfs/dbraw/zinc/98/77/60/1038987760.db2.gz GHQZNWJEPXASKB-NSHDSACASA-N 2 0 339.266 4.312 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCC[C@H]2c2ccc(OC)c(F)c2)C1 ZINC000481039921 1038988396 /nfs/dbraw/zinc/98/83/96/1038988396.db2.gz QINATYYIUFKGPW-IMFGXOCKSA-N 2 0 348.506 4.182 20 0 EIADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000539394938 1039030846 /nfs/dbraw/zinc/03/08/46/1039030846.db2.gz AISZRCPHIFQRIW-NZSAHSFTSA-N 2 0 328.500 4.143 20 0 EIADRP c1ccc(CC(Cc2ccccc2)[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000378931082 1039039941 /nfs/dbraw/zinc/03/99/41/1039039941.db2.gz YIYROVRNYOVJIR-FYYLOGMGSA-N 2 0 334.507 4.057 20 0 EIADRP C[C@H](CCc1ccc(OC(F)F)cc1)[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414808710 1039040428 /nfs/dbraw/zinc/04/04/28/1039040428.db2.gz FSPKSFNGAAMMPY-CABCVRRESA-N 2 0 348.437 4.419 20 0 EIADRP CC[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000552046415 1039066986 /nfs/dbraw/zinc/06/69/86/1039066986.db2.gz HFUSWPSNVLMLAZ-KRWDZBQOSA-N 2 0 344.421 4.358 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)c(C)c1OC ZINC000552062771 1039081472 /nfs/dbraw/zinc/08/14/72/1039081472.db2.gz GJYXPSKPJAIPNQ-QZTJIDSGSA-N 2 0 348.531 4.031 20 0 EIADRP CCCOc1ccc(CN(C)[C@H]2CC[N@H+](CC)[C@@H](C)C2)cc1OCC ZINC000552071106 1039096798 /nfs/dbraw/zinc/09/67/98/1039096798.db2.gz PTRQOOFOOMKJQX-HKUYNNGSSA-N 2 0 348.531 4.179 20 0 EIADRP Cc1cccnc1[C@H](NC1CC[NH+](C2CCCCC2)CC1)C(C)C ZINC000120458352 1039114364 /nfs/dbraw/zinc/11/43/64/1039114364.db2.gz KAHFGFZKGXCMKB-HXUWFJFHSA-N 2 0 329.532 4.474 20 0 EIADRP CCc1ccc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)nc1 ZINC000555381654 1039136392 /nfs/dbraw/zinc/13/63/92/1039136392.db2.gz ZXMHOFFRAQESJA-GOSISDBHSA-N 2 0 329.532 4.121 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(c2cccc(Cl)c2F)CCCC1 ZINC000477861517 1039142689 /nfs/dbraw/zinc/14/26/89/1039142689.db2.gz NOAWQAHFHZGAKD-YOEHRIQHSA-N 2 0 338.898 4.221 20 0 EIADRP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(OC(F)F)cc1 ZINC000120546511 1039152179 /nfs/dbraw/zinc/15/21/79/1039152179.db2.gz WGUSHCRYBAWXHM-GFCCVEGCSA-N 2 0 326.431 4.248 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccc3c(c2)OCO3)cc1 ZINC000120580627 1039179632 /nfs/dbraw/zinc/17/96/32/1039179632.db2.gz SIBHEUWRDCFCLN-INIZCTEOSA-N 2 0 340.467 4.108 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H](C)CCc2ccc(OC(F)F)cc2)CC1 ZINC000120706974 1039208886 /nfs/dbraw/zinc/20/88/86/1039208886.db2.gz AEYHQZSDUGKWMA-OAHLLOKOSA-N 2 0 340.458 4.073 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2COc3ccccc32)cc1 ZINC000090845039 1039309050 /nfs/dbraw/zinc/30/90/50/1039309050.db2.gz NZYHVNFHVORNQK-QYWGDWMGSA-N 2 0 347.462 4.396 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)[C@@H]1COc2ccccc21)c1ccc(-n2ccnc2)cc1 ZINC000090845071 1039309204 /nfs/dbraw/zinc/30/92/04/1039309204.db2.gz KAPKFWBBRXXMSH-GUXCAODWSA-N 2 0 333.435 4.088 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](CC)c2cccc(C)c2)[C@@H](C)C1 ZINC000552244528 1039311334 /nfs/dbraw/zinc/31/13/34/1039311334.db2.gz DEYJCPYKLAQTFD-TYPHKJRUSA-N 2 0 332.532 4.173 20 0 EIADRP Cc1ccccc1CN1CCC([NH2+][C@@H]2CCc3c2cccc3F)CC1 ZINC000513857700 1039335334 /nfs/dbraw/zinc/33/53/34/1039335334.db2.gz OWNPSDNDLKXATE-JOCHJYFZSA-N 2 0 338.470 4.376 20 0 EIADRP C[N@H+](CCC[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1)C1CCCCC1 ZINC000534351247 1039339793 /nfs/dbraw/zinc/33/97/93/1039339793.db2.gz TWLFGMAGANENQH-SIKLNZKXSA-N 2 0 344.543 4.399 20 0 EIADRP C[C@@H](CC(F)(F)F)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000552280653 1039356638 /nfs/dbraw/zinc/35/66/38/1039356638.db2.gz ORKYQNPLWOJHAU-OOHWJJMZSA-N 2 0 328.422 4.360 20 0 EIADRP CCC[N@H+](C)C[C@@H]1CCN(CCOc2cc(Cl)ccc2Cl)C1 ZINC000478042473 1039364695 /nfs/dbraw/zinc/36/46/95/1039364695.db2.gz PRTZFRLMFLXUSB-AWEZNQCLSA-N 2 0 345.314 4.036 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1)c1ccc2n[nH]cc2c1 ZINC000552338650 1039404549 /nfs/dbraw/zinc/40/45/49/1039404549.db2.gz LCBYTTIECYXVNT-JXXFODFXSA-N 2 0 340.515 4.257 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000121892641 1039527380 /nfs/dbraw/zinc/52/73/80/1039527380.db2.gz MIZZYFSLPUJHNR-OXJNMPFZSA-N 2 0 328.500 4.098 20 0 EIADRP C[NH+](C)CCC1CC[NH+](CCc2cccc(Cl)c2Cl)CC1 ZINC000434534330 1039593648 /nfs/dbraw/zinc/59/36/48/1039593648.db2.gz HRQRDKQBFLDEAM-UHFFFAOYSA-N 2 0 329.315 4.200 20 0 EIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccc(Cl)c4cccnc34)C2)CC1 ZINC000555803551 1039656141 /nfs/dbraw/zinc/65/61/41/1039656141.db2.gz YUMNBEQYILGXJT-INIZCTEOSA-N 2 0 343.902 4.052 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(Cl)c(Cl)c1Cl ZINC000643534418 1039716040 /nfs/dbraw/zinc/71/60/40/1039716040.db2.gz UOVYNYDQMACZFR-JOYOIKCWSA-N 2 0 333.690 4.440 20 0 EIADRP c1ccc(C[C@H]([NH2+]C2CC[NH+](CC3CC3)CC2)c2ccccc2)cc1 ZINC001168351259 1039731355 /nfs/dbraw/zinc/73/13/55/1039731355.db2.gz OFIRWDHAYLVRHC-QHCPKHFHSA-N 2 0 334.507 4.434 20 0 EIADRP Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1C ZINC000481727218 1039790898 /nfs/dbraw/zinc/79/08/98/1039790898.db2.gz PJVSVAVHCHLQSH-LJQANCHMSA-N 2 0 340.511 4.403 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(C)c(C)c2)[C@@H](C)C1 ZINC000481734912 1039799618 /nfs/dbraw/zinc/79/96/18/1039799618.db2.gz XPIFMUXVOPGPFB-ZJOUEHCJSA-N 2 0 332.532 4.091 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(C)c(C)c2)[C@H](C)C1 ZINC000481734895 1039799816 /nfs/dbraw/zinc/79/98/16/1039799816.db2.gz XPIFMUXVOPGPFB-DYXWJJEUSA-N 2 0 332.532 4.091 20 0 EIADRP CN1CC[C@@H]([NH2+]CCc2ccc3ccccc3n2)C[C@@H]1c1ccccc1 ZINC000551029282 1039886271 /nfs/dbraw/zinc/88/62/71/1039886271.db2.gz CBIANMYTINVFEZ-FYYLOGMGSA-N 2 0 345.490 4.202 20 0 EIADRP CCCCc1ccc([C@H](C)[NH2+]C2CC[NH+](CCCOC)CC2)cc1 ZINC000481929188 1039900595 /nfs/dbraw/zinc/90/05/95/1039900595.db2.gz CHUHKTVJCIGALX-SFHVURJKSA-N 2 0 332.532 4.181 20 0 EIADRP Cc1cc(C[NH+](C)C)cc(N[C@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000551147672 1040006861 /nfs/dbraw/zinc/00/68/61/1040006861.db2.gz HNIDGWRGKPLORZ-RBBKRZOGSA-N 2 0 337.511 4.304 20 0 EIADRP COc1ccccc1C1(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)CC1 ZINC000482121017 1040035483 /nfs/dbraw/zinc/03/54/83/1040035483.db2.gz MMKWNCFTBQLQKU-UHFFFAOYSA-N 2 0 342.527 4.114 20 0 EIADRP CC(C)=CCC[C@@H](C)CC[NH+]1CCC(C)(C[NH+]2CCN(C)CC2)CC1 ZINC000482251117 1040112157 /nfs/dbraw/zinc/11/21/57/1040112157.db2.gz BJAFQIAWIHJSHC-OAQYLSRUSA-N 2 0 349.607 4.109 20 0 EIADRP C[N@@H+]1CC[C@@]2(CC[NH+](CC(Cc3ccccc3)Cc3ccccc3)C2)C1 ZINC000430135327 1040121347 /nfs/dbraw/zinc/12/13/47/1040121347.db2.gz SWGKBQVAHAFYBJ-XMMPIXPASA-N 2 0 348.534 4.116 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC000479197770 1040191398 /nfs/dbraw/zinc/19/13/98/1040191398.db2.gz VDQLNLQJZQFCKT-IBGZPJMESA-N 2 0 344.886 4.058 20 0 EIADRP COc1ccc2oc([C@@H](C)[NH2+]CCC3CC[NH+](C)CC3)c(C)c2c1 ZINC000482344698 1040192295 /nfs/dbraw/zinc/19/22/95/1040192295.db2.gz KBJLHWBYMQMDKY-OAHLLOKOSA-N 2 0 330.472 4.132 20 0 EIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(C)c(O)c(C)c1 ZINC000514758673 1040210271 /nfs/dbraw/zinc/21/02/71/1040210271.db2.gz PXEKTABDDNCNLE-UHFFFAOYSA-N 2 0 326.484 4.093 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000514812797 1040255851 /nfs/dbraw/zinc/25/58/51/1040255851.db2.gz UEQQHFQKQQGNJF-MJSCBBHESA-N 2 0 340.433 4.430 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@@H](C[NH2+][C@@H](Cc3ccccc3)C3CC3)C2)cc1 ZINC000482452128 1040262760 /nfs/dbraw/zinc/26/27/60/1040262760.db2.gz ABHIMGHYFMWALQ-UPVQGACJSA-N 2 0 348.534 4.162 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2ccccc2Br)CC1 ZINC000482509785 1040308420 /nfs/dbraw/zinc/30/84/20/1040308420.db2.gz KXXTWWWMTBPFPR-CQSZACIVSA-N 2 0 339.321 4.222 20 0 EIADRP CC(C)CCC[C@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccccc1 ZINC000482509705 1040308602 /nfs/dbraw/zinc/30/86/02/1040308602.db2.gz MUDBKJXJNXZADO-UNMCSNQZSA-N 2 0 345.575 4.027 20 0 EIADRP CS[C@@H]1CC[C@H]1[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000425355394 1040326694 /nfs/dbraw/zinc/32/66/94/1040326694.db2.gz ONSDLGZCCGPXPX-QZTJIDSGSA-N 2 0 338.948 4.036 20 0 EIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]CC1CC[NH+](C)CC1 ZINC000482540799 1040328683 /nfs/dbraw/zinc/32/86/83/1040328683.db2.gz VJSNMFMTIIWGFC-LJQANCHMSA-N 2 0 328.525 4.272 20 0 EIADRP COC1CCC(C)(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000479447865 1040377787 /nfs/dbraw/zinc/37/77/87/1040377787.db2.gz DRMJOMMKMZWRPQ-PMJAUZGISA-N 2 0 344.543 4.082 20 0 EIADRP COc1ccc2oc(C[NH2+]CCCCC[NH+]3CCCCC3)cc2c1 ZINC000482606081 1040386351 /nfs/dbraw/zinc/38/63/51/1040386351.db2.gz SEAGWNKMIAKPHM-UHFFFAOYSA-N 2 0 330.472 4.187 20 0 EIADRP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000479466319 1040391520 /nfs/dbraw/zinc/39/15/20/1040391520.db2.gz RNJJXZYXLKYOIR-CDMIOBSGSA-N 2 0 338.470 4.171 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 ZINC000643503581 1040401648 /nfs/dbraw/zinc/40/16/48/1040401648.db2.gz FVQFWACYXLNJLO-QETWGEEDSA-N 2 0 349.453 4.323 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000666995137 1040407711 /nfs/dbraw/zinc/40/77/11/1040407711.db2.gz DSTQNGYEFRWYAE-IBGZPJMESA-N 2 0 336.479 4.127 20 0 EIADRP Clc1ccccc1CSCC[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001168356891 1040410529 /nfs/dbraw/zinc/41/05/29/1040410529.db2.gz YIBIGGJUEIDQLB-UHFFFAOYSA-N 2 0 338.948 4.037 20 0 EIADRP Fc1ccccc1-c1ccc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)s1 ZINC000666998332 1040421099 /nfs/dbraw/zinc/42/10/99/1040421099.db2.gz NYHFJPTXVDVFEO-CQSZACIVSA-N 2 0 330.472 4.319 20 0 EIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H]3CCC[C@H](C4CC4)C3)cc2)CC1 ZINC000551573448 1040424086 /nfs/dbraw/zinc/42/40/86/1040424086.db2.gz RNQMNTMCBUGNSN-VQTJNVASSA-N 2 0 342.527 4.218 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cc2cc(Cl)ccc2o1 ZINC000539494272 1040468712 /nfs/dbraw/zinc/46/87/12/1040468712.db2.gz CQNZUUJZBKPNPX-CZUORRHYSA-N 2 0 338.879 4.094 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000482900166 1040564153 /nfs/dbraw/zinc/56/41/53/1040564153.db2.gz ZSZUDPRLLPYMHH-PXNSSMCTSA-N 2 0 338.495 4.008 20 0 EIADRP C[N@@H+](Cc1cnc(-c2ccc(Cl)cc2)s1)CC1CC[NH+](C)CC1 ZINC000551804784 1040598999 /nfs/dbraw/zinc/59/89/99/1040598999.db2.gz HMEKZEYGEVNLGT-UHFFFAOYSA-N 2 0 349.931 4.237 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@H]32)cc1 ZINC000668172371 1040605666 /nfs/dbraw/zinc/60/56/66/1040605666.db2.gz MCQRXBFJLKWDCD-RTBURBONSA-N 2 0 341.524 4.035 20 0 EIADRP C[C@H](c1cccc2ccccc21)[NH+]1CCC([C@@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000515342937 1040679377 /nfs/dbraw/zinc/67/93/77/1040679377.db2.gz MWOKYXVAGWWNTI-PERKRYKHSA-N 2 0 338.495 4.119 20 0 EIADRP C[C@H]([NH2+][C@H]1CSc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000483157369 1040742650 /nfs/dbraw/zinc/74/26/50/1040742650.db2.gz RNYDWRSXSDZQCV-KXBFYZLASA-N 2 0 342.508 4.125 20 0 EIADRP C[C@H]([NH2+][C@H]1CSc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000483177811 1040745871 /nfs/dbraw/zinc/74/58/71/1040745871.db2.gz QDATVOINPSXIJF-KXBFYZLASA-N 2 0 342.508 4.125 20 0 EIADRP C[C@@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1cccc(OC(F)F)c1 ZINC000483201212 1040761352 /nfs/dbraw/zinc/76/13/52/1040761352.db2.gz PKQSOPNNXDTTFM-CJNGLKHVSA-N 2 0 328.447 4.305 20 0 EIADRP CC(C)(C[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cccc(F)c1 ZINC000483184616 1040763496 /nfs/dbraw/zinc/76/34/96/1040763496.db2.gz LVHFWBCEGMIIJL-UHFFFAOYSA-N 2 0 332.507 4.490 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(F)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000539816873 1040809894 /nfs/dbraw/zinc/80/98/94/1040809894.db2.gz BKSUWNBVUFUJND-MLGOLLRUSA-N 2 0 332.385 4.007 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1cc(F)ccc1F ZINC000537843344 1040848004 /nfs/dbraw/zinc/84/80/04/1040848004.db2.gz PWQQLAGZIBUBKH-UHFFFAOYSA-N 2 0 345.437 4.098 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccncc2Cl)CC1)CC1CC1 ZINC000537847756 1040851304 /nfs/dbraw/zinc/85/13/04/1040851304.db2.gz TZHKNNWPZXEKDJ-UHFFFAOYSA-N 2 0 335.923 4.069 20 0 EIADRP CCC[C@H]([NH2+][C@@H]1CC[N@H+](CCCOCC)C[C@H]1C)c1ccccc1 ZINC000480034155 1040870007 /nfs/dbraw/zinc/87/00/07/1040870007.db2.gz JJSHPFSSAUJFHH-NRSPTQNISA-N 2 0 332.532 4.254 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](CCCSc3ccccc3Cl)CC[C@@H]21 ZINC000483504620 1040877213 /nfs/dbraw/zinc/87/72/13/1040877213.db2.gz RVVJURMMKKTPKA-WBVHZDCISA-N 2 0 338.948 4.238 20 0 EIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1Cl ZINC000537935035 1040899249 /nfs/dbraw/zinc/89/92/49/1040899249.db2.gz QZIMZHMRIPCGNO-CQSZACIVSA-N 2 0 347.865 4.441 20 0 EIADRP CC[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)C1CCOCC1 ZINC000537940134 1040905519 /nfs/dbraw/zinc/90/55/19/1040905519.db2.gz VNUXUOXSFYICHU-UZKOGDIHSA-N 2 0 344.543 4.082 20 0 EIADRP Cc1ccc(O[C@@H](C)C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000483619035 1040915412 /nfs/dbraw/zinc/91/54/12/1040915412.db2.gz FVGXYQXQAKOHLC-SFHVURJKSA-N 2 0 330.516 4.149 20 0 EIADRP Cc1ccc(CC[C@@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)o1 ZINC000483660547 1040939177 /nfs/dbraw/zinc/93/91/77/1040939177.db2.gz MDEVBPUJCLPZNV-SJLPKXTDSA-N 2 0 344.499 4.200 20 0 EIADRP C[C@H](CC[NH2+][C@@H](C)c1ccc2c(c1)COC2)[N@H+](C)Cc1ccccc1 ZINC000483672074 1040959878 /nfs/dbraw/zinc/95/98/78/1040959878.db2.gz PPUYZLPVPHLNLJ-MSOLQXFVSA-N 2 0 338.495 4.278 20 0 EIADRP Fc1cccc(Cl)c1[C@@H]1C[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC1 ZINC000903186879 1040960026 /nfs/dbraw/zinc/96/00/26/1040960026.db2.gz WBIJDFWOASCYRY-IYHLECPCSA-N 2 0 334.866 4.082 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2ccc(Br)s2)CC1 ZINC000483724075 1040972111 /nfs/dbraw/zinc/97/21/11/1040972111.db2.gz GDCKBFITLUVDGM-LBPRGKRZSA-N 2 0 345.350 4.283 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@H]2[NH2+]C2CC[NH+](C(C)C)CC2)cc1F ZINC000537972459 1040975292 /nfs/dbraw/zinc/97/52/92/1040975292.db2.gz LIWVJHFMFGQGDU-AZUAARDMSA-N 2 0 348.506 4.323 20 0 EIADRP C[C@@H]([NH2+][C@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)c1ccccn1 ZINC000898523033 1040977989 /nfs/dbraw/zinc/97/79/89/1040977989.db2.gz XLSSUQWYBOFJTM-PBASOCQRSA-N 2 0 335.495 4.033 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)Cc1cccs1 ZINC000483741953 1040993080 /nfs/dbraw/zinc/99/30/80/1040993080.db2.gz INCJWKKDWFFFIJ-IRXDYDNUSA-N 2 0 346.540 4.218 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1(c2ccccc2)CC1 ZINC000480208928 1041082512 /nfs/dbraw/zinc/08/25/12/1041082512.db2.gz LDRZBTVZHNGRJS-KNQAVFIVSA-N 2 0 334.507 4.218 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCc2ccc(Oc3ccc(F)cc3)cc2)CC[N@@H+]1C ZINC000540140577 1041159508 /nfs/dbraw/zinc/15/95/08/1041159508.db2.gz PCYQAEVBTZYWLR-APWZRJJASA-N 2 0 342.458 4.233 20 0 EIADRP Cc1ccc(SC2(C[NH2+][C@@H]3CC[N@H+](C)[C@@H](C)C3)CCCC2)cc1 ZINC000484287870 1041197121 /nfs/dbraw/zinc/19/71/21/1041197121.db2.gz CYHWAVGHHIMLBB-ZWKOTPCHSA-N 2 0 332.557 4.472 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3c2cccc3F)c1 ZINC000540172617 1041216210 /nfs/dbraw/zinc/21/62/10/1041216210.db2.gz PNJHRZVJFBXPCX-NRFANRHFSA-N 2 0 326.459 4.443 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@H](c2ccccc2)C(C)C)[C@@H](C)C1 ZINC000480331501 1041217148 /nfs/dbraw/zinc/21/71/48/1041217148.db2.gz HBIHUOZWCJGSGI-BVSLBCMMSA-N 2 0 346.559 4.153 20 0 EIADRP CC(C)CC[C@H](C)[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538268485 1041227102 /nfs/dbraw/zinc/22/71/02/1041227102.db2.gz IPWGAYMBBALKIE-PKOBYXMFSA-N 2 0 330.516 4.389 20 0 EIADRP CSc1ccccc1[C@@H](C)[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000194855141 1041232589 /nfs/dbraw/zinc/23/25/89/1041232589.db2.gz UAJKGUMQIHSXSM-MRXNPFEDSA-N 2 0 344.524 4.200 20 0 EIADRP Cc1cc2c(cc1C)[C@H](NC1CC[NH+](C(C)(C)C)CC1)CCCO2 ZINC000540189417 1041235240 /nfs/dbraw/zinc/23/52/40/1041235240.db2.gz CFYCMVYDIUZFBM-LJQANCHMSA-N 2 0 330.516 4.370 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3scnc3C)cc2)[C@@H](C)C1 ZINC000667666260 1041238569 /nfs/dbraw/zinc/23/85/69/1041238569.db2.gz HJKDVEFSROVGCN-HNAYVOBHSA-N 2 0 343.540 4.281 20 0 EIADRP COc1ccccc1[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)C1CCCC1 ZINC000540262649 1041327657 /nfs/dbraw/zinc/32/76/57/1041327657.db2.gz DXQNLZNTRCMWPY-JOCHJYFZSA-N 2 0 342.527 4.391 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]C2CCN(CCc3ccc(F)cc3)CC2)cc1 ZINC000463084700 1041333211 /nfs/dbraw/zinc/33/32/11/1041333211.db2.gz JWXQZLBUXGSBBT-SFHVURJKSA-N 2 0 340.486 4.492 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1nc2ccc(Cl)cc2n1C ZINC000516030780 1041358191 /nfs/dbraw/zinc/35/81/91/1041358191.db2.gz XGGKXXPQULQUQO-HNNXBMFYSA-N 2 0 348.922 4.143 20 0 EIADRP CC(C)(C[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)C(F)(F)F ZINC000554722031 1041364853 /nfs/dbraw/zinc/36/48/53/1041364853.db2.gz DJVVFMKVCLMZRO-GVDBMIGSSA-N 2 0 340.433 4.075 20 0 EIADRP C[C@@H](Nc1ccc(N2CC[C@@H]([NH+](C)C)C2)cn1)c1ccc(Cl)cc1 ZINC000538557763 1041420863 /nfs/dbraw/zinc/42/08/63/1041420863.db2.gz LWMGAINMYIUUOW-RDTXWAMCSA-N 2 0 344.890 4.048 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cccc(OC(F)F)c1 ZINC000480622504 1041437683 /nfs/dbraw/zinc/43/76/83/1041437683.db2.gz YNWFIJDBFSTDKB-JKSUJKDBSA-N 2 0 340.458 4.451 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2ccc(OCC3CC3)cc2)CC1 ZINC000480635876 1041446944 /nfs/dbraw/zinc/44/69/44/1041446944.db2.gz LWOQZOXHWMJQEE-UHFFFAOYSA-N 2 0 330.516 4.077 20 0 EIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3cnc(-c4ccsc4)s3)C2)CC1 ZINC000554879293 1041476512 /nfs/dbraw/zinc/47/65/12/1041476512.db2.gz QAXRWIXRIZJOJK-OAHLLOKOSA-N 2 0 347.553 4.035 20 0 EIADRP COc1cc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1F ZINC000195133246 1041485313 /nfs/dbraw/zinc/48/53/13/1041485313.db2.gz KOGIPFUHFQOKQY-SJLPKXTDSA-N 2 0 342.458 4.007 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)c(F)c1 ZINC000195135365 1041487200 /nfs/dbraw/zinc/48/72/00/1041487200.db2.gz VLLZXWUJLQVAST-NVXWUHKLSA-N 2 0 330.422 4.138 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1oc2ccccc2c1CC ZINC000540595267 1041550469 /nfs/dbraw/zinc/55/04/69/1041550469.db2.gz SAUOLNWKDYNQBO-HZPDHXFCSA-N 2 0 332.488 4.003 20 0 EIADRP c1ccc(CC[C@H](Cc2ccccc2)[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000461799870 1041592318 /nfs/dbraw/zinc/59/23/18/1041592318.db2.gz XEAKXVZMZKISIX-SGNDLWITSA-N 2 0 348.534 4.447 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+]CC(Cc2ccccc2)Cc2ccccc2)C1 ZINC000517001603 1041838952 /nfs/dbraw/zinc/83/89/52/1041838952.db2.gz LBFGLZJWBZSMSM-JOCHJYFZSA-N 2 0 336.523 4.019 20 0 EIADRP C[C@@]1(c2ccccc2)CC[C@@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000437779837 1041897984 /nfs/dbraw/zinc/89/79/84/1041897984.db2.gz CKZDCUHKZCIBPI-FYYLOGMGSA-N 2 0 349.522 4.398 20 0 EIADRP Cn1ccnc1C[C@@H]1CCC[N@@H+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000437791851 1041913734 /nfs/dbraw/zinc/91/37/34/1041913734.db2.gz HTYPVOCBVOQNKU-CZTZKLFOSA-N 2 0 337.511 4.185 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CCC[N@H+](C)Cc2ccccc2)ccc1F ZINC000301718697 1041982426 /nfs/dbraw/zinc/98/24/26/1041982426.db2.gz PUUCTDFKDFLOJC-MRXNPFEDSA-N 2 0 330.447 4.007 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CCC[C@H]2[NH2+][C@H]2CCC[NH2+]CC2)cc1 ZINC000414918935 1041985227 /nfs/dbraw/zinc/98/52/27/1041985227.db2.gz TUEMGTYRBOOZPH-YESZJQIVSA-N 2 0 326.406 4.073 20 0 EIADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+]([C@@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000438094685 1042042720 /nfs/dbraw/zinc/04/27/20/1042042720.db2.gz OBVLVGAIPKHDMW-KSEOMHKRSA-N 2 0 326.528 4.161 20 0 EIADRP CC(C)(C)CC[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000438190714 1042083447 /nfs/dbraw/zinc/08/34/47/1042083447.db2.gz NEUSHBCIHZFJRC-UHFFFAOYSA-N 2 0 332.532 4.084 20 0 EIADRP CC[NH+](CC)C[C@H]1CC[N@H+](CCCSc2ccccc2Cl)C1 ZINC000464774793 1042157462 /nfs/dbraw/zinc/15/74/62/1042157462.db2.gz IVXWGEAQVWFTLR-MRXNPFEDSA-N 2 0 340.964 4.486 20 0 EIADRP C[C@H](c1ccc(F)cc1)[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464832149 1042189660 /nfs/dbraw/zinc/18/96/60/1042189660.db2.gz BVJFWQIOWBYLJM-IEBWSBKVSA-N 2 0 326.459 4.341 20 0 EIADRP C[C@@H]1CCCC[C@H]1OCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464847132 1042195077 /nfs/dbraw/zinc/19/50/77/1042195077.db2.gz UTUIURPIHCXRCE-BAGYTPMASA-N 2 0 344.543 4.036 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000414933633 1042218068 /nfs/dbraw/zinc/21/80/68/1042218068.db2.gz XBKXOFQCQSQPPW-YYIAUSFCSA-N 2 0 326.406 4.201 20 0 EIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]Cc3cccc4cc[nH]c43)CC2)C1 ZINC000467373544 1042298466 /nfs/dbraw/zinc/29/84/66/1042298466.db2.gz NKAYFJFVANAOGS-OXJNMPFZSA-N 2 0 325.500 4.301 20 0 EIADRP CC(C)[NH+]1CCC(N(C)Cc2ccc(F)c(C(F)(F)F)c2)CC1 ZINC000506343314 1042330234 /nfs/dbraw/zinc/33/02/34/1042330234.db2.gz RNTMXIIWYUGIAE-UHFFFAOYSA-N 2 0 332.385 4.149 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCc2ccccc2F)CC1 ZINC000438835224 1042375574 /nfs/dbraw/zinc/37/55/74/1042375574.db2.gz VZFUMCGWCFZXIZ-UHFFFAOYSA-N 2 0 340.486 4.401 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCCOc2ccc(F)cc2)C1 ZINC000303603349 1042483846 /nfs/dbraw/zinc/48/38/46/1042483846.db2.gz NYEWPCQBRHPXPM-OALUTQOASA-N 2 0 348.506 4.181 20 0 EIADRP Brc1ccc([C@H]([NH2+]CCC[NH+]2CCCC2)C2CC2)s1 ZINC000439148344 1042520497 /nfs/dbraw/zinc/52/04/97/1042520497.db2.gz XMMHTOBXEOADRN-OAHLLOKOSA-N 2 0 343.334 4.037 20 0 EIADRP [NH3+]C1C[C@H]2CC[C@@H](C1)C2[NH2+]Cc1c(OC(F)F)ccc2ccccc21 ZINC000414985194 1042535105 /nfs/dbraw/zinc/53/51/05/1042535105.db2.gz FROVBHJZYMJMIO-WWMCIYDGSA-N 2 0 346.421 4.047 20 0 EIADRP CCCc1csc(C[NH+]2CCC(CCC[NH+](CC)CC)CC2)n1 ZINC000426371240 1042605556 /nfs/dbraw/zinc/60/55/56/1042605556.db2.gz MLPJBPYJSACSFR-UHFFFAOYSA-N 2 0 337.577 4.430 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)C1 ZINC000518793740 1042695941 /nfs/dbraw/zinc/69/59/41/1042695941.db2.gz ARLAMMNGYNLRBK-INIZCTEOSA-N 2 0 346.421 4.189 20 0 EIADRP c1ccc(CCC[N@@H+]2CCCN(c3cc[nH+]c4ccccc43)CC2)cc1 ZINC000518899044 1042749884 /nfs/dbraw/zinc/74/98/84/1042749884.db2.gz PFHPRHCLVDNIMW-UHFFFAOYSA-N 2 0 345.490 4.380 20 0 EIADRP CCc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000309707879 1042819290 /nfs/dbraw/zinc/81/92/90/1042819290.db2.gz IMPNKUCFLQEITC-SJLPKXTDSA-N 2 0 328.525 4.311 20 0 EIADRP CCc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000309710698 1042819411 /nfs/dbraw/zinc/81/94/11/1042819411.db2.gz JESXOHUZMZRMCF-FUHWJXTLSA-N 2 0 328.525 4.483 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC001168447786 1042825064 /nfs/dbraw/zinc/82/50/64/1042825064.db2.gz HLOFBQOYZSEPHZ-QGZVFWFLSA-N 2 0 326.459 4.142 20 0 EIADRP C[C@@H]([NH2+]CCSc1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310170868 1042830032 /nfs/dbraw/zinc/83/00/32/1042830032.db2.gz UAUPBAFOHWMDDW-UYAOXDASSA-N 2 0 340.536 4.279 20 0 EIADRP Cc1cc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1F ZINC000310522231 1042839200 /nfs/dbraw/zinc/83/92/00/1042839200.db2.gz NVJWGIYVOVMALP-XLIONFOSSA-N 2 0 326.459 4.134 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1OC ZINC000310985596 1042849610 /nfs/dbraw/zinc/84/96/10/1042849610.db2.gz GTHDBFODEHWHDM-PZJWPPBQSA-N 2 0 338.495 4.258 20 0 EIADRP CC(C)Oc1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000310991161 1042849974 /nfs/dbraw/zinc/84/99/74/1042849974.db2.gz HTDJSTJXTMEJGQ-OAQYLSRUSA-N 2 0 338.495 4.086 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000310998842 1042850079 /nfs/dbraw/zinc/85/00/79/1042850079.db2.gz UVEIKUHUHJNACO-UEXGIBASSA-N 2 0 338.495 4.256 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc2c(c1)CCCO2 ZINC000152727150 1042955010 /nfs/dbraw/zinc/95/50/10/1042955010.db2.gz YDUZRFWOAHWUCM-NRFANRHFSA-N 2 0 338.495 4.314 20 0 EIADRP COC[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(Cl)cc1 ZINC000493884679 1042971272 /nfs/dbraw/zinc/97/12/72/1042971272.db2.gz ZNNQGCITJNPICD-APWZRJJASA-N 2 0 338.923 4.272 20 0 EIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000493890810 1042972112 /nfs/dbraw/zinc/97/21/12/1042972112.db2.gz HMTGJMDJNPFGOK-GCJKJVERSA-N 2 0 340.511 4.393 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCc2cccc(F)c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168007477 1043015023 /nfs/dbraw/zinc/01/50/23/1043015023.db2.gz SHPMFKFOBGFGKX-OPMZPASUSA-N 2 0 340.486 4.399 20 0 EIADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(OC)cc1 ZINC000183192887 1043039120 /nfs/dbraw/zinc/03/91/20/1043039120.db2.gz KIMIAYUJTQNZJD-BLIXFSHQSA-N 2 0 330.516 4.389 20 0 EIADRP C[C@H](NC1CC[NH+](C2CCCCC2)CC1)[C@H](c1ccccc1)[NH+](C)C ZINC000186320968 1043268526 /nfs/dbraw/zinc/26/85/26/1043268526.db2.gz HEWLSXITCBHJEJ-PGRDOPGGSA-N 2 0 343.559 4.065 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCCCc3cc(Br)ccc32)CC1 ZINC000338785107 1043272881 /nfs/dbraw/zinc/27/28/81/1043272881.db2.gz ADYSTIJFJYSLNK-SFHVURJKSA-N 2 0 349.316 4.068 20 0 EIADRP CCCC[N@H+](C)CCCN[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168012145 1043416253 /nfs/dbraw/zinc/41/62/53/1043416253.db2.gz WWWWPYMMZRNMTK-VTYHHJSWSA-N 2 0 345.575 4.140 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3F)s2)C1 ZINC000520943395 1043444667 /nfs/dbraw/zinc/44/46/67/1043444667.db2.gz AIFQFQQUGVCRPX-HNNXBMFYSA-N 2 0 332.488 4.376 20 0 EIADRP Cc1nc2ccc(C[NH2+]CCCC[N@H+]3CCCC[C@H]3C)cc2s1 ZINC000494385263 1043459541 /nfs/dbraw/zinc/45/95/41/1043459541.db2.gz LYODQEKDDHWVOT-OAHLLOKOSA-N 2 0 331.529 4.349 20 0 EIADRP CN(c1ccccc1C[N@H+](C)C[C@@H]1CC=CCC1)C1CC[NH+](C)CC1 ZINC000542483084 1043478107 /nfs/dbraw/zinc/47/81/07/1043478107.db2.gz VFDJGZRXLWJLNQ-LJQANCHMSA-N 2 0 341.543 4.005 20 0 EIADRP Cc1ccc(COc2ccc(C[NH2+][C@H](C)CC[NH+](C)C)cc2)cc1 ZINC000065981542 1043519953 /nfs/dbraw/zinc/51/99/53/1043519953.db2.gz YARMDEPWDCZDQO-GOSISDBHSA-N 2 0 326.484 4.004 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000665281024 1043648733 /nfs/dbraw/zinc/64/87/33/1043648733.db2.gz RYJFFJKEHMBISE-MLGOLLRUSA-N 2 0 335.492 4.282 20 0 EIADRP CC[C@@H]1C[N@H+](CCCCn2ccnc2C)CC[C@H]1c1ccccc1 ZINC000442394528 1043669657 /nfs/dbraw/zinc/66/96/57/1043669657.db2.gz SHOSLCGPXOTZGE-TZIWHRDSSA-N 2 0 325.500 4.487 20 0 EIADRP CCC1(C[NH2+][C@@H]2CCCSC2)CC[NH+](Cc2ccccc2)CC1 ZINC000543074017 1043739362 /nfs/dbraw/zinc/73/93/62/1043739362.db2.gz IKZOLRHLZZVQRP-LJQANCHMSA-N 2 0 332.557 4.164 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc(OCC3CC3)cc2)c1 ZINC000190955688 1043755410 /nfs/dbraw/zinc/75/54/10/1043755410.db2.gz ZDHVKRNQXHGNIY-UHFFFAOYSA-N 2 0 338.495 4.217 20 0 EIADRP COCCCCC[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000521477540 1043784433 /nfs/dbraw/zinc/78/44/33/1043784433.db2.gz RLFSCTLNDBHCCU-FDFHNCONSA-N 2 0 344.543 4.084 20 0 EIADRP Cc1c([C@@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)cnn1C(C)C ZINC000191331663 1043808799 /nfs/dbraw/zinc/80/87/99/1043808799.db2.gz KXHWXFWMDVPMJF-QGZVFWFLSA-N 2 0 334.552 4.181 20 0 EIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1csc(Cl)c1 ZINC000191348972 1043810256 /nfs/dbraw/zinc/81/02/56/1043810256.db2.gz RAULOUHSOJCRKZ-ZDUSSCGKSA-N 2 0 335.904 4.364 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CCSc2ccc(OC)cc21 ZINC000191483881 1043819508 /nfs/dbraw/zinc/81/95/08/1043819508.db2.gz ARLGZFZMFBABBY-MAUKXSAKSA-N 2 0 336.545 4.332 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1C ZINC000658168050 1043948814 /nfs/dbraw/zinc/94/88/14/1043948814.db2.gz RRSFPPIESVSVLD-LJQANCHMSA-N 2 0 337.511 4.261 20 0 EIADRP Clc1csc(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)c1 ZINC000193083159 1043997476 /nfs/dbraw/zinc/99/74/76/1043997476.db2.gz SYDAGSFTPDZDSG-INIZCTEOSA-N 2 0 334.916 4.056 20 0 EIADRP Cc1nccn1C[C@@H](C)C[NH2+]Cc1ccc(-c2ccc(F)cc2)s1 ZINC000521856324 1044029928 /nfs/dbraw/zinc/02/99/28/1044029928.db2.gz SMRFJGGXQWEIMN-AWEZNQCLSA-N 2 0 343.471 4.485 20 0 EIADRP C[C@@H]1CC(n2nc(C[NH3+])c3ccccc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168015207 1044077770 /nfs/dbraw/zinc/07/77/70/1044077770.db2.gz PNWDVTXTZZQDQT-IAGOWNOFSA-N 2 0 348.494 4.109 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2[C@@H]2CCOC2)cc1 ZINC000474044882 1044276140 /nfs/dbraw/zinc/27/61/40/1044276140.db2.gz JKKMRXBHEUSDRM-YPAWHYETSA-N 2 0 344.543 4.213 20 0 EIADRP CCC[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccsc1 ZINC000191207796 1044277612 /nfs/dbraw/zinc/27/76/12/1044277612.db2.gz RHBQFHHIMJZFLF-IBGZPJMESA-N 2 0 332.513 4.320 20 0 EIADRP CCCCOCCC[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168016928 1044285787 /nfs/dbraw/zinc/28/57/87/1044285787.db2.gz WJBFZLJRFFXOEE-RTBURBONSA-N 2 0 332.532 4.224 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cnc(-c3ccco3)s2)CC1 ZINC000194330018 1044286955 /nfs/dbraw/zinc/28/69/55/1044286955.db2.gz BRBCGBQUNLMLNY-UHFFFAOYSA-N 2 0 347.528 4.347 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC001168470372 1044290237 /nfs/dbraw/zinc/29/02/37/1044290237.db2.gz XURVMTAKDJHZFH-QGZVFWFLSA-N 2 0 332.507 4.391 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc(O)cc1 ZINC001168017936 1044318563 /nfs/dbraw/zinc/31/85/63/1044318563.db2.gz YDQIVCCCRXXXNK-NYUBLWNDSA-N 2 0 338.495 4.484 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](CC2CCCC2)CC1)C1CCC(F)(F)CC1 ZINC000474057680 1044320087 /nfs/dbraw/zinc/32/00/87/1044320087.db2.gz XITCRWGVVTYXNX-OAHLLOKOSA-N 2 0 328.491 4.445 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)C1CCC(F)(F)CC1 ZINC000474079417 1044357449 /nfs/dbraw/zinc/35/74/49/1044357449.db2.gz IXISZHDEECMEMO-ZOBUZTSGSA-N 2 0 328.491 4.443 20 0 EIADRP OC1CC[NH+](Cc2ccccc2C[NH2+]CCCC2CCCCC2)CC1 ZINC000348047673 1044374325 /nfs/dbraw/zinc/37/43/25/1044374325.db2.gz VADFQYLUIZLZHS-UHFFFAOYSA-N 2 0 344.543 4.093 20 0 EIADRP CC(C)C[C@@H]1CCC[C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C1 ZINC000657538365 1044382567 /nfs/dbraw/zinc/38/25/67/1044382567.db2.gz ZQPKXSXOLNFLLZ-PMACEKPBSA-N 2 0 336.564 4.072 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCCC[C@H]2[C@H]2CCOC2)c1 ZINC000474085259 1044418189 /nfs/dbraw/zinc/41/81/89/1044418189.db2.gz WSHNGWGHGGVVFO-FDFHNCONSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(COc2ccccc2)c1)C1CC[NH+](C)CC1 ZINC000675763322 1044471702 /nfs/dbraw/zinc/47/17/02/1044471702.db2.gz KBIPEZBJLOQDEZ-GOSISDBHSA-N 2 0 338.495 4.086 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cc2ccccc2[nH]1 ZINC000675790078 1044500749 /nfs/dbraw/zinc/50/07/49/1044500749.db2.gz RCMADJNBHUDIDA-DYESRHJHSA-N 2 0 333.479 4.168 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)C1CC[NH+](C)CC1)c1c(Cl)cccc1Cl ZINC000675802976 1044503486 /nfs/dbraw/zinc/50/34/86/1044503486.db2.gz JNPQDGISKNZLDF-OLZOCXBDSA-N 2 0 329.315 4.417 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)c1ccc(F)cc1Cl)C1CC[NH+](C)CC1 ZINC000675878317 1044549628 /nfs/dbraw/zinc/54/96/28/1044549628.db2.gz RZXDNIQOUSIOQV-ZDUSSCGKSA-N 2 0 326.887 4.077 20 0 EIADRP C[C@H](CC[NH2+][C@@H](C[C@H]1CCOC1)c1ccc(F)cc1)[NH+]1CCCCC1 ZINC000494976020 1044553465 /nfs/dbraw/zinc/55/34/65/1044553465.db2.gz OGVBHQSADHXCLF-OPYAIIAOSA-N 2 0 348.506 4.148 20 0 EIADRP C[C@@H]1CC(N2CC[C@@H]([NH3+])c3ccccc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168023160 1044560657 /nfs/dbraw/zinc/56/06/57/1044560657.db2.gz VMYSCORWSVEKNN-JBYIUTFZSA-N 2 0 349.522 4.338 20 0 EIADRP CC[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc(F)cn1 ZINC000494967974 1044564502 /nfs/dbraw/zinc/56/45/02/1044564502.db2.gz JTKVIZOTIZUMRQ-ACBHZAAOSA-N 2 0 333.495 4.305 20 0 EIADRP C[C@H]1CC([NH2+]C(C)(C)c2ccncc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168025310 1044644873 /nfs/dbraw/zinc/64/48/73/1044644873.db2.gz JIOLMFCFSPWVCG-ROUUACIJSA-N 2 0 337.511 4.348 20 0 EIADRP C[C@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)C1CCSCC1 ZINC000250104781 1044673718 /nfs/dbraw/zinc/67/37/18/1044673718.db2.gz RXKYLTVZANMGKX-TWFHAPMSSA-N 2 0 346.584 4.264 20 0 EIADRP CC1([NH+]2CCCC2)CCC([NH2+]Cc2c[nH]nc2-c2ccsc2)CC1 ZINC000922505571 1044791040 /nfs/dbraw/zinc/79/10/40/1044791040.db2.gz UJEUNNAJHOKUJK-UHFFFAOYSA-N 2 0 344.528 4.025 20 0 EIADRP CC1(C[NH2+][C@H]2CCN(C3CC3)[C@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000895532369 1044800001 /nfs/dbraw/zinc/80/00/01/1044800001.db2.gz OAUAXHSXRHJXKP-WMZOPIPTSA-N 2 0 334.454 4.380 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccncc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168032455 1044839310 /nfs/dbraw/zinc/83/93/10/1044839310.db2.gz GIVAUBMIBKHGGC-NNTZPNAXSA-N 2 0 349.522 4.490 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CCN(C2CC2)[C@H](c2ccccc2)C1)[C@@H]1CCCOC1 ZINC000895663398 1044842164 /nfs/dbraw/zinc/84/21/64/1044842164.db2.gz KPSUGSYYLBWXJN-WKDRNLAYSA-N 2 0 342.527 4.149 20 0 EIADRP C[C@@H]1CC([NH2+]CC2Cc3ccccc3C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168033438 1044895331 /nfs/dbraw/zinc/89/53/31/1044895331.db2.gz LPTHDPVZUZIVJU-RTBURBONSA-N 2 0 348.534 4.433 20 0 EIADRP C[C@H](c1nc2ccccc2s1)[N@H+](C)CCC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000923319178 1045060249 /nfs/dbraw/zinc/06/02/49/1045060249.db2.gz MJDPFPVTIYXRHX-WZYMTQMTSA-N 2 0 329.513 4.210 20 0 EIADRP CC[NH+](CC)CCOC1CC[NH+](Cc2ccc(C(C)(C)C)cc2)CC1 ZINC000466708345 1045062885 /nfs/dbraw/zinc/06/28/85/1045062885.db2.gz REPTZFLGZCVFTP-UHFFFAOYSA-N 2 0 346.559 4.307 20 0 EIADRP Fc1ccc([C@H](CC(F)(F)F)[NH2+]CCC2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000923377336 1045080220 /nfs/dbraw/zinc/08/02/20/1045080220.db2.gz SKVBHZYIJSXPMG-BHJGYWERSA-N 2 0 344.396 4.330 20 0 EIADRP CC(C)C[N@H+](Cc1ccccc1N(C)C1CC[NH+](C)CC1)C(C)C ZINC000509407769 1045128380 /nfs/dbraw/zinc/12/83/80/1045128380.db2.gz MEAWWNGRAHIVDL-UHFFFAOYSA-N 2 0 331.548 4.083 20 0 EIADRP CC[NH+](CC)C[C@H]1CC[N@H+](CCCc2ccc(C(F)(F)F)cc2)C1 ZINC000674007448 1045178534 /nfs/dbraw/zinc/17/85/34/1045178534.db2.gz JEVZLQNBDNXNOP-QGZVFWFLSA-N 2 0 342.449 4.302 20 0 EIADRP FC(F)C1(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000671762706 1045185637 /nfs/dbraw/zinc/18/56/37/1045185637.db2.gz GYPRWQFEIDKXDS-IPMKNSEASA-N 2 0 348.481 4.312 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)[C@@H](C)c1ccccc1C(F)(F)F ZINC000542567521 1045330207 /nfs/dbraw/zinc/33/02/07/1045330207.db2.gz ZTSCPPKJVFINIK-ILXRZTDVSA-N 2 0 328.422 4.271 20 0 EIADRP Cl/C=C(/Cl)C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000762926571 1045416785 /nfs/dbraw/zinc/41/67/85/1045416785.db2.gz LENOOGVQPKXRCY-SFQUDFHCSA-N 2 0 339.310 4.294 20 0 EIADRP Cc1ccsc1C[N@@H+]1Cc2ccccc2C2(CC[NH+](C)CC2)C1 ZINC001279165973 1045427320 /nfs/dbraw/zinc/42/73/20/1045427320.db2.gz KXSZFCODGHYGPD-UHFFFAOYSA-N 2 0 326.509 4.036 20 0 EIADRP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(Br)c1 ZINC000322630204 1045491675 /nfs/dbraw/zinc/49/16/75/1045491675.db2.gz VIGBPICLMXOAND-NPYXIHBLSA-N 2 0 337.305 4.115 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cccc3cccnc32)CC1 ZINC000054337452 1045575237 /nfs/dbraw/zinc/57/52/37/1045575237.db2.gz AUYZLBYBSORLLQ-UHFFFAOYSA-N 2 0 325.500 4.179 20 0 EIADRP CC[C@H]([NH2+]C1CC[NH+](CC(C)C)CC1)c1ccc2c(c1)CCCO2 ZINC000768092404 1045707523 /nfs/dbraw/zinc/70/75/23/1045707523.db2.gz XXSKXAMCQUAHQE-FQEVSTJZSA-N 2 0 330.516 4.173 20 0 EIADRP C[C@H](C[NH2+]CC1(N[C@@H](C)c2ccccc2)CCOCC1)C(C)(C)C ZINC000670267809 1045761468 /nfs/dbraw/zinc/76/14/68/1045761468.db2.gz UVQGTZSPBFRHPC-MSOLQXFVSA-N 2 0 332.532 4.158 20 0 EIADRP C[C@H](N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1nc(-c2ccccc2)cs1 ZINC000246813586 1045831585 /nfs/dbraw/zinc/83/15/85/1045831585.db2.gz AVBIPIAMXGBBRG-UAGQMJEPSA-N 2 0 327.497 4.088 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccccc2N2CCCCC2)CC1 ZINC000768925391 1045861868 /nfs/dbraw/zinc/86/18/68/1045861868.db2.gz CBMRIGYGICIDOP-UHFFFAOYSA-N 2 0 343.559 4.229 20 0 EIADRP c1ccc(C[N@H+]2CC[C@@H](C[NH2+][C@H]3CCCOc4ccccc43)C2)cc1 ZINC000249157426 1045893657 /nfs/dbraw/zinc/89/36/57/1045893657.db2.gz XKYCQGHQBXWCFM-FPOVZHCZSA-N 2 0 336.479 4.012 20 0 EIADRP CC[C@@H]1C[C@H]([N@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)CCO1 ZINC001170176619 1045913120 /nfs/dbraw/zinc/91/31/20/1045913120.db2.gz AAEJAJVUHWWWJQ-XJSHKYLYSA-N 2 0 342.527 4.072 20 0 EIADRP C[C@@H](Cc1ccccc1Cl)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001170250350 1045973281 /nfs/dbraw/zinc/97/32/81/1045973281.db2.gz KPKKZEFUQFTTAJ-PKOBYXMFSA-N 2 0 342.914 4.383 20 0 EIADRP CCc1noc(C)c1[C@H](C)[NH2+]Cc1cccc(C[NH+](CC)CC)c1 ZINC000769877357 1046105133 /nfs/dbraw/zinc/10/51/33/1046105133.db2.gz VYXURISKUVDSLO-HNNXBMFYSA-N 2 0 329.488 4.238 20 0 EIADRP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(Br)s1 ZINC000038002012 1046168654 /nfs/dbraw/zinc/16/86/54/1046168654.db2.gz BUURMSMWYOJGQA-SNVBAGLBSA-N 2 0 345.350 4.470 20 0 EIADRP CSc1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1F ZINC000123634168 1046189096 /nfs/dbraw/zinc/18/90/96/1046189096.db2.gz FDZCZPTYEVMIMY-AWEZNQCLSA-N 2 0 332.488 4.460 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@H+](C)CC)c2)cc1 ZINC000124004295 1046212411 /nfs/dbraw/zinc/21/24/11/1046212411.db2.gz NYPNRKVQMARNHS-KRWDZBQOSA-N 2 0 326.484 4.388 20 0 EIADRP COc1ccc2cc([C@@H](C)[NH2+]CCC3CC[NH+](C)CC3)ccc2c1 ZINC000125472826 1046311411 /nfs/dbraw/zinc/31/14/11/1046311411.db2.gz LDUYMKNRFQOHOU-MRXNPFEDSA-N 2 0 326.484 4.231 20 0 EIADRP C[C@H](Nc1cccc(C[NH+](C)C)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508688661 1046321856 /nfs/dbraw/zinc/32/18/56/1046321856.db2.gz DLAGTOFQMIXOFR-RXVVDRJESA-N 2 0 337.511 4.071 20 0 EIADRP COc1cc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1C ZINC000508698032 1046328450 /nfs/dbraw/zinc/32/84/50/1046328450.db2.gz KSTQEXQRXZCKPL-NQIIRXRSSA-N 2 0 338.495 4.004 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@@H]1Cc1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508709193 1046359893 /nfs/dbraw/zinc/35/98/93/1046359893.db2.gz GMDXFVKHFKIQPO-OUFMZXHOSA-N 2 0 334.507 4.118 20 0 EIADRP C[C@H]([NH2+]CC1(c2ccccc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508710703 1046370243 /nfs/dbraw/zinc/37/02/43/1046370243.db2.gz NRFRVNSJNRLIAS-PZJWPPBQSA-N 2 0 334.507 4.218 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)C/C(C)=C\c2ccccc2COC)C[C@@H]1C ZINC000508719526 1046378016 /nfs/dbraw/zinc/37/80/16/1046378016.db2.gz NYAFEXDQTIJWHJ-JCXSTKQLSA-N 2 0 330.516 4.041 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)c2ccccc12 ZINC000536652209 1046594163 /nfs/dbraw/zinc/59/41/63/1046594163.db2.gz OKVMRVAAZBHUBV-UHFFFAOYSA-N 2 0 340.511 4.401 20 0 EIADRP c1ccc(C[C@@H]2CCC[C@H]2[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459436207 1046646340 /nfs/dbraw/zinc/64/63/40/1046646340.db2.gz QESRFYDVWIHMEQ-SIKLNZKXSA-N 2 0 335.495 4.051 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccccc2N(C)C)c1 ZINC000536702372 1046700185 /nfs/dbraw/zinc/70/01/85/1046700185.db2.gz CTQYKERDWADJDL-SFHVURJKSA-N 2 0 339.527 4.445 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc2c(c1)COC2 ZINC000536835104 1046810649 /nfs/dbraw/zinc/81/06/49/1046810649.db2.gz XBSOVRBDFJSEDD-YTXWROIDSA-N 2 0 342.527 4.411 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@H]1c1ccccc1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000459730184 1046866834 /nfs/dbraw/zinc/86/68/34/1046866834.db2.gz LNWYHFCAVKASNX-UYKQMDHISA-N 2 0 338.470 4.182 20 0 EIADRP C/C(=C/c1ccccc1OC(F)F)C[NH2+]CC[C@@H]1CCC[N@@H+](C)C1 ZINC000459796845 1046892892 /nfs/dbraw/zinc/89/28/92/1046892892.db2.gz WLKVQCLGSLPSTE-IRVMHKCDSA-N 2 0 338.442 4.013 20 0 EIADRP Cc1nc(F)ccc1C[NH+]1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000787202678 1046949572 /nfs/dbraw/zinc/94/95/72/1046949572.db2.gz SKZDGJHTROITJB-MRXNPFEDSA-N 2 0 333.495 4.006 20 0 EIADRP Cc1nccn1CCCC[NH2+][C@H](COc1ccccc1)c1ccccc1 ZINC000537116024 1046966695 /nfs/dbraw/zinc/96/66/95/1046966695.db2.gz DOGUHPFWWKSYNQ-JOCHJYFZSA-N 2 0 349.478 4.382 20 0 EIADRP COc1cccc(CC2([NH3+])CC[NH+]([C@@H](C)CCCC(C)C)CC2)c1 ZINC001170072220 1047002090 /nfs/dbraw/zinc/00/20/90/1047002090.db2.gz ZDIGTCAYRHCVOP-SFHVURJKSA-N 2 0 332.532 4.246 20 0 EIADRP CC(C)CCC[C@H](C)[NH2+]CCCP(CCC[NH3+])c1ccccc1 ZINC001170073711 1047009123 /nfs/dbraw/zinc/00/91/23/1047009123.db2.gz MGYUWDXZCPZXCT-HSTJUUNISA-N 2 0 336.504 4.337 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCc4ccc(Cl)nc43)CC2)CC1 ZINC000787764700 1047047913 /nfs/dbraw/zinc/04/79/13/1047047913.db2.gz PIKVLOCJWCKVLT-ABHNRTSZSA-N 2 0 347.934 4.355 20 0 EIADRP COc1ccccc1C[N@@H+](Cc1cccs1)CC1CC[NH+](C)CC1 ZINC000788473889 1047197352 /nfs/dbraw/zinc/19/73/52/1047197352.db2.gz LZSAVTVQIROWTE-UHFFFAOYSA-N 2 0 344.524 4.101 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CCO1 ZINC000537406726 1047199441 /nfs/dbraw/zinc/19/94/41/1047199441.db2.gz IAAGTFBSTJYNCM-UVUJQTEASA-N 2 0 344.543 4.080 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1cc[nH]c(=O)c1 ZINC000788530231 1047229212 /nfs/dbraw/zinc/22/92/12/1047229212.db2.gz WQMDQLIXXPNGJY-IAGOWNOFSA-N 2 0 339.483 4.012 20 0 EIADRP CC1(C)CC([NH2+][C@H]2CCCc3c4ccccc4[nH]c32)CC(C)(C)[NH2+]1 ZINC000325637228 1047289910 /nfs/dbraw/zinc/28/99/10/1047289910.db2.gz VTCHJTRPYQMMGT-SFHVURJKSA-N 2 0 325.500 4.444 20 0 EIADRP c1ccc2c(c1)OC1(CCCCC1)C[C@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000129754318 1047500915 /nfs/dbraw/zinc/50/09/15/1047500915.db2.gz ZVDGAYLDCXNRIA-FXAWDEMLSA-N 2 0 340.511 4.287 20 0 EIADRP FC1(F)CCC[C@@H]1CC[NH+]1CCN(c2cc[nH+]c3ccccc32)CC1 ZINC001170127301 1047512897 /nfs/dbraw/zinc/51/28/97/1047512897.db2.gz HUEYAVSSGUBMGM-MRXNPFEDSA-N 2 0 345.437 4.182 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000129862438 1047519161 /nfs/dbraw/zinc/51/91/61/1047519161.db2.gz RWYWXPRYSIXQFK-RXVVDRJESA-N 3 0 343.559 4.023 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)[C@@H]1CCOC1 ZINC000129870453 1047520968 /nfs/dbraw/zinc/52/09/68/1047520968.db2.gz JVLZYAAJTGNTJR-IRLDBZIGSA-N 2 0 344.543 4.356 20 0 EIADRP C[NH+](C)C1CCC([NH2+]C2(c3ccc(Cl)cc3Cl)CC2)CC1 ZINC001168298837 1047686192 /nfs/dbraw/zinc/68/61/92/1047686192.db2.gz FLNUQVZECNKKBE-UHFFFAOYSA-N 2 0 327.299 4.445 20 0 EIADRP C[C@H]1CCCC[C@H]1C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556404277 1047737696 /nfs/dbraw/zinc/73/76/96/1047737696.db2.gz PALZLCWOESVCNY-HKUYNNGSSA-N 2 0 330.516 4.076 20 0 EIADRP Cc1ccc([C@H](O)C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)cc1 ZINC000763432488 1047746963 /nfs/dbraw/zinc/74/69/63/1047746963.db2.gz MBSRKARZGUVNEJ-SIKLNZKXSA-N 2 0 344.543 4.005 20 0 EIADRP C[NH+](C)C1CCC([NH2+]C(C)(C)Cc2ccccc2C(F)(F)F)CC1 ZINC001168305368 1047765853 /nfs/dbraw/zinc/76/58/53/1047765853.db2.gz JAPWUABLEUELTF-UHFFFAOYSA-N 2 0 342.449 4.489 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H](CC2CCOCC2)c2cccc(F)c2)CC1 ZINC001168305732 1047771941 /nfs/dbraw/zinc/77/19/41/1047771941.db2.gz LYARQVNDAFZTRJ-CBNMVNINSA-N 2 0 348.506 4.146 20 0 EIADRP CN1CC[C@H]([NH2+]CCCOc2ccc(F)cc2)C[C@H]1c1ccccc1 ZINC000550644326 1047798375 /nfs/dbraw/zinc/79/83/75/1047798375.db2.gz QXWFJWPGUVQKII-FPOVZHCZSA-N 2 0 342.458 4.020 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+](Cc1cc3c(cccc3Cl)[nH]1)CC2 ZINC001136863982 1047859085 /nfs/dbraw/zinc/85/90/85/1047859085.db2.gz ZMWZILOQRMSICL-UHFFFAOYSA-N 2 0 331.891 4.129 20 0 EIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@H](C)c1ccccc1C(F)(F)F ZINC000824988012 1048016411 /nfs/dbraw/zinc/01/64/11/1048016411.db2.gz GAFOGGJIRFEOCB-BLNMRFBMSA-N 2 0 340.433 4.412 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2CCc3cc(Cl)ccc3C2)cc1 ZINC001171092923 1048117712 /nfs/dbraw/zinc/11/77/12/1048117712.db2.gz BGJUMCAHZUBEAM-FQEVSTJZSA-N 2 0 328.887 4.049 20 0 EIADRP C[N@H+](Cc1csc(Cc2ccc(Cl)cc2)n1)C1CCC([NH3+])CC1 ZINC000844221132 1048225163 /nfs/dbraw/zinc/22/51/63/1048225163.db2.gz WCSLEUFQCMXQGF-UHFFFAOYSA-N 2 0 349.931 4.089 20 0 EIADRP CCn1c2ccccc2nc1[C@H]1CCC[N@@H+]1CCCCCCC[NH3+] ZINC000844221942 1048225880 /nfs/dbraw/zinc/22/58/80/1048225880.db2.gz OSHKXHSAYDNMMN-LJQANCHMSA-N 2 0 328.504 4.102 20 0 EIADRP Clc1ccc2c(c1)CC[C@@H]([NH+]1CCC([NH+]3CCCCC3)CC1)C2 ZINC001171117295 1048287648 /nfs/dbraw/zinc/28/76/48/1048287648.db2.gz WOUVGUPUJXWKPV-HXUWFJFHSA-N 2 0 332.919 4.148 20 0 EIADRP CCc1cc(C[NH+]2CCC(C3CC[NH+](C)CC3)CC2)cc(CC)c1O ZINC001144148396 1048458268 /nfs/dbraw/zinc/45/82/68/1048458268.db2.gz RZWQFBCXHCXHLS-UHFFFAOYSA-N 2 0 344.543 4.071 20 0 EIADRP [NH3+]Cc1ccccc1C[NH2+][C@@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171149567 1048485010 /nfs/dbraw/zinc/48/50/10/1048485010.db2.gz YMIFAKAYEQQALB-MRXNPFEDSA-N 2 0 335.278 4.099 20 0 EIADRP CCCCCC[C@H](CC)n1nc(C[N@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001170592880 1048588530 /nfs/dbraw/zinc/58/85/30/1048588530.db2.gz NGOWBDHKRKLPOR-KRWDZBQOSA-N 2 0 334.552 4.291 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CC[C@@]2(C)C[C@]2(F)Cl)CC1 ZINC000846030934 1048798582 /nfs/dbraw/zinc/79/85/82/1048798582.db2.gz GGJQATBDRDJMCF-LAVFITLUSA-N 2 0 330.919 4.324 20 0 EIADRP C[N@H+](Cc1cccc2cc[nH]c21)C1CC[NH+](C2CCCCC2)CC1 ZINC001144721354 1048831820 /nfs/dbraw/zinc/83/18/20/1048831820.db2.gz IERNNLDJLFFDHG-UHFFFAOYSA-N 2 0 325.500 4.397 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cnc(C3CCC3)s2)CC1 ZINC000134173603 1048891964 /nfs/dbraw/zinc/89/19/64/1048891964.db2.gz KDOAIOZDGIHCHO-UHFFFAOYSA-N 2 0 335.561 4.355 20 0 EIADRP CC[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc2c(c1)CCCO2 ZINC000772953069 1048897155 /nfs/dbraw/zinc/89/71/55/1048897155.db2.gz RFZNAAWOMFUCAJ-IBGZPJMESA-N 2 0 330.516 4.315 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc2c(c1)CCC2 ZINC000817907247 1049056144 /nfs/dbraw/zinc/05/61/44/1049056144.db2.gz SVICRDOEFWQJBA-POCHDABASA-N 2 0 348.490 4.082 20 0 EIADRP CCC([NH3+])(CC)C[NH2+]C1CCC(O)(c2ccc(C(C)C)cc2)CC1 ZINC000817959682 1049069005 /nfs/dbraw/zinc/06/90/05/1049069005.db2.gz GCPPSQXFRBIPNA-UHFFFAOYSA-N 2 0 332.532 4.047 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@@H](C)CCCC[NH3+])ccc1SC(F)F ZINC000817976471 1049073940 /nfs/dbraw/zinc/07/39/40/1049073940.db2.gz ZEDOZDKDCYXEGG-RYUDHWBXSA-N 2 0 332.460 4.178 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)c(F)c1)c1ccc(F)cc1F ZINC000135299156 1049109042 /nfs/dbraw/zinc/10/90/42/1049109042.db2.gz OTZZIOSOQIAUBF-LJQANCHMSA-N 2 0 336.401 4.406 20 0 EIADRP CC(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cccc(Cl)c2C1 ZINC001170916749 1049215163 /nfs/dbraw/zinc/21/51/63/1049215163.db2.gz PEJQYIPSDZAWRY-BZSNNMDCSA-N 2 0 334.935 4.425 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]C[C@H](O)c1ccccc1Cl ZINC000818960344 1049216165 /nfs/dbraw/zinc/21/61/65/1049216165.db2.gz BMWLACSRQNRNRY-FQEVSTJZSA-N 2 0 346.902 4.003 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+][C@@H]1CCc2c(F)cc(F)cc2C1)c1ccccc1 ZINC001171335784 1049357672 /nfs/dbraw/zinc/35/76/72/1049357672.db2.gz ATQNHPUSZQFFND-NQIIRXRSSA-N 2 0 344.449 4.105 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]CCOCC[NH2+][C@@H](C)c2cc(C)oc2C)c(C)o1 ZINC000348098008 1049417046 /nfs/dbraw/zinc/41/70/46/1049417046.db2.gz XXUGYFGNHLZWOH-IYBDPMFKSA-N 2 0 348.487 4.124 20 0 EIADRP Fc1cccc2c1C[C@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CC2 ZINC001170947237 1049501473 /nfs/dbraw/zinc/50/14/73/1049501473.db2.gz UDAKFYVPWYASRN-HXUWFJFHSA-N 2 0 338.470 4.069 20 0 EIADRP Cc1cc(C[NH+](C)C)cc(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]2C)c1 ZINC000820836052 1049566292 /nfs/dbraw/zinc/56/62/92/1049566292.db2.gz IZFYUQIMOOCFGF-XMSQKQJNSA-N 2 0 337.511 4.132 20 0 EIADRP Fc1cccc2c1CC[C@@H](N1CCC3(CCC[N@@H+]3CC3CC3)CC1)C2 ZINC001171421104 1049658944 /nfs/dbraw/zinc/65/89/44/1049658944.db2.gz CLHIRPOORNSGNI-LJQANCHMSA-N 2 0 342.502 4.023 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@@H]2CCc3cc(F)c(F)cc3C2)CC1(C)C ZINC001171462901 1049715124 /nfs/dbraw/zinc/71/51/24/1049715124.db2.gz LHLQYDJLPNWRJW-OAHLLOKOSA-N 2 0 336.470 4.063 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171467494 1049724577 /nfs/dbraw/zinc/72/45/77/1049724577.db2.gz WMENWROHLKUGRM-ADKAHSJRSA-N 2 0 336.470 4.065 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171474687 1049729864 /nfs/dbraw/zinc/72/98/64/1049729864.db2.gz WMENWROHLKUGRM-OKZBNKHCSA-N 2 0 336.470 4.065 20 0 EIADRP COc1cccc([C@@H]2CC[N@@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)C2)c1 ZINC001171641330 1049779013 /nfs/dbraw/zinc/77/90/13/1049779013.db2.gz OVMQNEQJSJFDNV-QGZVFWFLSA-N 2 0 330.516 4.136 20 0 EIADRP Cc1ccc2c(CC[NH3+])cn([C@@H]3C[C@@H](C)[N@@H+](Cc4ccccc4)C3)c2c1 ZINC001171724863 1049784929 /nfs/dbraw/zinc/78/49/29/1049784929.db2.gz DBGBJUKWAUSABI-WIYYLYMNSA-N 2 0 347.506 4.286 20 0 EIADRP Cc1ccc2c(CC[NH3+])cn([C@H]3C[C@H](C)[N@@H+](Cc4ccccc4)C3)c2c1 ZINC001171724862 1049785808 /nfs/dbraw/zinc/78/58/08/1049785808.db2.gz DBGBJUKWAUSABI-RXVVDRJESA-N 2 0 347.506 4.286 20 0 EIADRP C[NH2+]CCc1cn([C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171760335 1049792641 /nfs/dbraw/zinc/79/26/41/1049792641.db2.gz UDOQZCXTVGNIOX-RXVVDRJESA-N 2 0 347.506 4.239 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)CCN1C ZINC000245605367 1049793972 /nfs/dbraw/zinc/79/39/72/1049793972.db2.gz QWFCCIPQIIGIAQ-JLZZUVOBSA-N 2 0 326.406 4.229 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001171963082 1049825494 /nfs/dbraw/zinc/82/54/94/1049825494.db2.gz GSICNBONNISNEF-AWEZNQCLSA-N 2 0 340.433 4.100 20 0 EIADRP C[C@@]1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCS1 ZINC000245686788 1049825756 /nfs/dbraw/zinc/82/57/56/1049825756.db2.gz JQRNVYDRXVKTCH-HAGHYFMRSA-N 2 0 330.541 4.057 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CCC(CC[NH3+])CC1 ZINC001171965133 1049826759 /nfs/dbraw/zinc/82/67/59/1049826759.db2.gz PWMXFZLTYHOEFI-CBCUQQMYSA-N 2 0 328.422 4.134 20 0 EIADRP CC1(C)C[C@H]([NH2+]CCc2ccsc2)CC[N@@H+]1Cc1ccccc1 ZINC001171969145 1049833512 /nfs/dbraw/zinc/83/35/12/1049833512.db2.gz UBPOKTLIPPIYKJ-LJQANCHMSA-N 2 0 328.525 4.323 20 0 EIADRP C[C@@H](CCCC(C)(C)O)[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171972621 1049834352 /nfs/dbraw/zinc/83/43/52/1049834352.db2.gz RRDFWUDAAWBPHJ-ICSRJNTNSA-N 2 0 346.559 4.349 20 0 EIADRP CC1(C)C[C@@H](n2cnc3cccc(C[NH3+])c32)CC[N@@H+]1Cc1ccccc1 ZINC001171973878 1049835800 /nfs/dbraw/zinc/83/58/00/1049835800.db2.gz AEEBRLCQZHCHPF-IBGZPJMESA-N 2 0 348.494 4.111 20 0 EIADRP Cc1ncsc1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171980611 1049838265 /nfs/dbraw/zinc/83/82/65/1049838265.db2.gz WAOHHXGTOQJFNN-GOSISDBHSA-N 2 0 343.540 4.027 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CC2Cc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001171979043 1049838642 /nfs/dbraw/zinc/83/86/42/1049838642.db2.gz KMTYVMWTXUZCDI-QHCPKHFHSA-N 2 0 348.534 4.434 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@@H]2CCCc3ncccc32)CC[N@@H+]1Cc1ccccc1 ZINC001171982334 1049839044 /nfs/dbraw/zinc/83/90/44/1049839044.db2.gz HJOUFBCACLODOJ-DENIHFKCSA-N 2 0 349.522 4.492 20 0 EIADRP C[N@H+](CCc1ccncc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172074723 1049844997 /nfs/dbraw/zinc/84/49/97/1049844997.db2.gz LHVISXUEMLNOIP-JKHIJQBDSA-N 2 0 349.522 4.142 20 0 EIADRP C[C@@H](Cc1cccs1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245770352 1049853006 /nfs/dbraw/zinc/85/30/06/1049853006.db2.gz XEBGOLFGCFCYGV-FFGOWVMKSA-N 2 0 340.536 4.464 20 0 EIADRP C[N@H+](Cc1cccc(OC(F)(F)F)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172133274 1049855014 /nfs/dbraw/zinc/85/50/14/1049855014.db2.gz QWSRSCYICAQJPO-MUJYYYPQSA-N 2 0 342.405 4.032 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCc1ccc(Cl)c(Cl)c1)C2 ZINC001172103123 1049855629 /nfs/dbraw/zinc/85/56/29/1049855629.db2.gz SEEYHHSUAYRGKP-QDMKHBRRSA-N 2 0 327.299 4.141 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cnc(-c3cccs3)s2)[C@@H](C)C1 ZINC000245799480 1049856857 /nfs/dbraw/zinc/85/68/57/1049856857.db2.gz XOICAUXEWHXHJJ-ZFWWWQNUSA-N 2 0 335.542 4.034 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)N2C)c1ccc(OC(F)(F)F)cc1 ZINC001172109704 1049857034 /nfs/dbraw/zinc/85/70/34/1049857034.db2.gz KCNMBNHREVBOBU-MIGQKNRLSA-N 2 0 342.405 4.251 20 0 EIADRP CN(Cc1ccc(Cl)cc1Cl)[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172112776 1049857418 /nfs/dbraw/zinc/85/74/18/1049857418.db2.gz FESJTKFZHUUUBZ-ZSHCYNCHSA-N 2 0 327.299 4.441 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](n1c3ccc(Cl)cc3c3c1CC[NH2+]C3)C2 ZINC001172120163 1049858480 /nfs/dbraw/zinc/85/84/80/1049858480.db2.gz DMCFADXUKJTXMD-MUJYYYPQSA-N 2 0 343.902 4.128 20 0 EIADRP C[N@H+](Cc1ccccc1C(F)(F)F)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172124219 1049859779 /nfs/dbraw/zinc/85/97/79/1049859779.db2.gz JNXPDKIXEMJQLE-ZSHCYNCHSA-N 2 0 326.406 4.153 20 0 EIADRP c1ccc2c(c1)C[C@@H]([N@H+]1CCCC[C@H]1CC[NH+]1CCCC1)CS2 ZINC001172203694 1049863691 /nfs/dbraw/zinc/86/36/91/1049863691.db2.gz VDCHGTQUHDFXGG-RBUKOAKNSA-N 2 0 330.541 4.044 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1CSc2ccccc2C1 ZINC001172206329 1049864780 /nfs/dbraw/zinc/86/47/80/1049864780.db2.gz ONPOOHUOZSJKIU-FHWLQOOXSA-N 2 0 330.541 4.042 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+][C@@H]3COC(C)(C)C3)[C@@H](C)C2)CC[C@@H]1[NH3+] ZINC001172277477 1049870562 /nfs/dbraw/zinc/87/05/62/1049870562.db2.gz IRTPHJZRARPLHH-SXJNSPEGSA-N 2 0 336.564 4.102 20 0 EIADRP CC(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2c(Cl)cccc2C1 ZINC001171031398 1049876117 /nfs/dbraw/zinc/87/61/17/1049876117.db2.gz WLVWRHLVJKGAMS-KZNAEPCWSA-N 2 0 334.935 4.425 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[NH2+]CCC1CC[NH+](Cc2ccccc2)CC1 ZINC001172317865 1049876683 /nfs/dbraw/zinc/87/66/83/1049876683.db2.gz VRWCRZSNOPQFKV-PMACEKPBSA-N 2 0 346.559 4.472 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171033898 1049883130 /nfs/dbraw/zinc/88/31/30/1049883130.db2.gz QHVQDLHSGPDJCW-OKZBNKHCSA-N 2 0 334.935 4.440 20 0 EIADRP C[C@@H]1CC[C@H]([NH+]2CCC3(CC[N@H+](Cc4cccnc4)C3)CC2)C[C@H]1C ZINC001172381012 1049886017 /nfs/dbraw/zinc/88/60/17/1049886017.db2.gz ZSPZFTBVVNIWFL-SBHAEUEKSA-N 2 0 341.543 4.194 20 0 EIADRP CC[C@@H](C)OCC[C@H](C)[NH+]1CCC(CC2CC[NH+](CC)CC2)CC1 ZINC001172347304 1049890481 /nfs/dbraw/zinc/89/04/81/1049890481.db2.gz LZDUTGQYFFCSLE-RBUKOAKNSA-N 2 0 338.580 4.414 20 0 EIADRP CC(C)c1noc([C@@H](C)N2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)n1 ZINC000246007582 1049891343 /nfs/dbraw/zinc/89/13/43/1049891343.db2.gz KNIWRHUSJMSJET-DLBZAZTESA-N 2 0 348.535 4.231 20 0 EIADRP CC(C)COCC[C@@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1C ZINC001172470548 1049909196 /nfs/dbraw/zinc/90/91/96/1049909196.db2.gz ZKHUCUVTMGGRGX-SJBKTWHCSA-N 2 0 346.559 4.185 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CCCC[NH+]1CCCC1 ZINC001172575139 1049941987 /nfs/dbraw/zinc/94/19/87/1049941987.db2.gz HOVAIXLHXQWTRL-CQSZACIVSA-N 2 0 344.877 4.405 20 0 EIADRP [NH3+]C1(Cc2ccccn2)CC[NH+]([C@@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172537673 1049943909 /nfs/dbraw/zinc/94/39/09/1049943909.db2.gz UAINSMKTHDSHJZ-IFMALSPDSA-N 2 0 349.522 4.144 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CCC1CC[NH+](C)CC1 ZINC001172577626 1049950381 /nfs/dbraw/zinc/95/03/81/1049950381.db2.gz VYCLIHRTYYYLFH-CYBMUJFWSA-N 2 0 344.877 4.261 20 0 EIADRP CC1(C)CC([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CC(C)(C)O1 ZINC001172643857 1049954848 /nfs/dbraw/zinc/95/48/48/1049954848.db2.gz CNDSUJFXGGBBEU-UHFFFAOYSA-N 2 0 344.543 4.224 20 0 EIADRP CC1(C)CC([NH2+]CC2CC[NH+](CC3CCCC3)CC2)CC(C)(C)O1 ZINC001172654169 1049957142 /nfs/dbraw/zinc/95/71/42/1049957142.db2.gz WNCLSORPOOFTRZ-UHFFFAOYSA-N 2 0 336.564 4.214 20 0 EIADRP COC1CC[NH+](C2CC[NH+](C3CCC4(CCCC4)CC3)CC2)CC1 ZINC001172731275 1049969069 /nfs/dbraw/zinc/96/90/69/1049969069.db2.gz VXIPKCFPXGSJPT-UHFFFAOYSA-N 2 0 334.548 4.065 20 0 EIADRP C[NH+](C)CC[C@@H]([NH2+][C@@H]1Cc2ccc(Cl)cc2C1)c1ccccc1 ZINC001172708951 1049971316 /nfs/dbraw/zinc/97/13/16/1049971316.db2.gz QFIOGWLBLUPARM-WOJBJXKFSA-N 2 0 328.887 4.090 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccncc1 ZINC000247487642 1050025577 /nfs/dbraw/zinc/02/55/77/1050025577.db2.gz VJZAOXZMVVYRPW-CEXWTWQISA-N 2 0 337.511 4.410 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)CCS2 ZINC000248893055 1050082776 /nfs/dbraw/zinc/08/27/76/1050082776.db2.gz ZGNYFVITIOGBBW-LPHOPBHVSA-N 2 0 348.556 4.190 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H](C)c2ccc(C(F)(F)F)cc2)[C@@H](C)C1 ZINC000249137883 1050093855 /nfs/dbraw/zinc/09/38/55/1050093855.db2.gz XENCLJLFTDPAAX-ZQIUZPCESA-N 2 0 328.422 4.129 20 0 EIADRP C[C@H]1C[C@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)CCO1 ZINC001177213747 1050162941 /nfs/dbraw/zinc/16/29/41/1050162941.db2.gz HBLWHYUJLPDJPY-LAUBAEHRSA-N 2 0 338.495 4.072 20 0 EIADRP c1ccc2c(c1)CCC[C@@H]2C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC001177181040 1050164163 /nfs/dbraw/zinc/16/41/63/1050164163.db2.gz UTAGWSPLQGVONQ-LJQANCHMSA-N 2 0 326.528 4.493 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CC2 ZINC001172827628 1050166217 /nfs/dbraw/zinc/16/62/17/1050166217.db2.gz DDIMFTCZBGSXOM-OAQYLSRUSA-N 2 0 326.528 4.239 20 0 EIADRP COC(=O)[C@H]1CCC[C@@H]([NH2+]CCCCCCCCCCC[NH3+])CC1 ZINC001172801086 1050172869 /nfs/dbraw/zinc/17/28/69/1050172869.db2.gz UATAXXRWKDLPSM-RBUKOAKNSA-N 2 0 340.552 4.168 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ccc3ncccc3c2)C1 ZINC001177290923 1050177286 /nfs/dbraw/zinc/17/72/86/1050177286.db2.gz ZNMWOQZJKSCOQE-HDICACEKSA-N 2 0 325.500 4.083 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2cc(Cl)cc(Cl)c2N)CC1 ZINC001177294370 1050177801 /nfs/dbraw/zinc/17/78/01/1050177801.db2.gz IMSBMXRNJXHYRV-UHFFFAOYSA-N 2 0 344.330 4.177 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1csc(Br)c1 ZINC001177299147 1050179864 /nfs/dbraw/zinc/17/98/64/1050179864.db2.gz LAFJZRFRBSIZTR-ZDUSSCGKSA-N 2 0 345.350 4.255 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2cc(F)cc(F)c2)C1 ZINC001177261383 1050183882 /nfs/dbraw/zinc/18/38/82/1050183882.db2.gz CFBITXDBCVKORT-INIZCTEOSA-N 2 0 344.449 4.487 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cnc3ccsc3c2)C1 ZINC000090585741 1050186523 /nfs/dbraw/zinc/18/65/23/1050186523.db2.gz ICLXUSJAOKYSIV-JKSUJKDBSA-N 2 0 331.529 4.315 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cnc3ccsc3c2)C1 ZINC000090585743 1050188013 /nfs/dbraw/zinc/18/80/13/1050188013.db2.gz ICLXUSJAOKYSIV-HOTGVXAUSA-N 2 0 331.529 4.315 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC001172860435 1050199109 /nfs/dbraw/zinc/19/91/09/1050199109.db2.gz DXHHJNIJMMAURS-CBCUQQMYSA-N 2 0 326.887 4.120 20 0 EIADRP C[NH+](C)CCCCCCC[NH2+]Cc1cc(F)ccc1Br ZINC001177537035 1050245277 /nfs/dbraw/zinc/24/52/77/1050245277.db2.gz IZVYWOVMKQYTFL-UHFFFAOYSA-N 2 0 345.300 4.190 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@H](C)CSc2ccc(Cl)cc2)CC1 ZINC001172875208 1050214582 /nfs/dbraw/zinc/21/45/82/1050214582.db2.gz MTZIDMJWWAWWTK-CQSZACIVSA-N 2 0 326.937 4.283 20 0 EIADRP C[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccc2ccccc2c1 ZINC000090937248 1050218434 /nfs/dbraw/zinc/21/84/34/1050218434.db2.gz BVFSHYPOJULGCT-KRWDZBQOSA-N 2 0 349.478 4.026 20 0 EIADRP C[NH+](C)CCCCCCC[NH2+]Cc1cc(F)cc(Br)c1 ZINC001177537538 1050246476 /nfs/dbraw/zinc/24/64/76/1050246476.db2.gz SFOJAZBUGYYBHR-UHFFFAOYSA-N 2 0 345.300 4.190 20 0 EIADRP C(C1CCCCC1)[NH+]1CCC([NH2+]C2CCC3(CCOCC3)CC2)CC1 ZINC001173044678 1050270395 /nfs/dbraw/zinc/27/03/95/1050270395.db2.gz HTIHUCXTTRCFIH-UHFFFAOYSA-N 2 0 348.575 4.360 20 0 EIADRP CCC(CC)[NH+]1CCC(C[NH2+]C2CCC3(CCOCC3)CC2)CC1 ZINC001173045484 1050271804 /nfs/dbraw/zinc/27/18/04/1050271804.db2.gz XEHNNNIVEWVAED-UHFFFAOYSA-N 2 0 336.564 4.216 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccc(Br)s2)CC1 ZINC001173102571 1050304576 /nfs/dbraw/zinc/30/45/76/1050304576.db2.gz AFSMAOATGFKCRZ-UHFFFAOYSA-N 2 0 345.350 4.253 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](c2ccnc(Cl)c2)C2CC2)CC1 ZINC001173102819 1050304742 /nfs/dbraw/zinc/30/47/42/1050304742.db2.gz BPZBXHJKUCPNGR-FAFZWHIHSA-N 2 0 335.923 4.429 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](c2ccc(Cl)cn2)C2CC2)CC1 ZINC001173109403 1050307183 /nfs/dbraw/zinc/30/71/83/1050307183.db2.gz DVIQZVDOVVHGEO-FAFZWHIHSA-N 2 0 335.923 4.429 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2CC[NH+](C[C@H]3CC=CCC3)CC2)CC1 ZINC001173108861 1050307286 /nfs/dbraw/zinc/30/72/86/1050307286.db2.gz SNFCPLHHXANPQG-YMISUZCDSA-N 2 0 347.591 4.050 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2(Cc3ccc(OC)cc3)CCC2)CC1 ZINC001173106266 1050308121 /nfs/dbraw/zinc/30/81/21/1050308121.db2.gz KTWWVGZHTIZRGD-UHFFFAOYSA-N 2 0 344.543 4.403 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCCC2)[C@@H]2CCc3ncsc3C2)CC1 ZINC001173125808 1050319730 /nfs/dbraw/zinc/31/97/30/1050319730.db2.gz HZYZFERAWHBGOJ-KZNAEPCWSA-N 2 0 347.572 4.153 20 0 EIADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2cc(Cl)ccc2C(F)(F)F)CC1 ZINC001206311257 1050335364 /nfs/dbraw/zinc/33/53/64/1050335364.db2.gz LHWMRYRKLHGIHB-OAHLLOKOSA-N 2 0 334.813 4.310 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]C1CCC(Oc2ccccc2)CC1 ZINC001173196710 1050341107 /nfs/dbraw/zinc/34/11/07/1050341107.db2.gz UNMNOHUBBBARKU-JSOIOWGOSA-N 2 0 332.532 4.477 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CC2)C2CCC(Oc3ccccc3)CC2)CC1 ZINC001173198020 1050343146 /nfs/dbraw/zinc/34/31/46/1050343146.db2.gz PPVGTNDVSYBVKF-JCIQBNCYSA-N 2 0 342.527 4.359 20 0 EIADRP CCCC[C@@H](CC(C)C)[NH2+]CC1CC[NH+](Cc2ccccn2)CC1 ZINC001173258045 1050381353 /nfs/dbraw/zinc/38/13/53/1050381353.db2.gz YVUQREHYBMPWRD-FQEVSTJZSA-N 2 0 331.548 4.488 20 0 EIADRP CC[C@@H]1CC[C@H]([N@H+](Cc2ccccc2OC)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173272786 1050391637 /nfs/dbraw/zinc/39/16/37/1050391637.db2.gz WWCPNVZHRMSPLC-AFYVEPGGSA-N 2 0 330.516 4.346 20 0 EIADRP CC(C)CC1(C[NH2+]Cc2c(Cl)cccc2N2CC[NH+](C)CC2)CC1 ZINC001178161575 1050392560 /nfs/dbraw/zinc/39/25/60/1050392560.db2.gz NIYYCWYWRXLYIQ-UHFFFAOYSA-N 2 0 349.950 4.008 20 0 EIADRP CCc1sc(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)cc1Br ZINC001206317876 1050395855 /nfs/dbraw/zinc/39/58/55/1050395855.db2.gz KETJQLPRCNZLEE-HNNXBMFYSA-N 2 0 345.350 4.024 20 0 EIADRP Cc1cc(C[N@@H+]2CCC[C@](C)(C[NH3+])CC2)cc(C)c1Br ZINC001206317868 1050396101 /nfs/dbraw/zinc/39/61/01/1050396101.db2.gz KCDWYSAQOAJKQL-KRWDZBQOSA-N 2 0 339.321 4.017 20 0 EIADRP CCSC[C@@H](C)[NH+]1CCC([NH3+])(c2ccc(C(F)(F)F)cc2)CC1 ZINC001173295276 1050398999 /nfs/dbraw/zinc/39/89/99/1050398999.db2.gz KQTVUTSQDDMCFE-CYBMUJFWSA-N 2 0 346.462 4.097 20 0 EIADRP CCSC[C@@H](C)[NH+]1CCC([NH3+])(c2cccc(C(F)(F)F)c2)CC1 ZINC001173299181 1050401422 /nfs/dbraw/zinc/40/14/22/1050401422.db2.gz SDSXBNZIQIGPNP-CYBMUJFWSA-N 2 0 346.462 4.097 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]C[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC001178249777 1050411009 /nfs/dbraw/zinc/41/10/09/1050411009.db2.gz VBTNLSRYZNJREI-MRXNPFEDSA-N 2 0 342.449 4.471 20 0 EIADRP COCc1c(C)cc(C)c(C[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)c1C ZINC001178250007 1050411124 /nfs/dbraw/zinc/41/11/24/1050411124.db2.gz ZLHBRIWGYIOOQS-HXUWFJFHSA-N 2 0 346.559 4.216 20 0 EIADRP C[NH+](C)CC1(C[NH2+]Cc2cc3ccnc(Cl)c3s2)CCCC1 ZINC001178448751 1050462090 /nfs/dbraw/zinc/46/20/90/1050462090.db2.gz BHOONUNQXODOFL-UHFFFAOYSA-N 2 0 337.920 4.161 20 0 EIADRP Cc1cc(C[NH2+]CC2(C[NH+](C)C)CCCC2)ccc1C(F)(F)F ZINC001178449942 1050462412 /nfs/dbraw/zinc/46/24/12/1050462412.db2.gz ZVNDZEXOOJJPDP-UHFFFAOYSA-N 2 0 328.422 4.225 20 0 EIADRP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]CCC[NH+]1CCCC1 ZINC001173551202 1050487217 /nfs/dbraw/zinc/48/72/17/1050487217.db2.gz ULDJBTCEXHYEBN-AWEZNQCLSA-N 2 0 329.315 4.390 20 0 EIADRP CC[NH+]1C[C@@H]2C[NH+]([C@@H](C)CCc3ccc(Cl)c(Cl)c3)C[C@H]2C1 ZINC001173551153 1050488267 /nfs/dbraw/zinc/48/82/67/1050488267.db2.gz QYJWWIJXKUVYGU-NUEKZKHPSA-N 2 0 341.326 4.198 20 0 EIADRP c1ccc(C[N@H+]2CC[C@@H](C[NH2+]C3CCc4ccccc4CC3)C2)cc1 ZINC001178609373 1050518327 /nfs/dbraw/zinc/51/83/27/1050518327.db2.gz GKFRPYXKHZZZBR-FQEVSTJZSA-N 2 0 334.507 4.046 20 0 EIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000450740967 1050526217 /nfs/dbraw/zinc/52/62/17/1050526217.db2.gz XGNZIOTZYBGJIC-OGWHTMIXSA-N 2 0 336.470 4.168 20 0 EIADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+]C2CCC3(CCc4ccccc43)CC2)C1 ZINC001173685383 1050538831 /nfs/dbraw/zinc/53/88/31/1050538831.db2.gz RUYBEULXGYOPCW-LNSLMDJYSA-N 2 0 326.528 4.276 20 0 EIADRP CC(C)[NH+]1CCC([NH2+]C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173688143 1050539606 /nfs/dbraw/zinc/53/96/06/1050539606.db2.gz XHZANGAMPFAGOQ-UHFFFAOYSA-N 2 0 326.528 4.276 20 0 EIADRP CC[N@H+](C)C1CC[NH+](C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173690968 1050543557 /nfs/dbraw/zinc/54/35/57/1050543557.db2.gz CYIGRFBBGSTFFF-UHFFFAOYSA-N 2 0 326.528 4.229 20 0 EIADRP CCC[NH+]1C[C@@H]2C[NH+](C3CCC4(CCc5ccccc54)CC3)C[C@H]2C1 ZINC001173690882 1050544294 /nfs/dbraw/zinc/54/42/94/1050544294.db2.gz CENHUYCRFGJCRZ-YUTDQEIESA-N 2 0 338.539 4.087 20 0 EIADRP COc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)c2ccccc12 ZINC001179257490 1050662886 /nfs/dbraw/zinc/66/28/86/1050662886.db2.gz BJKKZJABILUQAG-SFHVURJKSA-N 2 0 338.495 4.060 20 0 EIADRP C[NH+]1CCC(C[NH2+]Cc2ccc(C(F)F)cc2)(c2ccccc2)CC1 ZINC001179370299 1050683791 /nfs/dbraw/zinc/68/37/91/1050683791.db2.gz XTCYYODGKMYBDD-UHFFFAOYSA-N 2 0 344.449 4.377 20 0 EIADRP CCCc1ccc(C[NH2+]CC2(c3ccccc3)CC[NH+](C)CC2)s1 ZINC001179369354 1050684402 /nfs/dbraw/zinc/68/44/02/1050684402.db2.gz CYDUZPKEXUWPAP-UHFFFAOYSA-N 2 0 342.552 4.454 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2cccc(C)n2)ccc1OC ZINC000182524224 1050736282 /nfs/dbraw/zinc/73/62/82/1050736282.db2.gz GJXIFVQMRICQPL-KRWDZBQOSA-N 2 0 341.499 4.091 20 0 EIADRP c1ccc(C[NH+]2CCC[C@H]3C[N@H+](CC4CCSCC4)CC[C@H]32)cc1 ZINC001179918358 1050833961 /nfs/dbraw/zinc/83/39/61/1050833961.db2.gz BOCCNQXXYRCCIC-LEWJYISDSA-N 2 0 344.568 4.116 20 0 EIADRP C[C@H]1CCCc2ccccc2[C@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC001180622197 1051042203 /nfs/dbraw/zinc/04/22/03/1051042203.db2.gz CLRFXDOFHRPPFK-JTSKRJEESA-N 2 0 335.495 4.354 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC001180810294 1051087271 /nfs/dbraw/zinc/08/72/71/1051087271.db2.gz KZVSXISZRZMZFE-HOTGVXAUSA-N 2 0 342.449 4.491 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCCc2cc(SC(F)F)ccc21 ZINC000775380438 1051174338 /nfs/dbraw/zinc/17/43/38/1051174338.db2.gz IPQFGRPCLISZLH-WBMJQRKESA-N 2 0 328.472 4.309 20 0 EIADRP CC[C@@H](C)[C@@H](C[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)OC ZINC001181458729 1051230335 /nfs/dbraw/zinc/23/03/35/1051230335.db2.gz ZEBCWCWZTVDILK-WIYYLYMNSA-N 2 0 332.532 4.069 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@H](C)C[C@@H]2CCOC2)ccc1OC ZINC000775402071 1051236338 /nfs/dbraw/zinc/23/63/38/1051236338.db2.gz YQIDAHJZTHNQGC-SQNIBIBYSA-N 2 0 348.531 4.003 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H](C)C[C@@H]2CCOC2)ccc1OC ZINC000775402068 1051236490 /nfs/dbraw/zinc/23/64/90/1051236490.db2.gz YQIDAHJZTHNQGC-BZSNNMDCSA-N 2 0 348.531 4.003 20 0 EIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](CCCSC(C)(C)C)C2)CC1 ZINC001190652298 1051245430 /nfs/dbraw/zinc/24/54/30/1051245430.db2.gz YZIBBRWVEKEZMH-SFHVURJKSA-N 2 0 326.594 4.352 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(SCC(F)F)cc2)C1 ZINC000163221426 1051250626 /nfs/dbraw/zinc/25/06/26/1051250626.db2.gz AXVUSPKFOGBSMF-KBPBESRZSA-N 2 0 328.472 4.036 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)[C@@H]1CCCC[C@H]1C ZINC001181656519 1051271693 /nfs/dbraw/zinc/27/16/93/1051271693.db2.gz SBPXSERFGALTKE-JBYIUTFZSA-N 2 0 344.543 4.464 20 0 EIADRP C([C@H]1CCCC12CCOCC2)[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001190827422 1051285268 /nfs/dbraw/zinc/28/52/68/1051285268.db2.gz PJTAUJRJEHNSQW-NHCUHLMSSA-N 2 0 348.575 4.171 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1ccc2c(c1)OCO2 ZINC000154845949 1051342299 /nfs/dbraw/zinc/34/22/99/1051342299.db2.gz WYHFSPUZYREFKQ-MRXNPFEDSA-N 2 0 340.467 4.106 20 0 EIADRP C([C@H]1CCC2(CCCCCC2)O1)[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC001191098493 1051349344 /nfs/dbraw/zinc/34/93/44/1051349344.db2.gz CWLBBRDOYPZTJC-VQTJNVASSA-N 2 0 334.548 4.209 20 0 EIADRP CO[C@@H](C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)CC(C)C ZINC001182020672 1051383859 /nfs/dbraw/zinc/38/38/59/1051383859.db2.gz MCDUZBXUXMKYDG-LQCXBHPOSA-N 2 0 344.543 4.223 20 0 EIADRP C[C@@H](CCc1ccccc1)[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001191233032 1051404046 /nfs/dbraw/zinc/40/40/46/1051404046.db2.gz KEEDDUCXBREVGG-REWPJTCUSA-N 2 0 336.523 4.462 20 0 EIADRP C/C=C/COc1ccc(CC[C@H](C)[NH2+]CC[C@H]2CCC[N@H+](C)C2)cc1 ZINC001182248548 1051440151 /nfs/dbraw/zinc/44/01/51/1051440151.db2.gz ACTTZACVUAOEKS-PXODQFSGSA-N 2 0 344.543 4.284 20 0 EIADRP CC(C)CCOCC[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001191359274 1051441514 /nfs/dbraw/zinc/44/15/14/1051441514.db2.gz SXKLWBYIMWZHRI-QFIPXVFZSA-N 2 0 344.543 4.037 20 0 EIADRP C[N@@H+]1CCC[C@@H](CC[NH2+]CCCCc2cccc(C(F)(F)F)c2)C1 ZINC001182251079 1051443549 /nfs/dbraw/zinc/44/35/49/1051443549.db2.gz LTJIVSLISCBGQP-KRWDZBQOSA-N 2 0 342.449 4.350 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+](CCOc1cccc3ccccc31)CC2 ZINC001175211534 1051443959 /nfs/dbraw/zinc/44/39/59/1051443959.db2.gz RSDOMMBKORMSJL-UHFFFAOYSA-N 2 0 338.495 4.026 20 0 EIADRP COc1cc(C)ccc1[C@H](C)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311188769 1051469990 /nfs/dbraw/zinc/46/99/90/1051469990.db2.gz DJWVWNJTRNVTPU-AZUAARDMSA-N 2 0 338.495 4.176 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](CCCOc3cccc(C(C)(C)C)c3)CC[C@H]21 ZINC001191521359 1051471695 /nfs/dbraw/zinc/47/16/95/1051471695.db2.gz PYFYREOFWSGLPC-WIYYLYMNSA-N 2 0 344.543 4.169 20 0 EIADRP C[C@@H]1C[C@H](C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)C[C@H](C)O1 ZINC001191549589 1051485298 /nfs/dbraw/zinc/48/52/98/1051485298.db2.gz FANKXXQEBVUQQN-BNDYYXHWSA-N 2 0 336.564 4.167 20 0 EIADRP CC(C)c1nccn1Cc1cccc(NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c1 ZINC000774280112 1051547330 /nfs/dbraw/zinc/54/73/30/1051547330.db2.gz CPZJNKQFNBUUHI-IHWFROFDSA-N 2 0 338.499 4.092 20 0 EIADRP Cc1nc(C)c([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000272354311 1051569577 /nfs/dbraw/zinc/56/95/77/1051569577.db2.gz RCBQXHMQMONGAC-ZRGWGRIASA-N 2 0 343.540 4.321 20 0 EIADRP CCC(CC)(C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)SC ZINC000775511594 1051660135 /nfs/dbraw/zinc/66/01/35/1051660135.db2.gz DUIDCTFIHDIIPZ-MJGOQNOKSA-N 2 0 334.573 4.408 20 0 EIADRP CC(C)C[N@@H+](Cc1cccc(Cl)c1F)CC1CC[NH+](C)CC1 ZINC001175601120 1051665038 /nfs/dbraw/zinc/66/50/38/1051665038.db2.gz HBAPJYPMCJVZME-UHFFFAOYSA-N 2 0 326.887 4.279 20 0 EIADRP CC(C)COc1cccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC001192323752 1051691062 /nfs/dbraw/zinc/69/10/62/1051691062.db2.gz FCNKMXJVYXYQAC-UGKGYDQZSA-N 2 0 342.527 4.170 20 0 EIADRP C(CC1CC[NH+](CC2([C@@H]3CCCCO3)CCC2)CC1)C[NH+]1CCCC1 ZINC001192401558 1051723115 /nfs/dbraw/zinc/72/31/15/1051723115.db2.gz PFRHBRUJDMGLJF-NRFANRHFSA-N 2 0 348.575 4.314 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc2c(c1)OCCCO2 ZINC000158205354 1051726706 /nfs/dbraw/zinc/72/67/06/1051726706.db2.gz AHPAPAGYUVDYOF-SFHVURJKSA-N 2 0 346.515 4.011 20 0 EIADRP C[N@H+](CCCC[NH+]1CCCCC1)Cc1ccc(F)c2cccnc12 ZINC001175688897 1051730238 /nfs/dbraw/zinc/73/02/38/1051730238.db2.gz QMVQRULFHOUTOA-UHFFFAOYSA-N 2 0 329.463 4.072 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)C1 ZINC000158559791 1051757816 /nfs/dbraw/zinc/75/78/16/1051757816.db2.gz JRJVZSFWPOBSIO-WOJBJXKFSA-N 3 0 349.607 4.131 20 0 EIADRP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]CC[C@H](C)[NH+](C)C ZINC001183105087 1051790664 /nfs/dbraw/zinc/79/06/64/1051790664.db2.gz YHHIGUYBXBWQEK-NEPJUHHUSA-N 2 0 336.829 4.220 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2nc3ccccc3o2)CC1 ZINC000159065861 1051807966 /nfs/dbraw/zinc/80/79/66/1051807966.db2.gz VAYCIFIEJJBYJC-KRWDZBQOSA-N 2 0 341.499 4.304 20 0 EIADRP CC(C)[C@H](C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C)[NH+](C)C ZINC001183366503 1051836635 /nfs/dbraw/zinc/83/66/35/1051836635.db2.gz RLMXWQSEOAZXFC-OAHLLOKOSA-N 2 0 330.497 4.158 20 0 EIADRP CC(C)CCC[C@@H](C)[NH2+]CCC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC001183533353 1051864190 /nfs/dbraw/zinc/86/41/90/1051864190.db2.gz KBHBJNWXTCZOJP-HXUWFJFHSA-N 2 0 346.559 4.208 20 0 EIADRP C[C@H]1C[N@H+](Cc2cccc(CC3CCC3)c2)CCN1c1cc[nH+]cc1 ZINC001183534606 1051864418 /nfs/dbraw/zinc/86/44/18/1051864418.db2.gz RMQNXRVBSNRTKZ-SFHVURJKSA-N 2 0 335.495 4.135 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001193249484 1051890879 /nfs/dbraw/zinc/89/08/79/1051890879.db2.gz NAPLJYBWCOVLHG-ZBFHGGJFSA-N 2 0 338.442 4.031 20 0 EIADRP C[C@H](Cc1coc2ccccc12)[NH2+]C1CCC(C)([NH+]2CCC2)CC1 ZINC001184135780 1051952917 /nfs/dbraw/zinc/95/29/17/1051952917.db2.gz WOFNNWITICYTQU-SRWJYRBRSA-N 2 0 326.484 4.360 20 0 EIADRP CCOc1ccc(CC[NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)cc1 ZINC001184142936 1051953970 /nfs/dbraw/zinc/95/39/70/1051953970.db2.gz NTWDKKNXMHLCIX-RXVVDRJESA-N 2 0 344.543 4.261 20 0 EIADRP COCc1c(C)cc(C)c(C[N@@H+]2CCC(C)(C)[NH2+]C(C)(C)C2)c1C ZINC001184374138 1051999455 /nfs/dbraw/zinc/99/94/55/1051999455.db2.gz JWUCQCBXUGEXRC-UHFFFAOYSA-N 2 0 332.532 4.111 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cc(F)cc(F)c1 ZINC000165182963 1052055079 /nfs/dbraw/zinc/05/50/79/1052055079.db2.gz RIBAYDYPFLRETF-HNNXBMFYSA-N 2 0 348.437 4.146 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000166172536 1052086576 /nfs/dbraw/zinc/08/65/76/1052086576.db2.gz FCEQNTHQKQVAJG-URVUXULASA-N 2 0 344.543 4.399 20 0 EIADRP CSc1ccccc1C[NH+]1CCN(c2cc[nH+]c3ccccc32)CC1 ZINC001194204009 1052104776 /nfs/dbraw/zinc/10/47/76/1052104776.db2.gz KTFHCDMBHCQVEQ-UHFFFAOYSA-N 2 0 349.503 4.279 20 0 EIADRP c1cc2cc(C3CC[NH+](CCC[NH+]4CCCCC4)CC3)ccc2[nH]1 ZINC001176787945 1052191247 /nfs/dbraw/zinc/19/12/47/1052191247.db2.gz NKTWFPUKUOGYHH-UHFFFAOYSA-N 2 0 325.500 4.223 20 0 EIADRP CC(C)(C)n1cncc1[C@H]1CCC[N@H+](Cc2cc(O)ccc2Cl)C1 ZINC001176992022 1052214472 /nfs/dbraw/zinc/21/44/72/1052214472.db2.gz WJSYFKBHWBBBOL-AWEZNQCLSA-N 2 0 347.890 4.377 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CCSc3ccc(F)cc32)cc1 ZINC000171131697 1052396194 /nfs/dbraw/zinc/39/61/94/1052396194.db2.gz IWZOVIXEPLRRPQ-GOSISDBHSA-N 2 0 330.472 4.214 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1cccc2n[nH]cc21 ZINC000623358200 1052630997 /nfs/dbraw/zinc/63/09/97/1052630997.db2.gz SSWQEXIIXIDHIE-QGZVFWFLSA-N 2 0 348.494 4.227 20 0 EIADRP c1[nH]nc2cccc(C[NH2+]Cc3ccc(C[NH+]4CCCCCC4)cc3)c12 ZINC000623384744 1052640873 /nfs/dbraw/zinc/64/08/73/1052640873.db2.gz HMDIKSXGEUFTQF-UHFFFAOYSA-N 2 0 348.494 4.229 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1(C)C ZINC000623512324 1052667283 /nfs/dbraw/zinc/66/72/83/1052667283.db2.gz BLZPDGQSFNLLQK-XIRDDKMYSA-N 2 0 340.433 4.414 20 0 EIADRP COc1cccc([C@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000177261029 1052675585 /nfs/dbraw/zinc/67/55/85/1052675585.db2.gz WVWDXDOQYXKCGX-KRWDZBQOSA-N 2 0 326.484 4.386 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@H](C)[C@H](C)c2nc3ccccc3s2)CC1 ZINC000177836394 1052692205 /nfs/dbraw/zinc/69/22/05/1052692205.db2.gz MDUOHUVGOKYRQE-JKSUJKDBSA-N 2 0 345.556 4.498 20 0 EIADRP COc1ccccc1[C@H](C)[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000177977634 1052695605 /nfs/dbraw/zinc/69/56/05/1052695605.db2.gz CIDQWLRCTGDDLI-KRWDZBQOSA-N 2 0 326.484 4.386 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc3c(c2)OCO3)c1 ZINC000177980009 1052695770 /nfs/dbraw/zinc/69/57/70/1052695770.db2.gz KGJXWVVDGOVGKK-INIZCTEOSA-N 2 0 340.467 4.106 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccsc1 ZINC000178699044 1052710782 /nfs/dbraw/zinc/71/07/82/1052710782.db2.gz DHRLJHHUVSAICS-SFHVURJKSA-N 2 0 343.540 4.001 20 0 EIADRP CC(C)[NH+]1CCC([NH2+]CCc2nc(C3CCCCC3)cs2)CC1 ZINC000180463131 1052801189 /nfs/dbraw/zinc/80/11/89/1052801189.db2.gz YIJWQEIBXDTISD-UHFFFAOYSA-N 2 0 335.561 4.196 20 0 EIADRP Clc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000623861233 1052824330 /nfs/dbraw/zinc/82/43/30/1052824330.db2.gz SJGQZRZFOOYSFG-BFUOFWGJSA-N 2 0 343.902 4.273 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000624124051 1052868715 /nfs/dbraw/zinc/86/87/15/1052868715.db2.gz VZJICWSWENQDBP-CBBWQLFWSA-N 2 0 326.937 4.215 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](c2ccccc2)c2ccc(F)cn2)CC1 ZINC000183555031 1052977640 /nfs/dbraw/zinc/97/76/40/1052977640.db2.gz KHKWYBWIVVCDJK-OAQYLSRUSA-N 2 0 341.474 4.022 20 0 EIADRP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000381131099 1053054607 /nfs/dbraw/zinc/05/46/07/1053054607.db2.gz KHCIPDQMARXAJU-QUCCMNQESA-N 2 0 338.495 4.258 20 0 EIADRP c1c2ccncc2sc1C[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000850097654 1053074445 /nfs/dbraw/zinc/07/44/45/1053074445.db2.gz ZPVODNMCRUUJIW-UHFFFAOYSA-N 2 0 343.540 4.431 20 0 EIADRP c1c2ccncc2sc1C[NH2+]CCCCCCC[NH+]1CCCC1 ZINC000850120161 1053075337 /nfs/dbraw/zinc/07/53/37/1053075337.db2.gz XVKATLMKSLSXDN-UHFFFAOYSA-N 2 0 331.529 4.432 20 0 EIADRP C[C@H]([NH2+]Cc1cc(Cl)cs1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000382062851 1053134920 /nfs/dbraw/zinc/13/49/20/1053134920.db2.gz PYXCHVBJSWHZOZ-GOEBONIOSA-N 2 0 334.916 4.402 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cc2ccccc2[nH]1 ZINC000775628277 1053222287 /nfs/dbraw/zinc/22/22/87/1053222287.db2.gz QSTOMFVCZAVHFI-UYAOXDASSA-N 2 0 347.506 4.383 20 0 EIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cc2ccccc2[nH]1 ZINC000775627902 1053227150 /nfs/dbraw/zinc/22/71/50/1053227150.db2.gz ACEGNXWPRMAYHO-MRXNPFEDSA-N 2 0 334.467 4.130 20 0 EIADRP Cc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000383428569 1053339421 /nfs/dbraw/zinc/33/94/21/1053339421.db2.gz BIUMWIXIEPRFTR-YLJYHZDGSA-N 2 0 326.459 4.134 20 0 EIADRP CSc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000383677400 1053373072 /nfs/dbraw/zinc/37/30/72/1053373072.db2.gz NSCKIMJFFTYGOC-FXAWDEMLSA-N 2 0 340.536 4.409 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)cc2)cs1 ZINC000339072187 1053475111 /nfs/dbraw/zinc/47/51/11/1053475111.db2.gz UQOGSYJIWKPCHE-KYNGSXCRSA-N 2 0 341.524 4.396 20 0 EIADRP Fc1cccc2cc(C[NH2+]Cc3cccc(C[NH+]4CCCC4)c3)cnc12 ZINC000865407928 1053493604 /nfs/dbraw/zinc/49/36/04/1053493604.db2.gz KNHUBSINXUJFKO-UHFFFAOYSA-N 2 0 349.453 4.260 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1cnc(Cl)c(F)c1 ZINC000865413408 1053497468 /nfs/dbraw/zinc/49/74/68/1053497468.db2.gz HEMXBWRUDRCXTQ-UHFFFAOYSA-N 2 0 335.854 4.004 20 0 EIADRP C[C@H](CSC(C)(C)C)[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000765450260 1053549444 /nfs/dbraw/zinc/54/94/44/1053549444.db2.gz PBYNWNYEOWEPQC-IEBWSBKVSA-N 2 0 334.573 4.408 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccnc(Cl)c1 ZINC000765449397 1053551227 /nfs/dbraw/zinc/55/12/27/1053551227.db2.gz JJJAPKMQMWUBKW-SJLPKXTDSA-N 2 0 343.902 4.298 20 0 EIADRP COc1ccc2c(NC[C@@H](c3ccco3)[NH+]3CCCC3)cc[nH+]c2c1 ZINC000765451646 1053554819 /nfs/dbraw/zinc/55/48/19/1053554819.db2.gz CAONPNNJSXOYFG-IBGZPJMESA-N 2 0 337.423 4.085 20 0 EIADRP COc1ccc2c(NC[C@H](c3ccco3)[NH+]3CCCC3)cc[nH+]c2c1 ZINC000765451647 1053555767 /nfs/dbraw/zinc/55/57/67/1053555767.db2.gz CAONPNNJSXOYFG-LJQANCHMSA-N 2 0 337.423 4.085 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]C1CC[NH+](CC3CCCCC3)CC1)CC2 ZINC000765453714 1053557462 /nfs/dbraw/zinc/55/74/62/1053557462.db2.gz QXBWIZNLHWGFCC-QFIPXVFZSA-N 2 0 342.527 4.317 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000865764979 1053587293 /nfs/dbraw/zinc/58/72/93/1053587293.db2.gz GZBZUUTVLSDBHP-SAPNQHFASA-N 2 0 330.516 4.089 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2cnc(-c3ccccc3F)s2)CC1 ZINC000865764975 1053587989 /nfs/dbraw/zinc/58/79/89/1053587989.db2.gz GUKWUJIVVMTCGV-UHFFFAOYSA-N 2 0 347.503 4.302 20 0 EIADRP CC(C)[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccccn1 ZINC000866251424 1053665673 /nfs/dbraw/zinc/66/56/73/1053665673.db2.gz SASRFNQJNRROFC-HXUWFJFHSA-N 2 0 343.540 4.342 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2cc3c(ccnc3Cl)o2)CC1 ZINC000866273678 1053672731 /nfs/dbraw/zinc/67/27/31/1053672731.db2.gz RKWGJCWUHOIMBA-ZDUSSCGKSA-N 2 0 335.879 4.254 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1nccc2c1CCCC2 ZINC000921528078 1053701970 /nfs/dbraw/zinc/70/19/70/1053701970.db2.gz REUVDZFZCUHGEQ-UHFFFAOYSA-N 2 0 337.511 4.090 20 0 EIADRP CC[N@H+](CCOC1CCCCCC1)Cc1ccc(C[NH+](C)C)cc1 ZINC001196622798 1053716409 /nfs/dbraw/zinc/71/64/09/1053716409.db2.gz LEMKQARSCDEBCL-UHFFFAOYSA-N 2 0 332.532 4.310 20 0 EIADRP CC(C)Oc1cccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000386492478 1053748009 /nfs/dbraw/zinc/74/80/09/1053748009.db2.gz XTCRMKZHSGDKPM-NRFANRHFSA-N 2 0 338.495 4.086 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@@H]2CCCO[C@H]2c2ccc(Cl)cc2)CC1 ZINC000866606904 1053802816 /nfs/dbraw/zinc/80/28/16/1053802816.db2.gz KHEQIBLRIVPSEX-MOPGFXCFSA-N 2 0 336.907 4.023 20 0 EIADRP CC1CC[NH+](CC[C@H]2CCC[N@@H+]2C[C@H]2CCCCC2(F)F)CC1 ZINC001196934745 1053805126 /nfs/dbraw/zinc/80/51/26/1053805126.db2.gz CGTGAMPUFTWTLY-QZTJIDSGSA-N 2 0 328.491 4.398 20 0 EIADRP C[N@@H+]1CC[C@@H]2CN(CCCCc3ccc(Cl)c(Cl)c3)CC[C@H]21 ZINC001197031942 1053827749 /nfs/dbraw/zinc/82/77/49/1053827749.db2.gz NFLNZDJNOSRVLI-CRAIPNDOSA-N 2 0 341.326 4.342 20 0 EIADRP COc1c(C)cc([C@H](C)NC2CC[NH+](C3CCC3)CC2)cc1Cl ZINC000796726279 1054031434 /nfs/dbraw/zinc/03/14/34/1054031434.db2.gz DHWLEZPEGCOVSH-AWEZNQCLSA-N 2 0 336.907 4.325 20 0 EIADRP Fc1ccc(/C=C\C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(F)c1 ZINC001199045851 1054332583 /nfs/dbraw/zinc/33/25/83/1054332583.db2.gz WBKGIAMURBSLIE-ARJAWSKDSA-N 2 0 342.433 4.364 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)C1 ZINC001199344130 1054387877 /nfs/dbraw/zinc/38/78/77/1054387877.db2.gz FWHNGVHMZMHIBR-SFHVURJKSA-N 2 0 344.543 4.392 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@H]2CCOC3(CCCCC3)C2)C1 ZINC001199319402 1054390029 /nfs/dbraw/zinc/39/00/29/1054390029.db2.gz AWWHHRCZKBFZIX-AQNXPRMDSA-N 2 0 336.564 4.216 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2cc(F)cc3cccnc32)C1 ZINC001199320665 1054390147 /nfs/dbraw/zinc/39/01/47/1054390147.db2.gz PIWKUODGFRSNJI-IRXDYDNUSA-N 2 0 343.490 4.222 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC2CC[NH+](C3CCCCC3)CC2)C1 ZINC001199760853 1054463842 /nfs/dbraw/zinc/46/38/42/1054463842.db2.gz STJOFKUHYRCGSE-KDURUIRLSA-N 2 0 349.607 4.130 20 0 EIADRP c1cnc2cccc(C[NH2+]Cc3cccc(C[NH+]4CCCC4)c3)c2c1 ZINC000873009133 1054476476 /nfs/dbraw/zinc/47/64/76/1054476476.db2.gz TUPIFPOVPQEDRP-UHFFFAOYSA-N 2 0 331.463 4.120 20 0 EIADRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(Oc3cccnc3)c(C)c2)C1 ZINC001199842993 1054477269 /nfs/dbraw/zinc/47/72/69/1054477269.db2.gz LSKXXRUTHVZTEX-IBGZPJMESA-N 2 0 339.483 4.004 20 0 EIADRP CC[N@@H+]1CCC[C@H](C[NH2+]Cc2cccc(Oc3ccc(F)cc3)c2)C1 ZINC001199844441 1054478807 /nfs/dbraw/zinc/47/88/07/1054478807.db2.gz ZGMOWSCXFPTGCV-GOSISDBHSA-N 2 0 342.458 4.440 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccc(SC(F)F)cc1 ZINC000858490895 1054498269 /nfs/dbraw/zinc/49/82/69/1054498269.db2.gz RUNKDZPYWUVZSI-KBPBESRZSA-N 2 0 328.472 4.384 20 0 EIADRP Clc1ccc2c(c1)[C@H]([NH2+]Cc1cc3c(s1)CC[NH2+]C3)CCC2 ZINC000873212596 1054510687 /nfs/dbraw/zinc/51/06/87/1054510687.db2.gz OYYIEOCDNRDZCO-QGZVFWFLSA-N 2 0 332.900 4.214 20 0 EIADRP CSc1cccc([C@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)c2cc(F)ccc2F)c1 ZINC000873255250 1054517327 /nfs/dbraw/zinc/51/73/27/1054517327.db2.gz FJTVXWJUDIXGCC-ODYMNIRHSA-N 2 0 348.462 4.103 20 0 EIADRP CCO[C@H]1C[C@H]([NH2+]C2CCC([NH+]3CCCCC3)CC2)C12CCCC2 ZINC000776164446 1054780072 /nfs/dbraw/zinc/78/00/72/1054780072.db2.gz ZXKMJEVKOAKWNB-GUMHCPJTSA-N 2 0 334.548 4.111 20 0 EIADRP CCO[C@@H]1C[C@@H]([NH2+]C2CCC([NH+]3CCCCC3)CC2)C12CCCC2 ZINC000776164447 1054780865 /nfs/dbraw/zinc/78/08/65/1054780865.db2.gz ZXKMJEVKOAKWNB-NTFDOXNWSA-N 2 0 334.548 4.111 20 0 EIADRP CC(C)=CCC[C@@H](C)C[N@@H+]1CC[C@@]2(C[NH+](C)C[C@@H]2COCC2CC2)C1 ZINC001201486157 1054814657 /nfs/dbraw/zinc/81/46/57/1054814657.db2.gz GJEJKEQVHSZANB-CEMLEFRQSA-N 2 0 348.575 4.049 20 0 EIADRP CC[C@H](C)C[NH+]1CCC2(CC[N@H+](Cc3cccc(OC)c3)C2)CC1 ZINC001201510286 1054824010 /nfs/dbraw/zinc/82/40/10/1054824010.db2.gz ZBYNIWRGXBOFEI-SFHVURJKSA-N 2 0 330.516 4.029 20 0 EIADRP c1ccc(CCC[N@@H+]2CC[C@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC001201672757 1054873502 /nfs/dbraw/zinc/87/35/02/1054873502.db2.gz XEWPHMPDEHYQPR-XZOQPEGZSA-N 2 0 334.507 4.073 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)c1ccc(C(C)(C)C)cc1 ZINC000173427959 1054945704 /nfs/dbraw/zinc/94/57/04/1054945704.db2.gz UNILHGHLMYOJJQ-MSOLQXFVSA-N 2 0 344.543 4.136 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cc2c(ccnc2Cl)o1 ZINC000876933419 1054985306 /nfs/dbraw/zinc/98/53/06/1054985306.db2.gz OQUGPXFQHDWPDN-AWEZNQCLSA-N 2 0 335.879 4.225 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cc2c(ccnc2Cl)o1 ZINC000876933420 1054986223 /nfs/dbraw/zinc/98/62/23/1054986223.db2.gz OQUGPXFQHDWPDN-CQSZACIVSA-N 2 0 335.879 4.225 20 0 EIADRP Cc1c(C[NH2+]Cc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)ccnc1F ZINC000862271096 1055041388 /nfs/dbraw/zinc/04/13/88/1055041388.db2.gz CNONWMBYDVEIJU-MRXNPFEDSA-N 2 0 341.474 4.051 20 0 EIADRP Cc1c(C[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@@H]2C)ccnc1F ZINC000862271369 1055042380 /nfs/dbraw/zinc/04/23/80/1055042380.db2.gz MKXYCSHATAEJIV-INIZCTEOSA-N 2 0 341.474 4.193 20 0 EIADRP COc1ccc(C2(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CCCCC2)cc1 ZINC000166310956 1055043489 /nfs/dbraw/zinc/04/34/89/1055043489.db2.gz IODYYAFGDVXJHP-WOJBJXKFSA-N 2 0 342.527 4.114 20 0 EIADRP FC(F)C1(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000671762705 1055052781 /nfs/dbraw/zinc/05/27/81/1055052781.db2.gz GYPRWQFEIDKXDS-GUDVDZBRSA-N 2 0 348.481 4.312 20 0 EIADRP C[N@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+](CCC(F)(F)F)C[C@@H]21 ZINC001202328551 1055142748 /nfs/dbraw/zinc/14/27/48/1055142748.db2.gz HNJRBGOQNWHGLN-VNQPRFMTSA-N 2 0 346.462 4.233 20 0 EIADRP COc1cc([C@H](C)[NH2+]CC[C@@H]2CCC[N@@H+]2C)ccc1OCCC(C)C ZINC001168604126 1055151968 /nfs/dbraw/zinc/15/19/68/1055151968.db2.gz KYBQANZSVTWHHW-HKUYNNGSSA-N 2 0 348.531 4.255 20 0 EIADRP C[C@@H]([NH2+]CCCCCCC[NH+]1CCCC1)c1ccc2c(c1)COC2 ZINC000765776514 1055216091 /nfs/dbraw/zinc/21/60/91/1055216091.db2.gz QWWYPAPTYHYWDM-GOSISDBHSA-N 2 0 330.516 4.414 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCCCCCc1ccccc1 ZINC000863541585 1055223829 /nfs/dbraw/zinc/22/38/29/1055223829.db2.gz JQTCOTJCYMKMRL-QGZVFWFLSA-N 2 0 325.500 4.302 20 0 EIADRP Cc1ccc([C@@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)C2CC2)cc1 ZINC000091287596 1055544256 /nfs/dbraw/zinc/54/42/56/1055544256.db2.gz HYTDZJJAUSITFP-JOCHJYFZSA-N 2 0 338.495 4.176 20 0 EIADRP Cc1ccc([C@H]([NH2+]Cc2cccc(Cn3ccnc3)c2)C2CCC2)o1 ZINC000542671932 1055555209 /nfs/dbraw/zinc/55/52/09/1055555209.db2.gz YSBBLFBGPZRNKY-OAQYLSRUSA-N 2 0 335.451 4.464 20 0 EIADRP C[C@H]([NH2+]C1CCC(C(F)F)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000282300149 1055790921 /nfs/dbraw/zinc/79/09/21/1055790921.db2.gz MGAHYHHSXLHRKX-WEOZKBJRSA-N 2 0 336.470 4.311 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@@H](C)C2CCC(C(F)(F)F)CC2)CC1 ZINC000474481427 1055885111 /nfs/dbraw/zinc/88/51/11/1055885111.db2.gz VROSFSCHWSVNBD-FHERZECASA-N 2 0 334.470 4.454 20 0 EIADRP CSC[C@H]([NH2+]CCCC[NH+](C)C)c1ccc(C(F)(F)F)cc1 ZINC000542847700 1056224129 /nfs/dbraw/zinc/22/41/29/1056224129.db2.gz GMYOYPUHQLACQN-HNNXBMFYSA-N 2 0 334.451 4.041 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2cccc(F)c2)CC1 ZINC000060377454 1056428308 /nfs/dbraw/zinc/42/83/08/1056428308.db2.gz XGWATMGVTBZFNW-UHFFFAOYSA-N 2 0 326.459 4.170 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C[C@@H]2CC3c4ccccc4C2c2ccccc23)C1 ZINC000656193725 1056692765 /nfs/dbraw/zinc/69/27/65/1056692765.db2.gz QMNHHEIZZGCSKS-LBUZQPQDSA-N 2 0 332.491 4.143 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(SC(F)F)cc2)[C@@H](C)C1 ZINC000746469508 1060373961 /nfs/dbraw/zinc/37/39/61/1060373961.db2.gz COFBAFZSOXPIOW-BBRMVZONSA-N 2 0 328.472 4.163 20 0 EIADRP C[C@H]1CCCC[C@@H]1C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001168825265 1060430531 /nfs/dbraw/zinc/43/05/31/1060430531.db2.gz HRUOHJMONODKKW-AZUAARDMSA-N 2 0 329.532 4.446 20 0 EIADRP CO[C@H](C[N@H+](C)Cc1ccc(C[NH+](C)C)cc1)c1ccc(Cl)cc1 ZINC001168836794 1060444776 /nfs/dbraw/zinc/44/47/76/1060444776.db2.gz FMIDTWOLVVQWHF-HXUWFJFHSA-N 2 0 346.902 4.221 20 0 EIADRP COc1ccc(C)cc1[C@@H](C)[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000766514832 1060470594 /nfs/dbraw/zinc/47/05/94/1060470594.db2.gz ZFXPRYPLAOWAOB-LMDPOFIKSA-N 2 0 330.516 4.451 20 0 EIADRP COc1cc(C)ccc1[C@@H](C)[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000766511581 1060481171 /nfs/dbraw/zinc/48/11/71/1060481171.db2.gz DYULIPWVODWCMS-LMDPOFIKSA-N 2 0 330.516 4.451 20 0 EIADRP CC(C)C[C@H](Cc1ccccc1)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC001169062033 1060619745 /nfs/dbraw/zinc/61/97/45/1060619745.db2.gz QAKXBOWUAGQZRC-OAQYLSRUSA-N 2 0 337.511 4.297 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CCc1ccc(Oc3ccccc3)cc1)C2 ZINC001169096480 1060634437 /nfs/dbraw/zinc/63/44/37/1060634437.db2.gz XIZHZOMUUOALER-OWZKRDHZSA-N 2 0 336.479 4.236 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@H]1CCCc3cc(Br)ccc31)C2 ZINC001169101515 1060637028 /nfs/dbraw/zinc/63/70/28/1060637028.db2.gz TZEYQEIFWNTAQB-CUSZFKRNSA-N 2 0 349.316 4.041 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C(C)(C)c1cccc(C(F)(F)F)c1)C2 ZINC001169101583 1060637621 /nfs/dbraw/zinc/63/76/21/1060637621.db2.gz UJPMLCZMELOBPD-PHZGNYQRSA-N 2 0 326.406 4.155 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CC[C@H](c3cccc(C(F)(F)F)c3)C1)C2 ZINC001169141063 1060660403 /nfs/dbraw/zinc/66/04/03/1060660403.db2.gz OMLXCFHNMAOCEV-DZJNRPSUSA-N 2 0 338.417 4.120 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CC[C@H](c3cccc(C(F)(F)F)c3)C1)C2 ZINC001169141065 1060661228 /nfs/dbraw/zinc/66/12/28/1060661228.db2.gz OMLXCFHNMAOCEV-OWLYRPNTSA-N 2 0 338.417 4.120 20 0 EIADRP C[C@H](c1cccc(Br)c1)[N@H+](C)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169162482 1060672292 /nfs/dbraw/zinc/67/22/92/1060672292.db2.gz TZKBJVHQKJIXTQ-VZEFYGNVSA-N 2 0 337.305 4.067 20 0 EIADRP C[C@@H]1C[N@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)CCC[C@H]1C[NH3+] ZINC001206011913 1060842130 /nfs/dbraw/zinc/84/21/30/1060842130.db2.gz HANOUXUPGYBENU-YPMHNXCESA-N 2 0 334.813 4.166 20 0 EIADRP CC[NH+](CC)Cc1cc(C(F)(F)F)ccc1NCC[C@H]1CCC[NH2+]1 ZINC001169568511 1060860185 /nfs/dbraw/zinc/86/01/85/1060860185.db2.gz BARYHJZNRYIJEM-MRXNPFEDSA-N 2 0 343.437 4.101 20 0 EIADRP C[C@H]1C[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)CCC[C@H]1C[NH3+] ZINC001206013211 1060862953 /nfs/dbraw/zinc/86/29/53/1060862953.db2.gz QIVIPSVBQFYZPO-QWRGUYRKSA-N 2 0 335.706 4.454 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cn3ccccc3n2)cc1 ZINC000563671523 370702822 /nfs/dbraw/zinc/70/28/22/370702822.db2.gz YPQHLQGBASCLAU-KRWDZBQOSA-N 2 0 336.483 4.027 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](CN[C@H](C)c2sccc2Br)C1 ZINC000531702763 1031487047 /nfs/dbraw/zinc/48/70/47/1031487047.db2.gz WGUHFPFAIGUXIU-OLZOCXBDSA-N 2 0 345.350 4.282 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2ccccc2n1)c1ccc(OCC[NH+](C)C)cc1 ZINC000532212089 1032092124 /nfs/dbraw/zinc/09/21/24/1032092124.db2.gz USBUXQUDPTUYGM-KRWDZBQOSA-N 2 0 349.478 4.026 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H]2CCc3c2cccc3Cl)ccc1F ZINC000532223333 1032102624 /nfs/dbraw/zinc/10/26/24/1032102624.db2.gz JWJJRLAVFNMQTP-LJQANCHMSA-N 2 0 332.850 4.318 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cc3cccc(OC)c3o2)c1 ZINC000729682076 1032131748 /nfs/dbraw/zinc/13/17/48/1032131748.db2.gz JREUQOZACFRFLA-UHFFFAOYSA-N 2 0 338.451 4.183 20 0 EIADRP C=Cn1cc(C[NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)cn1 ZINC000194199867 1032164177 /nfs/dbraw/zinc/16/41/77/1032164177.db2.gz KAUOEKAYTPIXRI-UHFFFAOYSA-N 2 0 346.478 4.002 20 0 EIADRP COc1cc(CN(C)C2CC[NH+](C(C)C)CC2)cc(C(F)(F)F)c1 ZINC000529520828 1032423194 /nfs/dbraw/zinc/42/31/94/1032423194.db2.gz NFHSTSXEQXQRCB-UHFFFAOYSA-N 2 0 344.421 4.019 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCN(Cc2ccccc2)CC1(C)C)C1CC(F)(F)C1 ZINC000529556101 1032451347 /nfs/dbraw/zinc/45/13/47/1032451347.db2.gz JTQAXXBMAOOBNC-CRAIPNDOSA-N 2 0 336.470 4.311 20 0 EIADRP C[C@H](c1ccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C)C2)cc1)C(F)(F)F ZINC000450504323 1032533899 /nfs/dbraw/zinc/53/38/99/1032533899.db2.gz UMSHESASPLNLOZ-ZTFGCOKTSA-N 2 0 340.433 4.269 20 0 EIADRP FC1(F)CC(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000450499643 1032542148 /nfs/dbraw/zinc/54/21/48/1032542148.db2.gz JJFKJTIQZGGCHZ-RTBURBONSA-N 2 0 334.454 4.018 20 0 EIADRP CCC[N@H+](CC)Cc1ccc(C(=O)Nc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000429581005 1032782101 /nfs/dbraw/zinc/78/21/01/1032782101.db2.gz RUEVDFVRJGWJFE-MRXNPFEDSA-N 2 0 339.483 4.191 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000579726812 1018828538 /nfs/dbraw/zinc/82/85/38/1018828538.db2.gz WKMAUYIJQFCDTL-ZWKOTPCHSA-N 2 0 340.433 4.273 20 0 EIADRP C[NH+](C)[C@@H]1CCCN(Cc2ccccc2OCc2ccccc2)CC1 ZINC000432799006 1032820745 /nfs/dbraw/zinc/82/07/45/1032820745.db2.gz VCIVJOWBMMXLPY-OAQYLSRUSA-N 2 0 338.495 4.182 20 0 EIADRP Cc1nc2c(s1)[C@H]([NH2+]Cc1ccccc1C[N@@H+](C)C(C)C)CCC2 ZINC000154869800 1020078214 /nfs/dbraw/zinc/07/82/14/1020078214.db2.gz DYPQZCLJUYDUAH-GOSISDBHSA-N 2 0 343.540 4.459 20 0 EIADRP COC(C)(C)CC[N@@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001209409085 1020267632 /nfs/dbraw/zinc/26/76/32/1020267632.db2.gz BJWAZPJEAKMEMN-UHFFFAOYSA-N 2 0 344.543 4.180 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000126179093 1020787491 /nfs/dbraw/zinc/78/74/91/1020787491.db2.gz SDYHYUSIBZIAMY-CYBMUJFWSA-N 2 0 346.462 4.333 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3c2cc(F)cc3F)c1 ZINC000121279781 1020795087 /nfs/dbraw/zinc/79/50/87/1020795087.db2.gz NNUAFLAQVZWUOA-HXUWFJFHSA-N 2 0 330.422 4.194 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](c2cccc(F)c2)c2cccc(Cl)c2)C1 ZINC000655805528 1020972016 /nfs/dbraw/zinc/97/20/16/1020972016.db2.gz OYMSTELSZCDKSF-VOBQZIQPSA-N 2 0 346.877 4.498 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000655805435 1020972349 /nfs/dbraw/zinc/97/23/49/1020972349.db2.gz OBVYUNFJRJXSLM-BVPBIZIASA-N 2 0 340.433 4.271 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000655806568 1020974780 /nfs/dbraw/zinc/97/47/80/1020974780.db2.gz YPVNDLHSEFZDPP-QFUCXCTJSA-N 2 0 338.495 4.256 20 0 EIADRP CCC[NH+]1CCC(N[C@@H](C)c2ccc(OCC3CC3)c(F)c2)CC1 ZINC000121637346 1020982558 /nfs/dbraw/zinc/98/25/58/1020982558.db2.gz ACPRSNZCNKKXLO-HNNXBMFYSA-N 2 0 334.479 4.140 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCCc3ccc(O)cc32)c1 ZINC000340473700 1021086022 /nfs/dbraw/zinc/08/60/22/1021086022.db2.gz KVYPJGNOQOXHLW-QFIPXVFZSA-N 2 0 338.495 4.401 20 0 EIADRP Cc1ccncc1[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000683691508 1021100348 /nfs/dbraw/zinc/10/03/48/1021100348.db2.gz YNVFDSFOHIZERQ-WJMWBRGCSA-N 2 0 335.495 4.236 20 0 EIADRP CC1CC[NH+](CCC[C@H]([NH2+][C@H]2CCCOC2)c2ccc(F)cc2)CC1 ZINC000340502106 1021155585 /nfs/dbraw/zinc/15/55/85/1021155585.db2.gz WRTYVDHZJVGGSB-SFTDATJTSA-N 2 0 348.506 4.148 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cccc(OC(F)F)c2)c1 ZINC000057968937 1021280128 /nfs/dbraw/zinc/28/01/28/1021280128.db2.gz YCYIWPBBZPLQEH-UHFFFAOYSA-N 2 0 348.437 4.418 20 0 EIADRP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000472468662 1021389069 /nfs/dbraw/zinc/38/90/69/1021389069.db2.gz UFXMFZNGXWYSNS-GOEBONIOSA-N 2 0 340.433 4.430 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc2c(c1)CCO2 ZINC000177728481 1021618703 /nfs/dbraw/zinc/61/87/03/1021618703.db2.gz HMSJIOFRSSIJQH-QGZVFWFLSA-N 2 0 336.479 4.068 20 0 EIADRP CC[C@@H]1CN(Cc2csc(-c3ccc(Cl)cc3)n2)CC[C@@H]1[NH3+] ZINC000647499080 1021635465 /nfs/dbraw/zinc/63/54/65/1021635465.db2.gz YXOJAEDGEZCDTE-WBMJQRKESA-N 2 0 335.904 4.023 20 0 EIADRP Cc1nc(C)c([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000272354302 1021643485 /nfs/dbraw/zinc/64/34/85/1021643485.db2.gz RCBQXHMQMONGAC-VCBZYWHSSA-N 2 0 343.540 4.321 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1 ZINC000414103516 1021857840 /nfs/dbraw/zinc/85/78/40/1021857840.db2.gz DUXDLFYWESCUCR-SQNIBIBYSA-N 2 0 330.516 4.307 20 0 EIADRP COc1ccc2ccccc2c1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000511497426 1021901495 /nfs/dbraw/zinc/90/14/95/1021901495.db2.gz UXRSRFYQZZCFSU-UHFFFAOYSA-N 2 0 326.484 4.012 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc2c[nH+]cn2c1)c1ccc(OC(F)F)cc1 ZINC000414144659 1021955139 /nfs/dbraw/zinc/95/51/39/1021955139.db2.gz AATVJFYJUBDGQM-QGZVFWFLSA-N 2 0 331.366 4.177 20 0 EIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]Cc1cc2ccccc2[nH]1 ZINC000683929142 1021996128 /nfs/dbraw/zinc/99/61/28/1021996128.db2.gz OVRPRCKFIYRXOS-QZTJIDSGSA-N 2 0 347.506 4.414 20 0 EIADRP CC[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccc(OC(F)F)cc1 ZINC000414168507 1022016816 /nfs/dbraw/zinc/01/68/16/1022016816.db2.gz AFEPZGYBROJFMW-WMLDXEAASA-N 2 0 326.431 4.061 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1cnn(C(C)C)c1 ZINC000163788416 1022033399 /nfs/dbraw/zinc/03/33/99/1022033399.db2.gz OPJZUEBMSXMJSD-KRWDZBQOSA-N 2 0 328.504 4.157 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000414182582 1022055812 /nfs/dbraw/zinc/05/58/12/1022055812.db2.gz MWVJOXUYTMBSTE-ZWKOTPCHSA-N 2 0 339.483 4.256 20 0 EIADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000414182580 1022056042 /nfs/dbraw/zinc/05/60/42/1022056042.db2.gz MWVJOXUYTMBSTE-QZTJIDSGSA-N 2 0 339.483 4.256 20 0 EIADRP Cc1cc(F)ncc1C[NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000892574010 1022255100 /nfs/dbraw/zinc/25/51/00/1022255100.db2.gz HNKVCEKTAQSMQH-INIZCTEOSA-N 2 0 341.474 4.051 20 0 EIADRP C[C@H](C[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)CC(F)(F)F ZINC000414264530 1022340802 /nfs/dbraw/zinc/34/08/02/1022340802.db2.gz KOEMPTAFJPUMJV-HOTGVXAUSA-N 2 0 342.449 4.260 20 0 EIADRP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]CCc1cn2c(n1)CCCC2 ZINC000152763257 1022516989 /nfs/dbraw/zinc/51/69/89/1022516989.db2.gz HMWFUWRFYAPLCK-CQSZACIVSA-N 2 0 347.890 4.165 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccnc(Cl)c1 ZINC000162923774 1022785852 /nfs/dbraw/zinc/78/58/52/1022785852.db2.gz PGXKXIVGMGZWFK-HNNXBMFYSA-N 2 0 329.875 4.182 20 0 EIADRP Clc1cc2cccnc2c(C[N@@H+]2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c1 ZINC000647543893 1022796782 /nfs/dbraw/zinc/79/67/82/1022796782.db2.gz UDWOJAYPLJFYHZ-DLBZAZTESA-N 2 0 343.902 4.100 20 0 EIADRP CCOc1cccc(C[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000311003474 1022811363 /nfs/dbraw/zinc/81/13/63/1022811363.db2.gz KGMUZTVRSYCCND-JOCHJYFZSA-N 2 0 338.495 4.087 20 0 EIADRP COc1cc(C)ccc1C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548153697 1022828099 /nfs/dbraw/zinc/82/80/99/1022828099.db2.gz DGZUSAJFZAPPRF-NQIIRXRSSA-N 2 0 338.495 4.004 20 0 EIADRP c1ccc(C[N@@H+]2C[C@H]3[C@@H](C2)[C@@H]2CC[C@H]3C[NH+]2Cc2ccccc2)cc1 ZINC000656404126 1022844534 /nfs/dbraw/zinc/84/45/34/1022844534.db2.gz WYQSTLLFJCLBJL-AFXVXQJMSA-N 2 0 332.491 4.029 20 0 EIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000558486175 1023082628 /nfs/dbraw/zinc/08/26/28/1023082628.db2.gz RWHPSNZWPSDWOL-RVSUXWIQSA-N 2 0 338.442 4.154 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)[C@@H]1C[C@H]1c1cccs1 ZINC000417313199 1023258068 /nfs/dbraw/zinc/25/80/68/1023258068.db2.gz PAIGSCQSEJMLLE-RRQGHBQHSA-N 2 0 332.488 4.231 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)CC1 ZINC000581504565 1023313536 /nfs/dbraw/zinc/31/35/36/1023313536.db2.gz WQORKGLGAPWWGK-HXUWFJFHSA-N 2 0 346.563 4.379 20 0 EIADRP C[C@@H](C[N@H+](C)C1CCN(CCc2ccccn2)CC1)C1CCCCC1 ZINC000549472628 1023337406 /nfs/dbraw/zinc/33/74/06/1023337406.db2.gz XYVBVOPGYLFGBH-IBGZPJMESA-N 2 0 343.559 4.237 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2ccc(F)c(C(F)(F)F)c2)CC1 ZINC000511520324 1023384728 /nfs/dbraw/zinc/38/47/28/1023384728.db2.gz FEUKULPZCHATEX-UHFFFAOYSA-N 2 0 332.385 4.008 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000415013414 1023390219 /nfs/dbraw/zinc/39/02/19/1023390219.db2.gz KWLWOOCJDCXPCH-CYBMUJFWSA-N 2 0 329.469 4.163 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1csc(-c2ccsc2)n1)c1ccccc1 ZINC000415046542 1023407950 /nfs/dbraw/zinc/40/79/50/1023407950.db2.gz CSFMUAHDGIDMAM-QGZVFWFLSA-N 2 0 343.521 4.441 20 0 EIADRP C[C@H]1C[C@H]([NH2+]Cc2cccc3c2CCCN3)CC[N@@H+]1Cc1ccccc1 ZINC000415046476 1023409532 /nfs/dbraw/zinc/40/95/32/1023409532.db2.gz ZTYLDQFIAXMZEM-GHTZIAJQSA-N 2 0 349.522 4.187 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1csc(-c2ccccc2)n1)c1ccccc1 ZINC000415057570 1023410827 /nfs/dbraw/zinc/41/08/27/1023410827.db2.gz RQYKRNXDMUZVAL-IBGZPJMESA-N 2 0 337.492 4.380 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1csc(Br)c1)c1ccccc1 ZINC000415058145 1023410847 /nfs/dbraw/zinc/41/08/47/1023410847.db2.gz SRQJJWOAZBNATI-CQSZACIVSA-N 2 0 339.302 4.080 20 0 EIADRP CCO[C@H]1C[C@H]([N@H+](C)Cc2cccc(C[NH+]3CCCCC3)c2)C1(C)C ZINC001167473938 1023425973 /nfs/dbraw/zinc/42/59/73/1023425973.db2.gz NOZIBWOICQMNIT-SFTDATJTSA-N 2 0 344.543 4.308 20 0 EIADRP CCO[C@@H]1C[C@@H]([N@H+](C)Cc2cccc(C[NH+]3CCCCC3)c2)C1(C)C ZINC001167473936 1023426505 /nfs/dbraw/zinc/42/65/05/1023426505.db2.gz NOZIBWOICQMNIT-NHCUHLMSSA-N 2 0 344.543 4.308 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000415089952 1023435574 /nfs/dbraw/zinc/43/55/74/1023435574.db2.gz ZJKNXLXKIQGKLN-VKJFTORMSA-N 2 0 343.540 4.466 20 0 EIADRP COc1cccc([C@H]([NH2+]C2CCC([NH3+])CC2)c2ccccc2Cl)c1 ZINC000415086637 1023438254 /nfs/dbraw/zinc/43/82/54/1023438254.db2.gz SHHWFXKSFWLGJK-PMTKGXAQSA-N 2 0 344.886 4.298 20 0 EIADRP CCCOc1c(C[NH+]2CCC(CC[NH+](C)C)CC2)cccc1OCC ZINC000511522216 1023462880 /nfs/dbraw/zinc/46/28/80/1023462880.db2.gz CNEIGIGYRROXKG-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP Cc1cc(C[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)cc(C)c1O ZINC000310991878 1023498215 /nfs/dbraw/zinc/49/82/15/1023498215.db2.gz HVTGUXJTTMSZDJ-QFIPXVFZSA-N 2 0 338.495 4.011 20 0 EIADRP C[C@H](C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000500106261 1023505996 /nfs/dbraw/zinc/50/59/96/1023505996.db2.gz ZLIHJQSZQXBZLJ-CVEARBPZSA-N 2 0 340.433 4.227 20 0 EIADRP c1csc(-c2ncc(C[NH+]3CCC([C@H]4CCC[NH2+]C4)CC3)s2)c1 ZINC000656785314 1023528672 /nfs/dbraw/zinc/52/86/72/1023528672.db2.gz GSAHJKKJNPCRKX-HNNXBMFYSA-N 2 0 347.553 4.083 20 0 EIADRP c1sc(-c2ccccc2)nc1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000656784484 1023530646 /nfs/dbraw/zinc/53/06/46/1023530646.db2.gz DNWAFGFGKKENJL-GOSISDBHSA-N 2 0 341.524 4.022 20 0 EIADRP Clc1ccc2cccnc2c1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000656787312 1023537022 /nfs/dbraw/zinc/53/70/22/1023537022.db2.gz XCAPXSTWJGJUJL-KRWDZBQOSA-N 2 0 343.902 4.100 20 0 EIADRP CC(C)C[C@@H](C)[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000341314019 1023567042 /nfs/dbraw/zinc/56/70/42/1023567042.db2.gz PHPHGUGZBKNXIF-LJQANCHMSA-N 2 0 332.532 4.082 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+](Cc1cc(Cl)ccc1Cl)CC2 ZINC001204568466 1023575214 /nfs/dbraw/zinc/57/52/14/1023575214.db2.gz HJLVVVHBLCZXEZ-UHFFFAOYSA-N 2 0 327.299 4.301 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCCCC1(F)F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000394556592 1023607005 /nfs/dbraw/zinc/60/70/05/1023607005.db2.gz IXSPKLHYOKXVBD-UHOSZYNNSA-N 2 0 336.470 4.312 20 0 EIADRP CCC1(C[NH2+][C@H]2CCC[C@@H](OC)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000684388550 1023616540 /nfs/dbraw/zinc/61/65/40/1023616540.db2.gz UPXBXRQFFHQCAA-LEWJYISDSA-N 2 0 344.543 4.226 20 0 EIADRP CC[NH+](CC)Cc1cc(NCCC[N@@H+]2CCCC[C@@H]2C)ccc1OC ZINC001167754259 1023636289 /nfs/dbraw/zinc/63/62/89/1023636289.db2.gz QBYHBCZDTDKEAF-SFHVURJKSA-N 2 0 347.547 4.213 20 0 EIADRP CC(C)C1=[NH+]CCc2ccc(NCCC[N@@H+]3CCCC[C@@H]3C)cc21 ZINC001167754789 1023641695 /nfs/dbraw/zinc/64/16/95/1023641695.db2.gz VLEZLPFNGYFEBZ-KRWDZBQOSA-N 2 0 327.516 4.364 20 0 EIADRP Cc1ccc2cc(C[N@@H+](C)C3CCN(c4cc[nH+]cc4)CC3)ccc2n1 ZINC000377709736 1023705473 /nfs/dbraw/zinc/70/54/73/1023705473.db2.gz VBUDDQQBXSVKFD-UHFFFAOYSA-N 2 0 346.478 4.039 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cc(F)ccc1Br ZINC000020049119 1023713275 /nfs/dbraw/zinc/71/32/75/1023713275.db2.gz XRXXHEBZOWTWRG-CYBMUJFWSA-N 2 0 345.300 4.188 20 0 EIADRP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(Br)cc1 ZINC000020143211 1023739334 /nfs/dbraw/zinc/73/93/34/1023739334.db2.gz QOHNXXJVLGHNMF-LBPRGKRZSA-N 2 0 339.321 4.409 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2c[nH]c3ccccc23)CC1 ZINC000472856026 1023741249 /nfs/dbraw/zinc/74/12/49/1023741249.db2.gz WQJBZRNCRAJVNU-GOSISDBHSA-N 2 0 325.500 4.222 20 0 EIADRP CC(C)[NH+]1CCC(N(C)Cc2cc3ccnc(Cl)c3s2)CC1 ZINC000893919992 1033163199 /nfs/dbraw/zinc/16/31/99/1033163199.db2.gz NQYIIWQACMPFMX-UHFFFAOYSA-N 2 0 337.920 4.254 20 0 EIADRP C[C@H](CCCC(F)(F)F)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000390744204 1023820018 /nfs/dbraw/zinc/82/00/18/1023820018.db2.gz OMYRZDVLVWTWEV-NVXWUHKLSA-N 2 0 328.422 4.219 20 0 EIADRP COc1ccc([C@H](C)C[NH+]2CCC([NH2+]Cc3ccccc3)CC2)cc1 ZINC000660679837 1024013336 /nfs/dbraw/zinc/01/33/36/1024013336.db2.gz PPRRGOJNSFNCEN-GOSISDBHSA-N 2 0 338.495 4.053 20 0 EIADRP c1c2cnccc2oc1C[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000651712512 1024248768 /nfs/dbraw/zinc/24/87/68/1024248768.db2.gz IOENQZJLVQIVCE-UHFFFAOYSA-N 2 0 349.478 4.494 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cc(F)c(F)c(F)c2)c1 ZINC000123937353 1024249695 /nfs/dbraw/zinc/24/96/95/1024249695.db2.gz NOOUZFVSAWDOMH-CYBMUJFWSA-N 2 0 336.401 4.406 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000510699557 1024252428 /nfs/dbraw/zinc/25/24/28/1024252428.db2.gz BZSMHBUQTFDQRG-RDJZCZTQSA-N 2 0 342.449 4.348 20 0 EIADRP CC(C)c1ccc(OC2CC[NH+](CC[C@@H]3CCC[N@@H+]3C)CC2)cc1 ZINC000535765558 1024922469 /nfs/dbraw/zinc/92/24/69/1024922469.db2.gz VYYNVVSOFLIVNZ-IBGZPJMESA-N 2 0 330.516 4.138 20 0 EIADRP CCC1([NH3+])CC[NH+]([C@H](C)c2sc(-c3ccccc3)nc2C)CC1 ZINC000925757659 1024960835 /nfs/dbraw/zinc/96/08/35/1024960835.db2.gz VKSDOUIKUZLOSD-OAHLLOKOSA-N 2 0 329.513 4.383 20 0 EIADRP CC[C@@H](c1ccc(F)cc1)[NH+]1CCC(OCC[NH+](CC)CC)CC1 ZINC000342107537 1025265498 /nfs/dbraw/zinc/26/54/98/1025265498.db2.gz CPQCOSJWYFPZRQ-FQEVSTJZSA-N 2 0 336.495 4.100 20 0 EIADRP FC(F)(F)[C@@H]1CC[N@H+](Cc2cccc(C[NH+]3CCCCC3)c2)C1 ZINC000663435087 1025338829 /nfs/dbraw/zinc/33/88/29/1025338829.db2.gz POWISNCARFLGPM-QGZVFWFLSA-N 2 0 326.406 4.057 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2occc2c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000511985606 1025393976 /nfs/dbraw/zinc/39/39/76/1025393976.db2.gz AQDRCOCJWSSLRC-UWJYYQICSA-N 2 0 334.463 4.433 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2occc2c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000511985601 1025394593 /nfs/dbraw/zinc/39/45/93/1025394593.db2.gz AQDRCOCJWSSLRC-LAUBAEHRSA-N 2 0 334.463 4.433 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cc1Cl ZINC000663467358 1025398036 /nfs/dbraw/zinc/39/80/36/1025398036.db2.gz DZNBDXODMCLFLT-HOCLYGCPSA-N 2 0 336.907 4.121 20 0 EIADRP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663470230 1025413094 /nfs/dbraw/zinc/41/30/94/1025413094.db2.gz TWWIHJDOQUGEGP-WMLDXEAASA-N 2 0 335.561 4.348 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cnc2ccsc2c1 ZINC000663470617 1025420362 /nfs/dbraw/zinc/42/03/62/1025420362.db2.gz VMOQNMWCNJMMKX-ZBFHGGJFSA-N 2 0 329.513 4.069 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 ZINC000643458775 1025555099 /nfs/dbraw/zinc/55/50/99/1025555099.db2.gz ZWUNBTARHTUDAG-WYUUTHIRSA-N 2 0 334.348 4.003 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@H]1c1ccc(OC)c(OC)c1 ZINC001167825464 1025606289 /nfs/dbraw/zinc/60/62/89/1025606289.db2.gz JHQOVICCIUBRFH-MJGOQNOKSA-N 2 0 348.531 4.351 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC001167826147 1025618082 /nfs/dbraw/zinc/61/80/82/1025618082.db2.gz NCTXMMUODRSHKU-FQEVSTJZSA-N 3 0 345.575 4.093 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](N[C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000643524154 1025676548 /nfs/dbraw/zinc/67/65/48/1025676548.db2.gz QLGZEWXEDHDCHO-SJBKTWHCSA-N 2 0 349.453 4.323 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](N[C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000643524152 1025678937 /nfs/dbraw/zinc/67/89/37/1025678937.db2.gz QLGZEWXEDHDCHO-KCZVDYSFSA-N 2 0 349.453 4.323 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc2ccccc2c1OC(F)F ZINC000643521713 1025683921 /nfs/dbraw/zinc/68/39/21/1025683921.db2.gz YNOLBEOXENXYPK-DZGCQCFKSA-N 2 0 334.410 4.234 20 0 EIADRP CN(CCSc1cccc(Cl)c1)CC[C@H]1CCCC[N@@H+]1C ZINC001167508631 1025768882 /nfs/dbraw/zinc/76/88/82/1025768882.db2.gz ILXUPWZJLPNARX-MRXNPFEDSA-N 2 0 326.937 4.238 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@@H]1c1cccc(C(=O)OC)c1 ZINC001167834086 1025811628 /nfs/dbraw/zinc/81/16/28/1025811628.db2.gz HLINSFRWUMWWCZ-YLJYHZDGSA-N 2 0 346.515 4.121 20 0 EIADRP C[C@@H]([NH2+][C@H](c1cccc(Cl)c1)c1ccccn1)C1CC[NH+](C)CC1 ZINC000124640531 1025830424 /nfs/dbraw/zinc/83/04/24/1025830424.db2.gz UMSWXEJLZLHECM-FOIQADDNSA-N 2 0 343.902 4.144 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1C[C@@H]2C[C@H]1CN2c1ccccc1Cl ZINC001167836178 1025845713 /nfs/dbraw/zinc/84/57/13/1025845713.db2.gz WZDWTUVAPSXSAM-SQNIBIBYSA-N 2 0 349.950 4.113 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](CC)[C@H]1CCN(Cc2ccccc2)C1 ZINC001167838967 1025852252 /nfs/dbraw/zinc/85/22/52/1025852252.db2.gz XGONZEJYRFVWEM-UNMCSNQZSA-N 2 0 345.575 4.093 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@@H](c2cccc(OC)c2)C1 ZINC001167839556 1025853608 /nfs/dbraw/zinc/85/36/08/1025853608.db2.gz ABJCKCYVLTVXBF-UYAOXDASSA-N 2 0 332.532 4.385 20 0 EIADRP COc1cccc([C@@H]2C[C@H](C)C[N@@H+]2CCCCn2ccnc2C)c1 ZINC000344034472 1025889946 /nfs/dbraw/zinc/88/99/46/1025889946.db2.gz FASLQLGNNBFDKQ-JXFKEZNVSA-N 2 0 327.472 4.063 20 0 EIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@H](c2ccccc2F)C2CCCC2)CCCO1 ZINC000432420125 1025898901 /nfs/dbraw/zinc/89/89/01/1025898901.db2.gz IYVIVNZMTWAMQW-UTKZUKDTSA-N 2 0 348.506 4.148 20 0 EIADRP Clc1ccc2c(c1)CC[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3CC1CC1)C2 ZINC001167971281 1026056457 /nfs/dbraw/zinc/05/64/57/1026056457.db2.gz VZMKVMXNCPNNKF-UDEWTMQYSA-N 2 0 344.930 4.192 20 0 EIADRP C[C@@H](Cc1ccc(Cl)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167971237 1026065552 /nfs/dbraw/zinc/06/55/52/1026065552.db2.gz UNDOQEAVUGACLR-LRLLJDFBSA-N 2 0 332.919 4.266 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000431353866 1026149510 /nfs/dbraw/zinc/14/95/10/1026149510.db2.gz XCSHWZKNYSTUFS-UWVAXJGDSA-N 2 0 328.500 4.240 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000431353868 1026149842 /nfs/dbraw/zinc/14/98/42/1026149842.db2.gz XCSHWZKNYSTUFS-ZWOKBUDYSA-N 2 0 328.500 4.240 20 0 EIADRP C[Si](C)(C)C([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)[Si](C)(C)C ZINC001167974212 1026184338 /nfs/dbraw/zinc/18/43/38/1026184338.db2.gz RAVFWQRSNPIUQP-ALOPSCKCSA-N 2 0 338.688 4.105 20 0 EIADRP COc1cccc(CC(C)(C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167978129 1026339400 /nfs/dbraw/zinc/33/94/00/1026339400.db2.gz KFBCFMHJRIIUBM-IHWFROFDSA-N 2 0 342.527 4.011 20 0 EIADRP c1c2ccncc2sc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000657384318 1026406037 /nfs/dbraw/zinc/40/60/37/1026406037.db2.gz ORZOZRFUHLXAQV-UHFFFAOYSA-N 2 0 329.513 4.183 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)cs2)cs1 ZINC000152425028 1026542461 /nfs/dbraw/zinc/54/24/61/1026542461.db2.gz JGYSWIYSQSFGFW-OCCSQVGLSA-N 2 0 347.553 4.315 20 0 EIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+]CC3CCCCC3)CC2)cc1 ZINC000344713050 1026556019 /nfs/dbraw/zinc/55/60/19/1026556019.db2.gz PGAMQCOXFYIURI-UHFFFAOYSA-N 2 0 344.543 4.228 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc3ccccc3s2)[C@H](C)C1 ZINC000132698518 1026565090 /nfs/dbraw/zinc/56/50/90/1026565090.db2.gz ITARHSAFPBFCMO-VQIMIIECSA-N 2 0 346.540 4.128 20 0 EIADRP C[C@@H]([NH2+]Cc1cc2ccncc2s1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000657430591 1026644673 /nfs/dbraw/zinc/64/46/73/1026644673.db2.gz RSQZTABUPRTFDR-GDBMZVCRSA-N 2 0 329.513 4.039 20 0 EIADRP Fc1ccc(CN(Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)c(F)c1 ZINC000432659567 1026687004 /nfs/dbraw/zinc/68/70/04/1026687004.db2.gz SAGKADKXGXHNNS-SFHVURJKSA-N 2 0 348.462 4.171 20 0 EIADRP Fc1ccc(CN(Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)c(F)c1 ZINC000432659563 1026687656 /nfs/dbraw/zinc/68/76/56/1026687656.db2.gz SAGKADKXGXHNNS-GOSISDBHSA-N 2 0 348.462 4.171 20 0 EIADRP CCC[NH+]1CCN(c2ccccc2C[N@H+](C)[C@@H](C)c2ccco2)CC1 ZINC000507212864 1026704423 /nfs/dbraw/zinc/70/44/23/1026704423.db2.gz PCIVDWDOLLKTDB-SFHVURJKSA-N 2 0 341.499 4.005 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000507440703 1026802598 /nfs/dbraw/zinc/80/25/98/1026802598.db2.gz ITUORMSBCQHZTN-KRWDZBQOSA-N 2 0 340.433 4.478 20 0 EIADRP Clc1ccc(CCCC[NH2+]Cc2ccnn2-c2cc[nH+]cc2)s1 ZINC000657464644 1026804749 /nfs/dbraw/zinc/80/47/49/1026804749.db2.gz VCRGJJAYINDBFM-UHFFFAOYSA-N 2 0 346.887 4.095 20 0 EIADRP CCCOc1ccc(C[NH2+][C@@H]2CCN(C)[C@H](c3ccccc3)C2)cc1 ZINC000582560157 1026805258 /nfs/dbraw/zinc/80/52/58/1026805258.db2.gz CWFFKGAYMQIECV-IRLDBZIGSA-N 2 0 338.495 4.401 20 0 EIADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cc(Cl)ccc1OC(F)F ZINC000507475876 1026808719 /nfs/dbraw/zinc/80/87/19/1026808719.db2.gz IGYXVXSBVHBXJI-GFCCVEGCSA-N 2 0 346.849 4.324 20 0 EIADRP CCOc1ccc([C@H](CC)[NH2+]C2CCN(CC)CC2)cc1OCC ZINC000159316146 1026809677 /nfs/dbraw/zinc/80/96/77/1026809677.db2.gz VNHBORYJYUWWDN-SFHVURJKSA-N 2 0 334.504 4.009 20 0 EIADRP CCc1cccnc1[C@H](C)[NH2+]Cc1ccccc1C[NH+](CC)CC ZINC000507522029 1026826279 /nfs/dbraw/zinc/82/62/79/1026826279.db2.gz CYNNCJUTRSDEHF-KRWDZBQOSA-N 2 0 325.500 4.337 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)CCCS2 ZINC000187964653 1026861624 /nfs/dbraw/zinc/86/16/24/1026861624.db2.gz IIFXFDGMSHGQPO-VQIMIIECSA-N 2 0 348.556 4.332 20 0 EIADRP Cc1ccc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1C ZINC000060952661 1026997301 /nfs/dbraw/zinc/99/73/01/1026997301.db2.gz IZRJBUNEIXFMDM-UHFFFAOYSA-N 2 0 328.525 4.367 20 0 EIADRP CC[NH+]1CCC(C[NH2+]Cc2ccc(-c3ccc(F)cc3C)o2)CC1 ZINC000519780762 1026997970 /nfs/dbraw/zinc/99/79/70/1026997970.db2.gz UXKUMZPCFVQAFA-UHFFFAOYSA-N 2 0 330.447 4.216 20 0 EIADRP CCc1cc(N2CC[NH+]([C@H](C)c3cccnc3)CC2)c2ccccc2[nH+]1 ZINC000301813539 1027095572 /nfs/dbraw/zinc/09/55/72/1027095572.db2.gz YSMAQXYIXQWNCC-QGZVFWFLSA-N 2 0 346.478 4.075 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cc1OC ZINC000474476298 1027107793 /nfs/dbraw/zinc/10/77/93/1027107793.db2.gz WXGBPMYDZGKMPK-KZNAEPCWSA-N 2 0 348.531 4.050 20 0 EIADRP CC[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cccc(F)c1 ZINC000188167277 1027160617 /nfs/dbraw/zinc/16/06/17/1027160617.db2.gz VDGQRSFFJCABKD-HXUWFJFHSA-N 2 0 327.447 4.178 20 0 EIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H]3CCC[C@@H]3CCCF)cc2)CC1 ZINC000342824898 1027179056 /nfs/dbraw/zinc/17/90/56/1027179056.db2.gz KLDULINDHQEJIA-WIYYLYMNSA-N 2 0 348.506 4.168 20 0 EIADRP Cc1ccc2[nH+]ccc(NCC3CCN(c4cc[nH+]cc4)CC3)c2c1 ZINC000302219166 1027266764 /nfs/dbraw/zinc/26/67/64/1027266764.db2.gz LKPVRQVWYSIEHW-UHFFFAOYSA-N 2 0 332.451 4.267 20 0 EIADRP c1ccc([C@H]2CC[C@@H]([NH2+]CC3CC[NH+](Cc4ccncc4)CC3)C2)cc1 ZINC000657613550 1027290018 /nfs/dbraw/zinc/29/00/18/1027290018.db2.gz NJJPKECTHKHIBF-XZOQPEGZSA-N 2 0 349.522 4.220 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H](c1ccccc1F)C(C)C ZINC000657616311 1027298371 /nfs/dbraw/zinc/29/83/71/1027298371.db2.gz WEWOOCXKOKKNRZ-FQEVSTJZSA-N 2 0 338.430 4.202 20 0 EIADRP Cc1ccc(COc2ccc(C[NH2+]CCCC[NH+](C)C)cc2)cc1 ZINC000520221657 1027332255 /nfs/dbraw/zinc/33/22/55/1027332255.db2.gz NCSLWRYGCYALFT-UHFFFAOYSA-N 2 0 326.484 4.005 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000474628557 1027335627 /nfs/dbraw/zinc/33/56/27/1027335627.db2.gz LBXKIXAXRKKFOX-APIJFGDWSA-N 2 0 326.937 4.215 20 0 EIADRP C[C@H](c1ccccn1)[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000342874067 1027393413 /nfs/dbraw/zinc/39/34/13/1027393413.db2.gz KOAZBINNCWOIMV-LJQANCHMSA-N 2 0 335.495 4.131 20 0 EIADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474714914 1027434096 /nfs/dbraw/zinc/43/40/96/1027434096.db2.gz SKSCLIHUVYBWQU-AEGPPILISA-N 2 0 326.937 4.215 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474814768 1027536186 /nfs/dbraw/zinc/53/61/86/1027536186.db2.gz DPGHMMAIHRQAML-YYFQZIEXSA-N 2 0 326.937 4.356 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H]3CCCc4ncccc43)CC2)c1 ZINC000631577120 1027580498 /nfs/dbraw/zinc/58/04/98/1027580498.db2.gz PHXFOFYABSERPE-HXUWFJFHSA-N 2 0 341.524 4.022 20 0 EIADRP C[C@H]([NH2+][C@@H](CC(F)(F)F)c1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC000090969069 1027638261 /nfs/dbraw/zinc/63/82/61/1027638261.db2.gz JFRPPHGBXUNQKX-LRDDRELGSA-N 2 0 332.385 4.139 20 0 EIADRP Fc1ccc(C2=CC[C@@H]([NH2+]C3CC([NH+]4CCCCC4)C3)CC2)cc1 ZINC000475574758 1027669144 /nfs/dbraw/zinc/66/91/44/1027669144.db2.gz XSZXXEXRBWFTQJ-QNGMFEMESA-N 2 0 328.475 4.368 20 0 EIADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474947440 1027821449 /nfs/dbraw/zinc/82/14/49/1027821449.db2.gz PLJHOFWWVUTREF-HZSPNIEDSA-N 2 0 326.937 4.215 20 0 EIADRP COc1ccc([C@@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)cc1Cl ZINC000522546630 1028007581 /nfs/dbraw/zinc/00/75/81/1028007581.db2.gz XDWMPKPMAMJBFI-CXAGYDPISA-N 2 0 326.912 4.366 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(Cl)s1 ZINC000162548624 1028080505 /nfs/dbraw/zinc/08/05/05/1028080505.db2.gz VQJCJNAHOFDSBO-CYBMUJFWSA-N 2 0 338.904 4.193 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000443971988 1028217599 /nfs/dbraw/zinc/21/75/99/1028217599.db2.gz LPYFMWKWSQELHG-QGZVFWFLSA-N 2 0 328.431 4.049 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](CCOCc2ccccc2)CC1 ZINC001167658441 1028220500 /nfs/dbraw/zinc/22/05/00/1028220500.db2.gz HHLNWLBGEJYKFL-FQEVSTJZSA-N 2 0 344.543 4.180 20 0 EIADRP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000280934732 1028282936 /nfs/dbraw/zinc/28/29/36/1028282936.db2.gz SAHHWROHTDIUSV-AWEZNQCLSA-N 2 0 340.433 4.243 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@H]1Cc1ccc(C)cc1 ZINC000346159709 1028297383 /nfs/dbraw/zinc/29/73/83/1028297383.db2.gz CXDCMTNESVSHPL-QFIPXVFZSA-N 2 0 346.478 4.091 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@@]3(C2)CCCCO3)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168048485 1028298560 /nfs/dbraw/zinc/29/85/60/1028298560.db2.gz VXDAOMLZXPHMNN-NPDDRXJXSA-N 2 0 342.527 4.073 20 0 EIADRP Cc1nccn1CC[N@@H+]1CCc2ccccc2[C@H]1Cc1ccccc1 ZINC000346179709 1028308923 /nfs/dbraw/zinc/30/89/23/1028308923.db2.gz JKRZTCFEIIQCHU-JOCHJYFZSA-N 2 0 331.463 4.034 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1C[C@@H](c2ccccc2C)C[C@@H]1C ZINC000346196991 1028323170 /nfs/dbraw/zinc/32/31/70/1028323170.db2.gz DCWIQCSVWHXZCT-HKUYNNGSSA-N 2 0 346.478 4.262 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@](C)(c2ccccc2)C1 ZINC000346230543 1028334821 /nfs/dbraw/zinc/33/48/21/1028334821.db2.gz WQQGZLKPPNOQAV-QFIPXVFZSA-N 2 0 346.478 4.129 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@](C)(c2ccccc2)C1 ZINC000346230542 1028336584 /nfs/dbraw/zinc/33/65/84/1028336584.db2.gz WQQGZLKPPNOQAV-JOCHJYFZSA-N 2 0 346.478 4.129 20 0 EIADRP FC1(F)CC[C@@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000281080509 1028379853 /nfs/dbraw/zinc/37/98/53/1028379853.db2.gz JGEPWXACDHOWRX-AKHDSKFASA-N 2 0 334.454 4.207 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@H]1/C=C/c1ccccc1 ZINC000346350242 1028383868 /nfs/dbraw/zinc/38/38/68/1028383868.db2.gz JTRFTWXYTDLOFE-GLCJEOIMSA-N 2 0 344.462 4.254 20 0 EIADRP FC(F)(F)c1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000261827612 1028417404 /nfs/dbraw/zinc/41/74/04/1028417404.db2.gz XHBUGBICBCMFCN-BRWVUGGUSA-N 2 0 326.406 4.106 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](c2cncc(F)c2)C2CC2)c1 ZINC000281354952 1028534496 /nfs/dbraw/zinc/53/44/96/1028534496.db2.gz VSDKJIDMZGUIMM-NRFANRHFSA-N 2 0 341.474 4.303 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccnc(Cl)c2)c1 ZINC000161720681 1028743175 /nfs/dbraw/zinc/74/31/75/1028743175.db2.gz JOQSFSNQFFPRSW-HNNXBMFYSA-N 2 0 331.891 4.426 20 0 EIADRP C(=C\C[N@@H+]1CCC[C@@H]1c1cccnc1)\C[NH+]1CCC[C@@H]1c1cccnc1 ZINC000346978600 1028830818 /nfs/dbraw/zinc/83/08/18/1028830818.db2.gz UEZABGVONGZQNQ-KTAFUJLCSA-N 2 0 348.494 4.007 20 0 EIADRP COCCC[C@H]([NH2+]C1CC[NH+](CC(C)C)CC1)c1ccc(F)cc1 ZINC000281929856 1028975403 /nfs/dbraw/zinc/97/54/03/1028975403.db2.gz KICPIFRHHMOXSH-FQEVSTJZSA-N 2 0 336.495 4.003 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](CC)c2ccc(OC(F)F)cc2)C1 ZINC000151133019 1029150419 /nfs/dbraw/zinc/15/04/19/1029150419.db2.gz IZPAJPSNOYOGFZ-PBHICJAKSA-N 2 0 326.431 4.061 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2ccc(OC(F)F)cc2)C1 ZINC000151133080 1029150476 /nfs/dbraw/zinc/15/04/76/1029150476.db2.gz IZPAJPSNOYOGFZ-YOEHRIQHSA-N 2 0 326.431 4.061 20 0 EIADRP Cc1nc(F)ccc1C[NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000278421069 1029180529 /nfs/dbraw/zinc/18/05/29/1029180529.db2.gz QQHLCPAHPMNYGL-MRXNPFEDSA-N 2 0 341.474 4.051 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](c1ccccc1OC)C1CCCC1 ZINC000650756969 1029197673 /nfs/dbraw/zinc/19/76/73/1029197673.db2.gz LFLVUYHBHNHSRR-QFIPXVFZSA-N 2 0 338.495 4.436 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000583826820 1029242076 /nfs/dbraw/zinc/24/20/76/1029242076.db2.gz CBHZFJDSRJVGLJ-MRXNPFEDSA-N 2 0 325.500 4.076 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[N@H+]1CCCC12CC[NH+](C)CC2 ZINC000475119973 1029264788 /nfs/dbraw/zinc/26/47/88/1029264788.db2.gz DWDSLILYMBZVTD-UHFFFAOYSA-N 2 0 326.406 4.074 20 0 EIADRP COc1c(C)cc([C@H](C)[NH2+]Cc2ccc3c[nH+]cn3c2)cc1Cl ZINC000840779930 1029273242 /nfs/dbraw/zinc/27/32/42/1029273242.db2.gz PMEXHAPQXYACIG-ZDUSSCGKSA-N 2 0 329.831 4.156 20 0 EIADRP CC(C)CC[NH+]1CCC([NH2+][C@@H]2CCO[C@@H](c3cccs3)C2)CC1 ZINC000926536925 1029326264 /nfs/dbraw/zinc/32/62/64/1029326264.db2.gz INYXHSYBUGPLMC-QZTJIDSGSA-N 2 0 336.545 4.068 20 0 EIADRP C/C(=C\c1ccccc1OC(F)F)CN(C)CCC[NH+]1CCCC1 ZINC000583903650 1029347590 /nfs/dbraw/zinc/34/75/90/1029347590.db2.gz DZCRQPYMOXEXGJ-JQIJEIRASA-N 2 0 338.442 4.109 20 0 EIADRP CCC[N@H+](C1CCOCC1)C1C[C@H](C)N(Cc2ccccc2)[C@@H](C)C1 ZINC001168059633 1029437932 /nfs/dbraw/zinc/43/79/32/1029437932.db2.gz USQPLUTXAFCUSS-OALUTQOASA-N 2 0 344.543 4.319 20 0 EIADRP Clc1cc2cccnc2c(C[NH2+]CC2CC[NH+](CC3CC3)CC2)c1 ZINC000657812381 1029444541 /nfs/dbraw/zinc/44/45/41/1029444541.db2.gz AGSAAVBOYIXTDM-UHFFFAOYSA-N 2 0 343.902 4.100 20 0 EIADRP c1cc(-c2nc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)cs2)cs1 ZINC000657811884 1029459460 /nfs/dbraw/zinc/45/94/60/1029459460.db2.gz JEMGZPAOAPHEHY-UHFFFAOYSA-N 2 0 347.553 4.083 20 0 EIADRP c1nc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)sc1-c1ccccc1 ZINC000657813249 1029467430 /nfs/dbraw/zinc/46/74/30/1029467430.db2.gz LTTMAHPFNGIABZ-UHFFFAOYSA-N 2 0 341.524 4.022 20 0 EIADRP c1[nH]c2ccccc2c1CC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000151306075 1029472729 /nfs/dbraw/zinc/47/27/29/1029472729.db2.gz XJIIHYHODCDHAX-UHFFFAOYSA-N 2 0 325.500 4.097 20 0 EIADRP c1ccc(N2CCC([NH2+]C3CC[NH+](C4CCCCC4)CC3)CC2)cc1 ZINC000132718125 1029503045 /nfs/dbraw/zinc/50/30/45/1029503045.db2.gz ZOAJEAKGOKQQGY-UHFFFAOYSA-N 2 0 341.543 4.042 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H](c2ccccc2)c2ccc3ccccc3n2)C1 ZINC000584047451 1029566268 /nfs/dbraw/zinc/56/62/68/1029566268.db2.gz AGWTUCCHIUINKR-XTQVGHSUSA-N 2 0 345.490 4.431 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cc2cnccc2o1 ZINC000657824646 1029584568 /nfs/dbraw/zinc/58/45/68/1029584568.db2.gz SBDGUXBBBJYWHE-INIZCTEOSA-N 2 0 335.451 4.274 20 0 EIADRP CCO[C@H](C[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1)c1ccccc1 ZINC000446852779 1029603471 /nfs/dbraw/zinc/60/34/71/1029603471.db2.gz QWVCEESGFMOVEZ-BVYCBKJFSA-N 2 0 344.543 4.397 20 0 EIADRP CCO[C@H](C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1)c1ccccc1 ZINC000446852781 1029603736 /nfs/dbraw/zinc/60/37/36/1029603736.db2.gz QWVCEESGFMOVEZ-VLCRHTCISA-N 2 0 344.543 4.397 20 0 EIADRP CCC[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccccn1 ZINC000158890051 1029616808 /nfs/dbraw/zinc/61/68/08/1029616808.db2.gz OTSJBYSSJHGYOE-IBGZPJMESA-N 2 0 343.540 4.486 20 0 EIADRP C[N@H+](CCCSc1ccccc1Cl)C[C@H]1CCC[NH+](C)C1 ZINC000525488187 1029653171 /nfs/dbraw/zinc/65/31/71/1029653171.db2.gz FQMHIYUCKRRMEV-HNNXBMFYSA-N 2 0 326.937 4.096 20 0 EIADRP Cc1ccc(C[N@H+]2CC[C@H](CN(C)Cc3cccc(F)c3)C2)s1 ZINC000584259149 1029698283 /nfs/dbraw/zinc/69/82/83/1029698283.db2.gz YOSSQWDXGFTCOD-QGZVFWFLSA-N 2 0 332.488 4.150 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CCC(C(F)F)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168065796 1029711860 /nfs/dbraw/zinc/71/18/60/1029711860.db2.gz YGDUHVALNFCFQE-HGKCTWBKSA-N 2 0 336.470 4.405 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1CNCc1ccc(Cl)cc1F ZINC000708519308 1029743505 /nfs/dbraw/zinc/74/35/05/1029743505.db2.gz HNRPWTURFWUPRO-QAPCUYQASA-N 2 0 346.877 4.337 20 0 EIADRP Cc1cc(N2CCC[C@H]([NH+]3CCCC3)CC2)c2cc(F)ccc2[nH+]1 ZINC000301642631 1029779088 /nfs/dbraw/zinc/77/90/88/1029779088.db2.gz BUKAOCLZKFURPH-KRWDZBQOSA-N 2 0 327.447 4.137 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1cc2cnccc2o1 ZINC000657851749 1029792190 /nfs/dbraw/zinc/79/21/90/1029792190.db2.gz QZLOALMLENDVSV-KRWDZBQOSA-N 2 0 349.478 4.391 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)C1CCOCC1 ZINC000584380788 1029794142 /nfs/dbraw/zinc/79/41/42/1029794142.db2.gz SDKIMIKXQCNPAK-UNMCSNQZSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNCc1ccc(F)cc1Cl ZINC000708523246 1029813168 /nfs/dbraw/zinc/81/31/68/1029813168.db2.gz LNYFQECPRRPPNA-CRAIPNDOSA-N 2 0 346.877 4.337 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCc2ccc(F)cc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000089552504 1029854743 /nfs/dbraw/zinc/85/47/43/1029854743.db2.gz BKFSJGVMIRCNBW-QVKFZJNVSA-N 2 0 342.458 4.104 20 0 EIADRP C[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc3occc3c2)[C@H]1c1cccs1 ZINC000375751890 1029864755 /nfs/dbraw/zinc/86/47/55/1029864755.db2.gz YBYZZMBGUXNQDJ-LPHOPBHVSA-N 2 0 326.465 4.277 20 0 EIADRP Cc1nc2c(s1)[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C3CCC3)C1)CCC2 ZINC000183187796 1029992903 /nfs/dbraw/zinc/99/29/03/1029992903.db2.gz DHDHOQQKKDMISZ-UNEWFSDZSA-N 2 0 333.545 4.072 20 0 EIADRP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000657875702 1030144408 /nfs/dbraw/zinc/14/44/08/1030144408.db2.gz HSGZOLSWTBAQGI-TZMCWYRMSA-N 2 0 348.840 4.221 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(C(F)F)nc1 ZINC000657876413 1030150657 /nfs/dbraw/zinc/15/06/57/1030150657.db2.gz BLBRZLTYARHMPN-HNNXBMFYSA-N 2 0 325.447 4.326 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccccc1OC(F)F ZINC000447582807 1030180517 /nfs/dbraw/zinc/18/05/17/1030180517.db2.gz YMFSKJCVYUMSLW-KRWDZBQOSA-N 2 0 338.442 4.203 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@@H](c2cccnc2)C2CC2)C3)cc1 ZINC000447588807 1030189539 /nfs/dbraw/zinc/18/95/39/1030189539.db2.gz VNTDPFGVYHXBDI-KAOXLYBCSA-N 2 0 347.506 4.318 20 0 EIADRP C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000261895241 1030259481 /nfs/dbraw/zinc/25/94/81/1030259481.db2.gz OFRPEUBQQFGASB-ZIAGYGMSSA-N 2 0 326.406 4.230 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2ccc(F)c(F)c2)CC1 ZINC000530329385 1030318741 /nfs/dbraw/zinc/31/87/41/1030318741.db2.gz XQBLYLKXRKAWKH-FOIQADDNSA-N 2 0 336.470 4.140 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+]CCCc2c(F)cccc2Cl)CC1 ZINC000447816974 1030339024 /nfs/dbraw/zinc/33/90/24/1030339024.db2.gz LWRUGYKHWZFIFA-UHFFFAOYSA-N 2 0 326.887 4.122 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cnn(C(C)(C)C)c2)CC1)CC(C)C ZINC000685462626 1030341226 /nfs/dbraw/zinc/34/12/26/1030341226.db2.gz KIUHCPWYYBROTH-UHFFFAOYSA-N 2 0 348.579 4.218 20 0 EIADRP FCC1CC[NH+](Cc2cccc(C[NH+]3CCC(CF)CC3)c2)CC1 ZINC000451390839 1030448100 /nfs/dbraw/zinc/44/81/00/1030448100.db2.gz DYRXSLSOPADXFP-UHFFFAOYSA-N 2 0 336.470 4.050 20 0 EIADRP C[C@H]([NH2+]CCc1cncn1C)c1ccc(SC2CCCC2)cc1 ZINC000530513343 1030504450 /nfs/dbraw/zinc/50/44/50/1030504450.db2.gz KTTQZBSUDMGVNK-HNNXBMFYSA-N 2 0 329.513 4.348 20 0 EIADRP Cc1cccc(N2CCC([NH2+][C@H](C)c3csc(Cl)c3)CC2)n1 ZINC000191294213 1030612996 /nfs/dbraw/zinc/61/29/96/1030612996.db2.gz PSTRRBJXAQVFRH-CYBMUJFWSA-N 2 0 335.904 4.425 20 0 EIADRP Cc1cccc(N2CCC([NH2+][C@@H](C)c3csc(Cl)c3)CC2)n1 ZINC000191294199 1030613500 /nfs/dbraw/zinc/61/35/00/1030613500.db2.gz PSTRRBJXAQVFRH-ZDUSSCGKSA-N 2 0 335.904 4.425 20 0 EIADRP C[C@H]([NH2+][C@H]1CCN(Cc2ccccn2)C[C@@H]1C)c1csc(Cl)c1 ZINC000191293576 1030614045 /nfs/dbraw/zinc/61/40/45/1030614045.db2.gz LHOQCNUIDXFBKL-ZQIUZPCESA-N 2 0 349.931 4.358 20 0 EIADRP Cc1c([C@H](C)NC2CC[NH+](C3CCCCC3)CC2)cnn1C(C)(C)C ZINC000191325779 1030617298 /nfs/dbraw/zinc/61/72/98/1030617298.db2.gz JLNLOWYSWRGGMH-INIZCTEOSA-N 2 0 346.563 4.394 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccc2cc[nH]c21 ZINC000398167213 1030720875 /nfs/dbraw/zinc/72/08/75/1030720875.db2.gz TZNXXSQHOVWSQK-LAUBAEHRSA-N 2 0 333.479 4.168 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccccc2C[N@H+]2C[C@H](C)C[C@H](C)C2)ccn1 ZINC000527638343 1030790889 /nfs/dbraw/zinc/79/08/89/1030790889.db2.gz RNGBVEOONOGZMQ-HDICACEKSA-N 2 0 337.511 4.158 20 0 EIADRP CC[C@@H]([NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C)c1cc(C)ccc1C ZINC000527817923 1030859714 /nfs/dbraw/zinc/85/97/14/1030859714.db2.gz DWXCKOHRESJVCN-OAQYLSRUSA-N 2 0 334.467 4.433 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cccs1 ZINC000658164387 1030861473 /nfs/dbraw/zinc/86/14/73/1030861473.db2.gz CTXAMLYQIWBWJF-SFHVURJKSA-N 2 0 329.513 4.096 20 0 EIADRP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658165412 1030861941 /nfs/dbraw/zinc/86/19/41/1030861941.db2.gz JJXMOPFVKZXLCA-XMSQKQJNSA-N 2 0 349.522 4.440 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H](c1cccc(C)c1)C(C)C ZINC000527806802 1030865870 /nfs/dbraw/zinc/86/58/70/1030865870.db2.gz AXHKJCBSVLGUSH-NRFANRHFSA-N 2 0 334.467 4.371 20 0 EIADRP Cc1cccc([C@H]([NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)C(C)C)c1 ZINC000527874636 1030889877 /nfs/dbraw/zinc/88/98/77/1030889877.db2.gz XIKGNLLSGSCFIK-YPAWHYETSA-N 2 0 344.543 4.050 20 0 EIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]CC(C1CCC1)C1CCC1 ZINC000527925278 1030922975 /nfs/dbraw/zinc/92/29/75/1030922975.db2.gz MDNBYPWATRRAJK-VGOFRKELSA-N 2 0 341.543 4.098 20 0 EIADRP CC1(C)[C@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1(F)F ZINC000658280749 1030938539 /nfs/dbraw/zinc/93/85/39/1030938539.db2.gz LCKZLVROWVDLOO-FJIDUMEYSA-N 2 0 334.454 4.063 20 0 EIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+][C@H]3CCCSCC3)C3(CCC3)C2)cc1 ZINC000658318855 1030980326 /nfs/dbraw/zinc/98/03/26/1030980326.db2.gz SYJIGFXSIYEVLD-UXHICEINSA-N 2 0 344.568 4.164 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccncc1 ZINC000658319486 1030981787 /nfs/dbraw/zinc/98/17/87/1030981787.db2.gz CHDFHURGPJGCHJ-WIYYLYMNSA-N 2 0 335.495 4.035 20 0 EIADRP COCCC1CC[NH+](C2CCC([N@H+](C)Cc3ccccc3)CC2)CC1 ZINC000527937892 1030981634 /nfs/dbraw/zinc/98/16/34/1030981634.db2.gz VNCCKVZBWJLSNM-UHFFFAOYSA-N 2 0 344.543 4.178 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cccnc1 ZINC000658320506 1030984742 /nfs/dbraw/zinc/98/47/42/1030984742.db2.gz YWLGNKGGFLMZFN-NQIIRXRSSA-N 2 0 335.495 4.035 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1Cl ZINC000658357696 1031028915 /nfs/dbraw/zinc/02/89/15/1031028915.db2.gz VKBMJHPWYXXMJK-CQSZACIVSA-N 2 0 336.907 4.121 20 0 EIADRP C[C@@H](c1ccccc1)N1CCC([NH2+][C@H]2CCc3cccnc3CC2)CC1 ZINC000421830395 1031035978 /nfs/dbraw/zinc/03/59/78/1031035978.db2.gz JUUDDVRAZPSZLW-RXVVDRJESA-N 2 0 349.522 4.144 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccccc3)CC2)cc1 ZINC000532463513 1031121742 /nfs/dbraw/zinc/12/17/42/1031121742.db2.gz HSKPZJXNGSLONL-SFHVURJKSA-N 2 0 338.495 4.258 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)s1 ZINC000171130326 1031190860 /nfs/dbraw/zinc/19/08/60/1031190860.db2.gz ITGLLYZRZQTZSV-MRXNPFEDSA-N 2 0 332.513 4.238 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc(C)c1F ZINC000532501143 1031219257 /nfs/dbraw/zinc/21/92/57/1031219257.db2.gz LEDVSYZWURPCOB-OAHLLOKOSA-N 2 0 332.438 4.494 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccc(C)cc1OC ZINC000449067843 1031420578 /nfs/dbraw/zinc/42/05/78/1031420578.db2.gz ORWBGPVIBMQIBP-UHFFFAOYSA-N 2 0 326.484 4.135 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]C2CCC(OC3CCCC3)CC2)C1 ZINC000449081659 1031437484 /nfs/dbraw/zinc/43/74/84/1031437484.db2.gz GYUINPOQOWOMHU-JSOIOWGOSA-N 2 0 336.564 4.359 20 0 EIADRP Cc1cnc(C[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)s1 ZINC000449125486 1031460827 /nfs/dbraw/zinc/46/08/27/1031460827.db2.gz JJCJDIQMDJNJMM-UHFFFAOYSA-N 2 0 349.931 4.107 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2ncc(-c3cccc(F)c3)o2)CC1 ZINC000123356460 1031461045 /nfs/dbraw/zinc/46/10/45/1031461045.db2.gz NLYPSGCEYWVRSA-UHFFFAOYSA-N 2 0 345.462 4.035 20 0 EIADRP c1ccc(C[NH+]2CCCCCC2)c(C[NH2+][C@H]2CCOC3(CCC3)C2)c1 ZINC000449140221 1031475652 /nfs/dbraw/zinc/47/56/52/1031475652.db2.gz IIQVLFOKVJIZBE-NRFANRHFSA-N 2 0 342.527 4.254 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCCC(F)(F)F)CC1 ZINC000449169511 1031491435 /nfs/dbraw/zinc/49/14/35/1031491435.db2.gz OPFNZRJCKAMRGQ-OAHLLOKOSA-N 2 0 328.422 4.014 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCSc3ccccc32)c1 ZINC000123917552 1031493553 /nfs/dbraw/zinc/49/35/53/1031493553.db2.gz PADVWXUBIVDBNR-LJQANCHMSA-N 2 0 326.509 4.465 20 0 EIADRP CC(C)[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C1CC1 ZINC000531725019 1031527188 /nfs/dbraw/zinc/52/71/88/1031527188.db2.gz UMRHQYGJKLFRPZ-NRFANRHFSA-N 2 0 326.484 4.436 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CC(C)(C)CCCO)CC1 ZINC000449205320 1031527859 /nfs/dbraw/zinc/52/78/59/1031527859.db2.gz OAZQYOPSAMGMCZ-UHFFFAOYSA-N 2 0 326.569 4.054 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccsc1 ZINC000453098957 1031558317 /nfs/dbraw/zinc/55/83/17/1031558317.db2.gz VSSKPJJTBPCVAG-LJQANCHMSA-N 2 0 332.513 4.320 20 0 EIADRP Cc1[nH]c2ccccc2c1C1CC[NH+](CC[C@@H]2CCC[N@H+]2C)CC1 ZINC000124971863 1031562198 /nfs/dbraw/zinc/56/21/98/1031562198.db2.gz LOCHTFBFMMFGRK-SFHVURJKSA-N 2 0 325.500 4.140 20 0 EIADRP CC[C@@H](CC(F)(F)F)[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449243601 1031577813 /nfs/dbraw/zinc/57/78/13/1031577813.db2.gz LXNFBYZYFBMLNE-WBVHZDCISA-N 2 0 342.449 4.403 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]Cc2cccc3cc[nH]c32)CC1 ZINC000449271690 1031587900 /nfs/dbraw/zinc/58/79/00/1031587900.db2.gz UHNOZDJVIDZZLP-SFHVURJKSA-N 2 0 347.506 4.353 20 0 EIADRP CC[C@H]([NH2+]C1CCN(c2cccc(C)n2)CC1)c1cccc(OC)c1 ZINC000128099620 1031723024 /nfs/dbraw/zinc/72/30/24/1031723024.db2.gz ZFLCSKLAHMDQIH-FQEVSTJZSA-N 2 0 339.483 4.108 20 0 EIADRP CC[C@@H]([NH2+]C1CCN(c2cccc(C)n2)CC1)c1cccc(OC)c1 ZINC000128099847 1031724798 /nfs/dbraw/zinc/72/47/98/1031724798.db2.gz ZFLCSKLAHMDQIH-HXUWFJFHSA-N 2 0 339.483 4.108 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@H]2CCCC2(F)F)CC1 ZINC000449499634 1031807408 /nfs/dbraw/zinc/80/74/08/1031807408.db2.gz UBLTZIMEGXNGML-FUHWJXTLSA-N 2 0 336.470 4.107 20 0 EIADRP C/C=C\COc1ccc(CC[C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000449560321 1031848158 /nfs/dbraw/zinc/84/81/58/1031848158.db2.gz JJJMNEODENUPIH-XWMUGEHUSA-N 2 0 342.527 4.177 20 0 EIADRP FC1(F)CCC[C@@H]1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000453326557 1031851831 /nfs/dbraw/zinc/85/18/31/1031851831.db2.gz YIXCVSIIRZKKQN-AKHDSKFASA-N 2 0 334.454 4.207 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)C1CCOCC1 ZINC000531947150 1031859708 /nfs/dbraw/zinc/85/97/08/1031859708.db2.gz HNGSHGJGTZTUDG-AVRDEDQJSA-N 2 0 344.543 4.213 20 0 EIADRP Clc1ccc(C[C@@H]([NH2+]CCn2ccnc2)c2ccccc2)cc1 ZINC000531947978 1031860568 /nfs/dbraw/zinc/86/05/68/1031860568.db2.gz WZAQUEHAGYKKQI-LJQANCHMSA-N 2 0 325.843 4.110 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC2CC[NH+](C3CC3)CC2)cc1 ZINC000459344584 1031863839 /nfs/dbraw/zinc/86/38/39/1031863839.db2.gz NXZKXOZBZHKYNV-QGZVFWFLSA-N 2 0 327.516 4.100 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccccc2C(F)(F)F)C1 ZINC000531958972 1031878894 /nfs/dbraw/zinc/87/88/94/1031878894.db2.gz HCMKGAVIKAHKPO-LSDHHAIUSA-N 2 0 328.422 4.476 20 0 EIADRP COc1cccc([C@H]2C[C@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)c1 ZINC000449618127 1031880732 /nfs/dbraw/zinc/88/07/32/1031880732.db2.gz KDPYQAKARBJCQC-KESTWPANSA-N 2 0 342.527 4.328 20 0 EIADRP CC[NH+](CC)C[C@H]1CCCC[C@H]1[NH2+]C1CCN(c2ccccc2)CC1 ZINC000531979745 1031922110 /nfs/dbraw/zinc/92/21/10/1031922110.db2.gz OPTABOOIXBGRHC-DENIHFKCSA-N 2 0 343.559 4.146 20 0 EIADRP COc1ccc([C@@H]([NH2+]CCCC[N@H+](C)C2CC2)c2ccccc2)cc1 ZINC000453399779 1031933724 /nfs/dbraw/zinc/93/37/24/1031933724.db2.gz LIZGDZMFEWGWAD-QFIPXVFZSA-N 2 0 338.495 4.249 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCC2CC(F)(F)C2)CC1 ZINC000453408532 1031944722 /nfs/dbraw/zinc/94/47/22/1031944722.db2.gz GYEDELFGNVQUSY-MRXNPFEDSA-N 2 0 336.470 4.107 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCC2CC(F)(F)C2)CC1 ZINC000453408531 1031945324 /nfs/dbraw/zinc/94/53/24/1031945324.db2.gz GYEDELFGNVQUSY-INIZCTEOSA-N 2 0 336.470 4.107 20 0 EIADRP CCOc1cccc2cc([C@H](C)[NH2+]CCCC[N@H+](C)C3CC3)oc21 ZINC000453417535 1031951603 /nfs/dbraw/zinc/95/16/03/1031951603.db2.gz XUGYKEQVGUAKCT-HNNXBMFYSA-N 2 0 330.472 4.357 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000531994305 1031962091 /nfs/dbraw/zinc/96/20/91/1031962091.db2.gz UPQSPABHJAUTHG-KNQAVFIVSA-N 2 0 344.543 4.226 20 0 EIADRP C[N@H+](CCCC[NH2+]C1CC(c2ccc(C(F)(F)F)cc2)C1)C1CC1 ZINC000453395986 1031965731 /nfs/dbraw/zinc/96/57/31/1031965731.db2.gz IJTWUAINQNWEKW-UHFFFAOYSA-N 2 0 340.433 4.415 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(Br)cc1F ZINC000453420113 1031975226 /nfs/dbraw/zinc/97/52/26/1031975226.db2.gz ZDVMRTBSCIFKOC-LBPRGKRZSA-N 2 0 343.284 4.113 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2CCOC(C)(C)C2)CC1 ZINC000453424147 1031978064 /nfs/dbraw/zinc/97/80/64/1031978064.db2.gz NIJFTUIFIMABBV-QNGMFEMESA-N 2 0 344.543 4.224 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2CCOC(C)(C)C2)CC1 ZINC000453424146 1031979354 /nfs/dbraw/zinc/97/93/54/1031979354.db2.gz NIJFTUIFIMABBV-MWXLCCTBSA-N 2 0 344.543 4.224 20 0 EIADRP C[N@H+](CCCOc1cccc2ccccc21)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000512557095 1033340813 /nfs/dbraw/zinc/34/08/13/1033340813.db2.gz LIJRRQAYUANQKE-YOFSQIOKSA-N 2 0 338.495 4.166 20 0 EIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]CC4CCSCC4)[C@H]3C2)cc1 ZINC000512612335 1033493431 /nfs/dbraw/zinc/49/34/31/1033493431.db2.gz OMBCFARABUWQKZ-ACRUOGEOSA-N 2 0 344.568 4.020 20 0 EIADRP FC1(F)CCC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000512646589 1033612869 /nfs/dbraw/zinc/61/28/69/1033612869.db2.gz BMWAUGSCCQIEGO-IYWMVGAKSA-N 2 0 348.481 4.455 20 0 EIADRP FC(F)(F)CCC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000512653432 1033620793 /nfs/dbraw/zinc/62/07/93/1033620793.db2.gz FHIFODHMDTVILA-OKZBNKHCSA-N 2 0 340.433 4.219 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000333272947 1034575194 /nfs/dbraw/zinc/57/51/94/1034575194.db2.gz KUXZVRLSFPOMMK-PMPSAXMXSA-N 2 0 345.487 4.186 20 0 EIADRP Cc1ccc([C@@H]2OCCC[C@H]2[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1 ZINC000513341440 1034889495 /nfs/dbraw/zinc/88/94/95/1034889495.db2.gz VFNUQEBZCUELAX-UXHICEINSA-N 2 0 330.516 4.068 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3c2c(F)ccc3F)c1 ZINC000513365062 1034893408 /nfs/dbraw/zinc/89/34/08/1034893408.db2.gz KFHQLTHSOYYYJE-LJQANCHMSA-N 2 0 330.422 4.194 20 0 EIADRP c1cc2c(cccc2C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)[nH]1 ZINC000513437901 1034946193 /nfs/dbraw/zinc/94/61/93/1034946193.db2.gz GROSGYUDHDQGST-SFHVURJKSA-N 2 0 325.500 4.256 20 0 EIADRP COc1cccc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000513510913 1035005476 /nfs/dbraw/zinc/00/54/76/1035005476.db2.gz GNHOOBOTGVCYPJ-GHTZIAJQSA-N 2 0 338.495 4.086 20 0 EIADRP CCc1nc(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cs1 ZINC000513546753 1035028288 /nfs/dbraw/zinc/02/82/88/1035028288.db2.gz ZPSJVNKCPWTJRS-AEFFLSMTSA-N 2 0 343.540 4.096 20 0 EIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@@H]([NH2+]C4CCSCC4)[C@@H]3C2)cc1 ZINC000513683636 1035100389 /nfs/dbraw/zinc/10/03/89/1035100389.db2.gz LUBPYKMVIWMFOB-CEWLAPEOSA-N 2 0 344.568 4.162 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000513702215 1035328249 /nfs/dbraw/zinc/32/82/49/1035328249.db2.gz GDGQLTDPUXAMAP-NVPAJSRCSA-N 2 0 328.422 4.099 20 0 EIADRP C[C@@H](c1cc(F)ccc1F)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501017326 1035350942 /nfs/dbraw/zinc/35/09/42/1035350942.db2.gz AZRDQTGDYCVLSY-HNNXBMFYSA-N 2 0 345.437 4.269 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000501427111 1035442984 /nfs/dbraw/zinc/44/29/84/1035442984.db2.gz VSRGTVVKGNWPIA-MRXNPFEDSA-N 2 0 344.449 4.028 20 0 EIADRP Cc1cc(C)c(CN(Cc2ccccn2)[C@@H]2CCC[NH2+]CC2)c(C)c1 ZINC000420315547 1035509559 /nfs/dbraw/zinc/50/95/59/1035509559.db2.gz RXONFSSLNVFCKM-OAQYLSRUSA-N 2 0 337.511 4.151 20 0 EIADRP Clc1ccc2oc(C3CC[NH+](CC[C@@H]4CCC[NH2+]C4)CC3)nc2c1 ZINC000420319206 1035514865 /nfs/dbraw/zinc/51/48/65/1035514865.db2.gz OYNSKWFMPCFRQC-AWEZNQCLSA-N 2 0 347.890 4.050 20 0 EIADRP CSCC1(CC[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000595073428 1035555758 /nfs/dbraw/zinc/55/57/58/1035555758.db2.gz SLDWDSCGUNGRBI-PKOBYXMFSA-N 2 0 332.557 4.020 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)C[C@H](C)O1 ZINC000574897712 1035577770 /nfs/dbraw/zinc/57/77/70/1035577770.db2.gz RMCCUNOQKANDSL-RMFSNUHRSA-N 2 0 330.516 4.108 20 0 EIADRP CC[N@H+](C)C[C@@H]1CCN(c2cc(C)[nH+]c3c(C)cc(Cl)cc23)C1 ZINC000485134116 1035712450 /nfs/dbraw/zinc/71/24/50/1035712450.db2.gz UZQJPPSIYSQFPC-HNNXBMFYSA-N 2 0 331.891 4.283 20 0 EIADRP C[NH+]1CCC(CC[NH2+]C(c2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000491007537 1035755288 /nfs/dbraw/zinc/75/52/88/1035755288.db2.gz OLBITNHSZZATRV-UHFFFAOYSA-N 2 0 344.449 4.376 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000491058985 1035795379 /nfs/dbraw/zinc/79/53/79/1035795379.db2.gz JNUKSVIXTXPWOM-FQEVSTJZSA-N 2 0 346.877 4.500 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@H]3CCCC(F)(F)C3)CC2)C1 ZINC000502368812 1036141847 /nfs/dbraw/zinc/14/18/47/1036141847.db2.gz GNBRFZKDVXZTAP-RYRKJORJSA-N 2 0 328.491 4.445 20 0 EIADRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000502432051 1036197406 /nfs/dbraw/zinc/19/74/06/1036197406.db2.gz CKJFUFNZIRTMAG-SIKLNZKXSA-N 2 0 344.543 4.213 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]C/C=C\c2ccccc2OC)c1 ZINC000588177807 1036283946 /nfs/dbraw/zinc/28/39/46/1036283946.db2.gz KLLWDBZWDUYXTA-LCYFTJDESA-N 2 0 338.495 4.340 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421367506 1036316653 /nfs/dbraw/zinc/31/66/53/1036316653.db2.gz DXTSHMCZMFKESK-RWBZWWBESA-N 2 0 342.449 4.489 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)CC1 ZINC000421370146 1036317823 /nfs/dbraw/zinc/31/78/23/1036317823.db2.gz JDNMZBAVCJSBNW-UHFFFAOYSA-N 2 0 334.813 4.321 20 0 EIADRP Cc1cc(F)ccc1-c1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)o1 ZINC000421372018 1036321906 /nfs/dbraw/zinc/32/19/06/1036321906.db2.gz LPEBLBOQFZVYNO-UHFFFAOYSA-N 2 0 330.447 4.357 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000502696679 1036510098 /nfs/dbraw/zinc/51/00/98/1036510098.db2.gz LIEJEAAXIPKRNQ-VXKWHMMOSA-N 2 0 344.543 4.357 20 0 EIADRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000502699189 1036522726 /nfs/dbraw/zinc/52/27/26/1036522726.db2.gz XMMPUJWYZLAFAR-YUXAGFNASA-N 2 0 344.543 4.356 20 0 EIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)oc1C ZINC000502707170 1036539149 /nfs/dbraw/zinc/53/91/49/1036539149.db2.gz DBHCFATWKYOYKP-KRWDZBQOSA-N 2 0 342.483 4.222 20 0 EIADRP COCC[C@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000502710994 1036568682 /nfs/dbraw/zinc/56/86/82/1036568682.db2.gz ZSXSMSZQCHJROS-DENIHFKCSA-N 2 0 344.543 4.357 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1C[C@@H]1c1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486479363 1036726540 /nfs/dbraw/zinc/72/65/40/1036726540.db2.gz VFVYEWZFCSNSIK-FDTGPBLFSA-N 2 0 334.507 4.290 20 0 EIADRP c1ccc(C[N@H+](C2CCSCC2)C2CC[NH+](CC3CC3)CC2)cc1 ZINC001168389238 1036736282 /nfs/dbraw/zinc/73/62/82/1036736282.db2.gz MAPFDGOXTGZKIF-UHFFFAOYSA-N 2 0 344.568 4.259 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3[nH]nc4ccccc43)cc2)C1 ZINC000589641196 1036857328 /nfs/dbraw/zinc/85/73/28/1036857328.db2.gz XAORUCVHJSJQRE-KRWDZBQOSA-N 2 0 348.494 4.085 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2ccc3[nH]cnc3c2)C1 ZINC000589642042 1036857587 /nfs/dbraw/zinc/85/75/87/1036857587.db2.gz ZEUMBBCITINOLJ-QGZVFWFLSA-N 2 0 348.494 4.085 20 0 EIADRP c1c2ccccc2[nH]c1C[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000589647218 1036859939 /nfs/dbraw/zinc/85/99/39/1036859939.db2.gz OEZBWGSDHCGKHD-UHFFFAOYSA-N 2 0 333.479 4.444 20 0 EIADRP CSCC[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000589726736 1036870821 /nfs/dbraw/zinc/87/08/21/1036870821.db2.gz MPUYJPMKHWGQGQ-LJQANCHMSA-N 2 0 338.536 4.332 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CCC[C@H](c2ccccc2)C1 ZINC000486859846 1036873532 /nfs/dbraw/zinc/87/35/32/1036873532.db2.gz QBXPWKDDYOIRTI-PZJWPPBQSA-N 2 0 346.478 4.392 20 0 EIADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000503081989 1036894458 /nfs/dbraw/zinc/89/44/58/1036894458.db2.gz VMUDZVNAKVSFDF-MRXNPFEDSA-N 2 0 338.948 4.381 20 0 EIADRP CC(C)c1ccc(C(C)(C)[NH2+]CCCN2CC[NH+](C(C)C)CC2)cc1 ZINC000669691252 1036913849 /nfs/dbraw/zinc/91/38/49/1036913849.db2.gz LFAFOSRHUZMPAI-UHFFFAOYSA-N 2 0 345.575 4.051 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2cnc(-c3ccco3)s2)CC1 ZINC000487265128 1037080315 /nfs/dbraw/zinc/08/03/15/1037080315.db2.gz ALQYDBUABXYCHS-UHFFFAOYSA-N 2 0 347.528 4.251 20 0 EIADRP C[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)[C@H]1CC1(C)C ZINC000487278181 1037091260 /nfs/dbraw/zinc/09/12/60/1037091260.db2.gz MJUYYNSVZYILNB-GHTZIAJQSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@@]12CC3([NH3+])CC([NH2+][C@@H]4CCc5cc(F)ccc5C4)(C1)C[C@](C)(C3)C2 ZINC001168415959 1037103934 /nfs/dbraw/zinc/10/39/34/1037103934.db2.gz ULJWOAZACYLWTD-SPQGHWSVSA-N 2 0 342.502 4.103 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)C1 ZINC000590611660 1037116588 /nfs/dbraw/zinc/11/65/88/1037116588.db2.gz QWDWCPSWLLBFCK-HXUWFJFHSA-N 2 0 347.506 4.121 20 0 EIADRP CC[C@@H](C)Oc1cc(C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)ccc1OC ZINC000590880851 1037196222 /nfs/dbraw/zinc/19/62/22/1037196222.db2.gz URZOVQNIOHPMKB-OAHLLOKOSA-N 2 0 348.531 4.271 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc2c(c1)COC2 ZINC000272691537 1037269823 /nfs/dbraw/zinc/26/98/23/1037269823.db2.gz PQQGJUYLHSHXRI-XYJFISCASA-N 2 0 328.500 4.020 20 0 EIADRP Cc1cnc([C@H](C)C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000273508580 1037486883 /nfs/dbraw/zinc/48/68/83/1037486883.db2.gz ZZDNCGACKAIKLA-GJYPPUQNSA-N 2 0 343.540 4.055 20 0 EIADRP C[C@@H](c1ccc(OC(F)F)cc1)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000488313489 1037502928 /nfs/dbraw/zinc/50/29/28/1037502928.db2.gz VACAMYGQOWLIJK-HNNXBMFYSA-N 2 0 338.442 4.157 20 0 EIADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC000488376851 1037552610 /nfs/dbraw/zinc/55/26/10/1037552610.db2.gz PSDMMJPSXWXXKA-HNNXBMFYSA-N 2 0 340.458 4.403 20 0 EIADRP CCC[NH+]1CCC(C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)CC1 ZINC000591707741 1037554508 /nfs/dbraw/zinc/55/45/08/1037554508.db2.gz ONTMRRJDQLMUSB-UHFFFAOYSA-N 2 0 330.447 4.297 20 0 EIADRP CC(C)(C)[C@H]1C[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)CS1 ZINC000488402698 1037569770 /nfs/dbraw/zinc/56/97/70/1037569770.db2.gz CCLXYXWUIVPESY-RTBURBONSA-N 2 0 332.557 4.292 20 0 EIADRP c1c2ccccc2oc1CNC[C@@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000488514662 1037642191 /nfs/dbraw/zinc/64/21/91/1037642191.db2.gz NSHFXKBSPKWZMM-IBGZPJMESA-N 2 0 334.463 4.087 20 0 EIADRP Fc1ccc2c(c1)CC[C@H]([NH2+]C1CC[NH+](C[C@@H]3CC=CCC3)CC1)C2 ZINC001168420170 1037720302 /nfs/dbraw/zinc/72/03/02/1037720302.db2.gz JTBWVIILSAUBRS-VGSWGCGISA-N 2 0 342.502 4.093 20 0 EIADRP CC[NH2+]CC1CC[NH+](Cc2ccc(-c3ccccc3OC)cc2)CC1 ZINC000414666363 1037731201 /nfs/dbraw/zinc/73/12/01/1037731201.db2.gz WRZQWWVTNIEICG-UHFFFAOYSA-N 2 0 338.495 4.184 20 0 EIADRP [NH3+][C@@H]1C[C@H]([NH2+]CCc2c[nH]c3c2cccc3Cl)c2ccccc21 ZINC000629555789 1037763798 /nfs/dbraw/zinc/76/37/98/1037763798.db2.gz DZNFFOGHNKMTOU-MSOLQXFVSA-N 2 0 325.843 4.098 20 0 EIADRP Cc1ccccc1[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)C1CC1 ZINC000422711913 1037805143 /nfs/dbraw/zinc/80/51/43/1037805143.db2.gz NJWNRHFFIJSOLT-MDNUFGMLSA-N 2 0 348.490 4.292 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC(C)(C)c1ccccc1Cl ZINC000422719292 1037812775 /nfs/dbraw/zinc/81/27/75/1037812775.db2.gz YJCUYEVEZSSYSU-ZDUSSCGKSA-N 2 0 331.891 4.131 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCc1cc(Cl)cc(Cl)c1 ZINC000422715731 1037813992 /nfs/dbraw/zinc/81/39/92/1037813992.db2.gz MNRWCIOGHJOVNV-NSHDSACASA-N 2 0 338.282 4.049 20 0 EIADRP CC1CC[NH+](Cc2cccc(CN[C@H]3C[C@H]([NH3+])c4ccccc43)c2)CC1 ZINC000422745041 1037822440 /nfs/dbraw/zinc/82/24/40/1037822440.db2.gz ULQQAESAYUWCMU-GOTSBHOMSA-N 2 0 349.522 4.153 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C1CCC(C[NH3+])CC1 ZINC000422746409 1037824311 /nfs/dbraw/zinc/82/43/11/1037824311.db2.gz WKFISOISTIQTLJ-RFSCMCKOSA-N 2 0 347.503 4.426 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC1(c2cccs2)CCCCC1 ZINC000422751751 1037825207 /nfs/dbraw/zinc/82/52/07/1037825207.db2.gz ACJSUGRFBIKKMS-HNNXBMFYSA-N 2 0 343.540 4.463 20 0 EIADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCCCSc1ccccc1Br ZINC000422750229 1037825349 /nfs/dbraw/zinc/82/53/49/1037825349.db2.gz CLQMNMQXPMHHBC-QWHCGFSZSA-N 2 0 345.350 4.037 20 0 EIADRP CCC[C@@H](CCc1ccccc1)[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422783682 1037832535 /nfs/dbraw/zinc/83/25/35/1037832535.db2.gz OQVBGFXHUUCMSH-LPHOPBHVSA-N 2 0 325.500 4.301 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@H+](C)C[C@@H]1CC[NH2+][C@H](C)C1 ZINC000414690882 1037832913 /nfs/dbraw/zinc/83/29/13/1037832913.db2.gz AXIFKXRPEDTUOG-HYVNUMGLSA-N 2 0 343.540 4.499 20 0 EIADRP CCC[C@H](CCc1ccccc1)[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422783683 1037833008 /nfs/dbraw/zinc/83/30/08/1037833008.db2.gz OQVBGFXHUUCMSH-QFBILLFUSA-N 2 0 325.500 4.301 20 0 EIADRP CCC[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1 ZINC000422765896 1037835028 /nfs/dbraw/zinc/83/50/28/1037835028.db2.gz PRRYTCUECHCNKI-JAXLGGSGSA-N 2 0 336.479 4.373 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c(C)s1 ZINC000422808551 1037838529 /nfs/dbraw/zinc/83/85/29/1037838529.db2.gz OJLLKCGUGLPRQZ-DCPHZVHLSA-N 2 0 342.508 4.271 20 0 EIADRP C[C@@H]1C[C@H](C[NH+]2CCC(c3nc4cc(Cl)ccc4o3)CC2)CC[NH2+]1 ZINC000414694043 1037838835 /nfs/dbraw/zinc/83/88/35/1037838835.db2.gz CRBSWYNSKVXEEU-ZIAGYGMSSA-N 2 0 347.890 4.049 20 0 EIADRP COc1ccccc1[C@@H](CC(C)C)[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422825936 1037841598 /nfs/dbraw/zinc/84/15/98/1037841598.db2.gz QFLMOVBVDAIJPA-OXJNMPFZSA-N 2 0 341.499 4.295 20 0 EIADRP C[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422828164 1037842392 /nfs/dbraw/zinc/84/23/92/1037842392.db2.gz TVAVFOBSVIOKFU-SXMNSQCDSA-N 2 0 336.479 4.024 20 0 EIADRP CC[C@H](C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C)Oc1ccccc1Cl ZINC000422838308 1037843891 /nfs/dbraw/zinc/84/38/91/1037843891.db2.gz ODKPFABYASNVQU-CZUORRHYSA-N 2 0 347.890 4.010 20 0 EIADRP FC(F)(F)[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000422820209 1037845390 /nfs/dbraw/zinc/84/53/90/1037845390.db2.gz PLLDBVLUUZSIPD-ZHCJQAHYSA-N 2 0 332.454 4.256 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CN[C@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000422863319 1037848717 /nfs/dbraw/zinc/84/87/17/1037848717.db2.gz OOGSDHXIGRQNMG-VSDWSMLSSA-N 2 0 349.522 4.295 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000422863233 1037849587 /nfs/dbraw/zinc/84/95/87/1037849587.db2.gz RJVNQIDYGIVBLD-GDBMZVCRSA-N 2 0 329.513 4.295 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCc1ccc(C(C)(C)C)cc1 ZINC000422845858 1037850173 /nfs/dbraw/zinc/85/01/73/1037850173.db2.gz OXBJBLBVLNDXTA-HNNXBMFYSA-N 2 0 325.500 4.040 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1cccc(OC(C)C)c1 ZINC000422886715 1037854421 /nfs/dbraw/zinc/85/44/21/1037854421.db2.gz XFOGUDIKXRNXHB-CABCVRRESA-N 2 0 327.472 4.048 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(OC(C)C)cc1 ZINC000422888637 1037855568 /nfs/dbraw/zinc/85/55/68/1037855568.db2.gz DIJYGPWKMWAEBA-LSDHHAIUSA-N 2 0 327.472 4.048 20 0 EIADRP CC(C)c1ccc(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422874717 1037860257 /nfs/dbraw/zinc/86/02/57/1037860257.db2.gz ASPAXCHLLICOHO-IFMALSPDSA-N 2 0 336.479 4.156 20 0 EIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000422898143 1037861934 /nfs/dbraw/zinc/86/19/34/1037861934.db2.gz DJFMGKWOFATKOO-HZEGPAAWSA-N 2 0 330.516 4.055 20 0 EIADRP Cc1cc(C)cc([C@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422891483 1037869105 /nfs/dbraw/zinc/86/91/05/1037869105.db2.gz VKPCHDXDGVPKFG-XJABCFGWSA-N 2 0 336.479 4.210 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](COc1ccccc1F)c1ccccc1 ZINC000422940953 1037875834 /nfs/dbraw/zinc/87/58/34/1037875834.db2.gz UJZXBAXFFUNKJA-VQIMIIECSA-N 2 0 330.447 4.053 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422943315 1037878582 /nfs/dbraw/zinc/87/85/82/1037878582.db2.gz XXUHGGFXEGLGRK-QIXHYMPYSA-N 2 0 327.497 4.052 20 0 EIADRP c1cc(OC2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1 ZINC000422946882 1037884367 /nfs/dbraw/zinc/88/43/67/1037884367.db2.gz PQJBYDREJBWYIK-NJDAHSKKSA-N 2 0 328.500 4.018 20 0 EIADRP CC[C@H](C[N@H+](Cc1ccccn1)[C@H]1CCC[NH2+]CC1)c1ccccc1 ZINC000414706126 1037886812 /nfs/dbraw/zinc/88/68/12/1037886812.db2.gz AABSGHUCWCBEAR-KNQAVFIVSA-N 2 0 337.511 4.220 20 0 EIADRP CC[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cccs1 ZINC000422949949 1037887296 /nfs/dbraw/zinc/88/72/96/1037887296.db2.gz VBLGWQYNYIYOFX-FRQCXROJSA-N 2 0 328.481 4.045 20 0 EIADRP CCC[C@H]([NH2+][C@@H](CCC[NH3+])COC)c1ccc(Cl)c(Cl)c1 ZINC000422958600 1037888883 /nfs/dbraw/zinc/88/88/83/1037888883.db2.gz YKJXXQPHWFZGNB-BBRMVZONSA-N 2 0 333.303 4.178 20 0 EIADRP C[C@@H]1Cc2cc(-c3ccc(C[NH2+]C4C[C@H]5CC[C@@H](C4)[NH2+]5)cc3)ccc2O1 ZINC000423012747 1037899162 /nfs/dbraw/zinc/89/91/62/1037899162.db2.gz LHMNXEGMMFDXON-BFTULFPGSA-N 2 0 348.490 4.050 20 0 EIADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+]CCc1csc(-c2ccc(Cl)cc2)n1 ZINC000423017591 1037902854 /nfs/dbraw/zinc/90/28/54/1037902854.db2.gz WSUGXIOHQFMPCH-IRXDYDNUSA-N 2 0 349.931 4.256 20 0 EIADRP C([NH2+][C@@H]1CCOC[C@H]1[C@@H]1CCC[NH2+]1)C1(C2CCCCC2)CCCCC1 ZINC000423022256 1037907109 /nfs/dbraw/zinc/90/71/09/1037907109.db2.gz HHALDIFTVBSXMA-PCCBWWKXSA-N 2 0 348.575 4.264 20 0 EIADRP Fc1ccc(C2(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)CC2)c(Cl)c1 ZINC000423030292 1037911619 /nfs/dbraw/zinc/91/16/19/1037911619.db2.gz WACDWJGHESASGW-JCGIZDLHSA-N 2 0 336.882 4.021 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H]1CCCOc2c(Cl)cccc21 ZINC000423035792 1037921639 /nfs/dbraw/zinc/92/16/39/1037921639.db2.gz ZGZJIJROBQNUGC-SCLBCKFNSA-N 2 0 345.874 4.067 20 0 EIADRP [NH3+][C@@H]1C[C@H]([NH+]2CCC(Cc3ccc(F)c(F)c3)CC2)c2ccccc21 ZINC000423046144 1037926567 /nfs/dbraw/zinc/92/65/67/1037926567.db2.gz DVOSYYNFBAAURW-RTWAWAEBSA-N 2 0 342.433 4.364 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000423063297 1037928451 /nfs/dbraw/zinc/92/84/51/1037928451.db2.gz OPBKZGOSZIAIAN-ZWNOBZJWSA-N 2 0 342.327 4.416 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1Cl ZINC000423069867 1037931999 /nfs/dbraw/zinc/93/19/99/1037931999.db2.gz FENXJWULJPDBFY-LXGCGDOSSA-N 2 0 342.870 4.247 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000423052580 1037936110 /nfs/dbraw/zinc/93/61/10/1037936110.db2.gz QURWDBVKJCCWAS-SWLSCSKDSA-N 2 0 333.476 4.044 20 0 EIADRP [NH3+][C@@H]1C[C@H]([NH2+]CC2(CCOCc3ccccc3)CC2)c2ccccc21 ZINC000423054526 1037942447 /nfs/dbraw/zinc/94/24/47/1037942447.db2.gz USCMEPFRRCXFHK-RTWAWAEBSA-N 2 0 336.479 4.108 20 0 EIADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000423087598 1037949179 /nfs/dbraw/zinc/94/91/79/1037949179.db2.gz PYDOCJKNCVBRGD-MTOHEIAKSA-N 2 0 326.459 4.010 20 0 EIADRP FC1(c2cccc(Cl)c2)CC([NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)C1 ZINC000423095832 1037952417 /nfs/dbraw/zinc/95/24/17/1037952417.db2.gz NEAFSVDJRHBSFR-MCCVISLTSA-N 2 0 336.882 4.178 20 0 EIADRP FC1(c2cccc(Cl)c2)CC([NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000423095833 1037954278 /nfs/dbraw/zinc/95/42/78/1037954278.db2.gz NEAFSVDJRHBSFR-MWXXRFSMSA-N 2 0 336.882 4.178 20 0 EIADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000423092029 1037955103 /nfs/dbraw/zinc/95/51/03/1037955103.db2.gz AGAWQGSOEJUFCY-DZUCGIPZSA-N 2 0 326.406 4.201 20 0 EIADRP Fc1cc(F)cc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)C2)c1 ZINC000423098298 1037958617 /nfs/dbraw/zinc/95/86/17/1037958617.db2.gz SALGPRMYZOHUGD-MRBRGOBGSA-N 2 0 334.454 4.111 20 0 EIADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]C[C@@H](OCC1CC1)c1ccc(Cl)cc1 ZINC000423107707 1037981599 /nfs/dbraw/zinc/98/15/99/1037981599.db2.gz QBBBNQWTQFSEFG-GUDVDZBRSA-N 2 0 336.907 4.057 20 0 EIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H]3CCCC[C@H]3OC(F)F)CC2)C1 ZINC000503919234 1037996545 /nfs/dbraw/zinc/99/65/45/1037996545.db2.gz FUWJOMXSGYWPGO-DZOHQFGASA-N 2 0 344.490 4.170 20 0 EIADRP Cc1sc(C2([NH2+][C@H](C)CCC[NH3+])CCC2)nc1-c1ccccc1F ZINC000423145077 1038000031 /nfs/dbraw/zinc/00/00/31/1038000031.db2.gz IZVKFLUUIFOWOB-CYBMUJFWSA-N 2 0 347.503 4.354 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+]CC(C)(C)c1ccc(Br)cc1Cl ZINC000423139577 1038014112 /nfs/dbraw/zinc/01/41/12/1038014112.db2.gz VODZIKUCNXZLNM-LLVKDONJSA-N 2 0 347.728 4.097 20 0 EIADRP C[C@H]([NH3+])C[C@H](C)[NH2+][C@H](Cc1ccccc1)c1nc2ccccc2s1 ZINC000423161425 1038020343 /nfs/dbraw/zinc/02/03/43/1038020343.db2.gz NUOPIZKFCWISOP-RLFYNMQTSA-N 2 0 339.508 4.296 20 0 EIADRP Cc1ccc(C[N@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)s1 ZINC000414721885 1038022955 /nfs/dbraw/zinc/02/29/55/1038022955.db2.gz JMUHRKYHQMZKDT-KRWDZBQOSA-N 2 0 332.538 4.262 20 0 EIADRP Clc1ccccc1C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cccs1 ZINC000423206061 1038034191 /nfs/dbraw/zinc/03/41/91/1038034191.db2.gz FRVBLFLVIUIHPP-PBHICJAKSA-N 2 0 334.916 4.275 20 0 EIADRP Fc1cc(F)cc(C[N@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)c1 ZINC000414724797 1038069295 /nfs/dbraw/zinc/06/92/95/1038069295.db2.gz SZSVJKLYMUQWMA-SFHVURJKSA-N 2 0 348.462 4.171 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423244929 1038077200 /nfs/dbraw/zinc/07/72/00/1038077200.db2.gz HYSSCFKCIHTVPR-DLBZAZTESA-N 2 0 342.458 4.055 20 0 EIADRP Clc1ccccc1C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccsc1 ZINC000423243881 1038077580 /nfs/dbraw/zinc/07/75/80/1038077580.db2.gz GSOKLPGHRYLRNH-KDOFPFPSSA-N 2 0 334.916 4.275 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@@H]1CCCC[C@H]1C[NH3+] ZINC000423283849 1038091150 /nfs/dbraw/zinc/09/11/50/1038091150.db2.gz WKSUOUXPACOURO-JCGIZDLHSA-N 2 0 343.540 4.210 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1C[NH3+] ZINC000423283848 1038092678 /nfs/dbraw/zinc/09/26/78/1038092678.db2.gz WKSUOUXPACOURO-BMGDILEWSA-N 2 0 343.540 4.210 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccccc2OC(F)(F)F)cc1 ZINC000423292201 1038095493 /nfs/dbraw/zinc/09/54/93/1038095493.db2.gz LYMZQYLXUJBWKD-STQMWFEESA-N 2 0 338.373 4.456 20 0 EIADRP Cc1ccc([C@@H](C)C[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)cc1 ZINC000606471599 1038095540 /nfs/dbraw/zinc/09/55/40/1038095540.db2.gz ZEUVAKVUVGQDSL-IBGZPJMESA-N 2 0 340.511 4.219 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H](C[C@H]2CCOC2)c2ccc(F)cc2)cc1 ZINC000423292955 1038096600 /nfs/dbraw/zinc/09/66/00/1038096600.db2.gz PBRKOOZFGZIPKU-LUQKVYGDSA-N 2 0 342.458 4.103 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000423290809 1038096773 /nfs/dbraw/zinc/09/67/73/1038096773.db2.gz FODDJEPMBCTEFR-CVEARBPZSA-N 2 0 334.467 4.051 20 0 EIADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(SCC(F)F)cc1 ZINC000423318573 1038112965 /nfs/dbraw/zinc/11/29/65/1038112965.db2.gz CMTJQJBQKJWSAP-CYBMUJFWSA-N 2 0 328.472 4.084 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCCOc3c(Cl)cccc32)cc1 ZINC000423293960 1038118137 /nfs/dbraw/zinc/11/81/37/1038118137.db2.gz SPKNJKCPDDHNKB-UGSOOPFHSA-N 2 0 330.859 4.363 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cccc(Br)c2)cc1 ZINC000423294577 1038122827 /nfs/dbraw/zinc/12/28/27/1038122827.db2.gz UWYXFQVUWVNAKV-STQMWFEESA-N 2 0 333.273 4.320 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2cccc(Br)c2)cc1 ZINC000423294574 1038124233 /nfs/dbraw/zinc/12/42/33/1038124233.db2.gz UWYXFQVUWVNAKV-CHWSQXEVSA-N 2 0 333.273 4.320 20 0 EIADRP C[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000423346316 1038138172 /nfs/dbraw/zinc/13/81/72/1038138172.db2.gz ZTWXCWYMBJDKJE-CYBMUJFWSA-N 2 0 346.462 4.381 20 0 EIADRP [NH3+]CCCC[NH2+][C@@H](c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 ZINC000423328683 1038142381 /nfs/dbraw/zinc/14/23/81/1038142381.db2.gz OCQCSQASTVDNBY-QGZVFWFLSA-N 2 0 340.364 4.262 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423361256 1038175614 /nfs/dbraw/zinc/17/56/14/1038175614.db2.gz AAPQQHJPILMACV-ZRGWGRIASA-N 2 0 328.431 4.267 20 0 EIADRP CC[C@H]([NH2+]CC1(COC)CC[NH2+]CC1)c1ccc(Cl)cc1Cl ZINC000423378525 1038189885 /nfs/dbraw/zinc/18/98/85/1038189885.db2.gz CFTXDWGGQDJZLB-INIZCTEOSA-N 2 0 345.314 4.050 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C2CCC(c3cccc(C(F)(F)F)c3)CC2)CC[NH2+]1 ZINC000423377837 1038190647 /nfs/dbraw/zinc/19/06/47/1038190647.db2.gz KNWHUARWQYUTEW-QQOVODFUSA-N 2 0 340.433 4.462 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H](Cc2ccccc2Cl)c2cccs2)CC[NH2+]1 ZINC000423388615 1038198914 /nfs/dbraw/zinc/19/89/14/1038198914.db2.gz UHGDEOHQTGUAOI-FRFSOERESA-N 2 0 334.916 4.415 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2ccccc2Cl)c2cccs2)CC[NH2+]1 ZINC000423388616 1038199716 /nfs/dbraw/zinc/19/97/16/1038199716.db2.gz UHGDEOHQTGUAOI-KMFMINBZSA-N 2 0 334.916 4.415 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](c1ccc(Br)s1)C1CC1 ZINC000423425094 1038211071 /nfs/dbraw/zinc/21/10/71/1038211071.db2.gz GODIAHARTIIRBH-QMTHXVAHSA-N 2 0 331.323 4.069 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccccc1OC(F)F ZINC000423425563 1038213682 /nfs/dbraw/zinc/21/36/82/1038213682.db2.gz OGYUMJSFCLXUOA-DZKIICNBSA-N 2 0 326.431 4.094 20 0 EIADRP COCC1(C[NH2+][C@H](c2cc3ccccc3o2)C(C)(C)C)CC[NH2+]CC1 ZINC000423406381 1038215147 /nfs/dbraw/zinc/21/51/47/1038215147.db2.gz KOEQHMVXAACBEP-LJQANCHMSA-N 2 0 344.499 4.126 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1csc(-c2ccccc2)n1 ZINC000423418356 1038223008 /nfs/dbraw/zinc/22/30/08/1038223008.db2.gz HMMVDVYYAJMBIL-BZUAXINKSA-N 2 0 329.513 4.226 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1cc2cc(Br)ccc2o1 ZINC000423442015 1038225756 /nfs/dbraw/zinc/22/57/56/1038225756.db2.gz UQYXWHNRLVBYPL-NEPJUHHUSA-N 2 0 339.277 4.363 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000423444787 1038226191 /nfs/dbraw/zinc/22/61/91/1038226191.db2.gz MCXAKZSBEREZHE-GCJKJVERSA-N 2 0 349.522 4.045 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccc(OC(F)F)cc1 ZINC000423427491 1038230016 /nfs/dbraw/zinc/23/00/16/1038230016.db2.gz QQTNZBGGNCMLMU-CKEIUWERSA-N 2 0 326.431 4.094 20 0 EIADRP Fc1ccc(C([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)c2ccc(F)cc2)cc1 ZINC000423451684 1038230906 /nfs/dbraw/zinc/23/09/06/1038230906.db2.gz YLEDBZSCVRNZFI-VQTJNVASSA-N 2 0 342.433 4.032 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cc(F)cc(F)c1 ZINC000423460857 1038240523 /nfs/dbraw/zinc/24/05/23/1038240523.db2.gz BOISRHFKXJDRCV-ZSOFBXJNSA-N 2 0 348.412 4.148 20 0 EIADRP Cc1c([C@H](C)[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)cnn1-c1cccc(Cl)c1 ZINC000423462229 1038243623 /nfs/dbraw/zinc/24/36/23/1038243623.db2.gz DGKSLSKLYSFBCQ-JLJPHGGASA-N 2 0 346.906 4.002 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000423467915 1038244814 /nfs/dbraw/zinc/24/48/14/1038244814.db2.gz UPDCDSVKNBJSLC-UAGQMJEPSA-N 2 0 341.524 4.295 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)C1 ZINC000423499686 1038254063 /nfs/dbraw/zinc/25/40/63/1038254063.db2.gz ICMMAGCJAGHOHU-VJUNAUMWSA-N 2 0 326.406 4.059 20 0 EIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cnn(Cc2ccccc2)c1 ZINC000423498591 1038254142 /nfs/dbraw/zinc/25/41/42/1038254142.db2.gz IHASLSNIJFDTAJ-AVRDEDQJSA-N 2 0 348.494 4.062 20 0 EIADRP COC[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(Cl)cc1 ZINC000423499399 1038254383 /nfs/dbraw/zinc/25/43/83/1038254383.db2.gz AVHGZUQEQWDIAM-RBUKOAKNSA-N 2 0 332.875 4.097 20 0 EIADRP CC[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccccc1Br ZINC000423487882 1038260650 /nfs/dbraw/zinc/26/06/50/1038260650.db2.gz URGOQUVSLKEHSA-XJKSGUPXSA-N 2 0 325.294 4.022 20 0 EIADRP CC[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(OC)c(OC)c1 ZINC000423495319 1038265207 /nfs/dbraw/zinc/26/52/07/1038265207.db2.gz BQZGKSDCXPPMJJ-RTBURBONSA-N 2 0 342.483 4.225 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H](C[NH3+])C2)cc1OCCC ZINC000423492314 1038265413 /nfs/dbraw/zinc/26/54/13/1038265413.db2.gz MNIPSTQKDDDWIW-XYJFISCASA-N 2 0 334.504 4.042 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CCC[NH2+]C1CC1 ZINC000423531703 1038267380 /nfs/dbraw/zinc/26/73/80/1038267380.db2.gz TWLFJKLQQACWAG-CQSZACIVSA-N 2 0 329.513 4.220 20 0 EIADRP Cc1c([C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cnn1C(C)(C)C ZINC000423521107 1038275906 /nfs/dbraw/zinc/27/59/06/1038275906.db2.gz SDWFVKKERHJLCC-KXBFYZLASA-N 2 0 328.504 4.077 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H](Cc2ccccc2Cl)c2ccsc2)C1 ZINC000423522166 1038277975 /nfs/dbraw/zinc/27/79/75/1038277975.db2.gz XOQQEHVAMGHYKM-QBIMZIAESA-N 2 0 334.916 4.402 20 0 EIADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1cc2cc(Br)ccc2o1 ZINC000423541302 1038288357 /nfs/dbraw/zinc/28/83/57/1038288357.db2.gz RWHRISXFLSWYDR-GFCCVEGCSA-N 2 0 349.272 4.156 20 0 EIADRP FC(F)(F)c1cccc([C@H]2CCC[C@@H]2[NH2+]CCC2=CC[NH2+]CC2)c1 ZINC000423541620 1038289601 /nfs/dbraw/zinc/28/96/01/1038289601.db2.gz SLLZMWAEGCGANV-MSOLQXFVSA-N 2 0 338.417 4.241 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)C(c1ccccc1)c1ccccc1 ZINC000423548009 1038292257 /nfs/dbraw/zinc/29/22/57/1038292257.db2.gz QSUDZLBSHGEFSZ-GUGJDKNPSA-N 2 0 334.507 4.185 20 0 EIADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1cccc(OCc2ccccc2)c1 ZINC000423573656 1038297923 /nfs/dbraw/zinc/29/79/23/1038297923.db2.gz ZIYMTYJHUSFSOY-SFHVURJKSA-N 2 0 336.479 4.226 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000574749286 1038323983 /nfs/dbraw/zinc/32/39/83/1038323983.db2.gz HLTMUAQBEJPSRX-BEVDRBHNSA-N 2 0 343.902 4.126 20 0 EIADRP COc1ccc([C@H]([NH2+]CCCC[NH+](C)C)c2ccccc2Cl)cc1 ZINC000490149334 1038343927 /nfs/dbraw/zinc/34/39/27/1038343927.db2.gz IYWPCLKPKDVTNQ-FQEVSTJZSA-N 2 0 346.902 4.369 20 0 EIADRP C[C@@H]1C[C@H](C[N@@H+]2CCC[C@@H]2c2ccc(Br)s2)CC[NH2+]1 ZINC000414760292 1038351348 /nfs/dbraw/zinc/35/13/48/1038351348.db2.gz QHDJGKJAWFSZHV-JHJVBQTASA-N 2 0 343.334 4.036 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc(F)cn1 ZINC000490167388 1038365545 /nfs/dbraw/zinc/36/55/45/1038365545.db2.gz IQIKMEXWJJQZEN-GOSISDBHSA-N 2 0 347.503 4.235 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)C1 ZINC000594784440 1038400959 /nfs/dbraw/zinc/40/09/59/1038400959.db2.gz KPNCJRFUUQICNU-HXUWFJFHSA-N 2 0 347.506 4.121 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC[N@@H+]1C ZINC000608061501 1038453656 /nfs/dbraw/zinc/45/36/56/1038453656.db2.gz WIQARCLZVWEGLI-KSSFIOAISA-N 2 0 346.421 4.329 20 0 EIADRP CSC1(C[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2)CC[NH+](C)CC1 ZINC000577684485 1038459377 /nfs/dbraw/zinc/45/93/77/1038459377.db2.gz HXYREWPVDDZZLE-GFCCVEGCSA-N 2 0 347.355 4.471 20 0 EIADRP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+][C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC000608064839 1038479984 /nfs/dbraw/zinc/47/99/84/1038479984.db2.gz WPEXXMIUKUWHKG-NJDAHSKKSA-N 2 0 342.527 4.220 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(C)c(OC)c2)CC1)CC1CC1 ZINC001168424547 1038785775 /nfs/dbraw/zinc/78/57/75/1038785775.db2.gz VOOMZUZLRLNGHX-UHFFFAOYSA-N 2 0 344.543 4.338 20 0 EIADRP C[C@@H](CC[NH2+][C@H](Cc1ccncc1)c1cccs1)[NH+]1CCCCC1 ZINC000424279992 1038791445 /nfs/dbraw/zinc/79/14/45/1038791445.db2.gz LDFMJCRJYHBWOY-PKOBYXMFSA-N 2 0 343.540 4.281 20 0 EIADRP c1csc([C@@H](Cc2ccncc2)[NH2+]CCCCC[NH+]2CCCC2)c1 ZINC000424345675 1038832493 /nfs/dbraw/zinc/83/24/93/1038832493.db2.gz IIYWHWXAZXQFMN-LJQANCHMSA-N 2 0 343.540 4.283 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2nc(C)c(C)s2)CC1)CC(C)C ZINC000539097438 1038837060 /nfs/dbraw/zinc/83/70/60/1038837060.db2.gz VSGVCNILIMWJOP-UHFFFAOYSA-N 2 0 337.577 4.340 20 0 EIADRP FC(F)(F)c1ccc(C2CC[NH+](CCC[NH+]3CCCC3)CC2)cc1 ZINC000539099119 1038837554 /nfs/dbraw/zinc/83/75/54/1038837554.db2.gz WCXRCOWONQCTJS-UHFFFAOYSA-N 2 0 340.433 4.371 20 0 EIADRP Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000504895219 1038841271 /nfs/dbraw/zinc/84/12/71/1038841271.db2.gz RPSWJSRATSZUBD-LAUBAEHRSA-N 2 0 338.495 4.274 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H](C)c3c2cccc3C)[C@H](C)C1 ZINC000504921119 1038844093 /nfs/dbraw/zinc/84/40/93/1038844093.db2.gz QXKPVXUODWIJDB-IZZBFERCSA-N 2 0 344.543 4.270 20 0 EIADRP Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000504911854 1038847711 /nfs/dbraw/zinc/84/77/11/1038847711.db2.gz MTSGYTIAUAYPQQ-PXNSSMCTSA-N 2 0 338.495 4.274 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H](c2ccc(F)cc2)C2CC2)ccc1F ZINC000539200946 1038877025 /nfs/dbraw/zinc/87/70/25/1038877025.db2.gz HUWUQNGNJVAHDI-HXUWFJFHSA-N 2 0 330.422 4.267 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2cc(Cl)ccc2OC(F)F)cc1 ZINC000414801454 1038930803 /nfs/dbraw/zinc/93/08/03/1038930803.db2.gz ADQUHRZGZOZQEV-LLVKDONJSA-N 2 0 340.801 4.251 20 0 EIADRP c1ccc(CCN2CCC([NH2+][C@@H]3CC[C@H]4CCC[C@@H]4C3)CC2)cc1 ZINC000462120571 1038937391 /nfs/dbraw/zinc/93/73/91/1038937391.db2.gz UKPSHLOKUJQFIP-KCZVDYSFSA-N 2 0 326.528 4.252 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc(SCC(F)F)cc2)C1 ZINC000481040998 1038989263 /nfs/dbraw/zinc/98/92/63/1038989263.db2.gz RXZBAZFQRMVTPS-CABCVRRESA-N 2 0 342.499 4.426 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(F)c(C(F)(F)F)c2)cc1 ZINC000414810485 1039053360 /nfs/dbraw/zinc/05/33/60/1039053360.db2.gz OGDHSMLUOPCZDN-NSHDSACASA-N 2 0 326.337 4.154 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2cc(F)cc(C(F)(F)F)c2)cc1 ZINC000414810792 1039056087 /nfs/dbraw/zinc/05/60/87/1039056087.db2.gz OJEOSAVKSBPLGG-NSHDSACASA-N 2 0 326.337 4.154 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+][C@@H]2CCC[NH2+]CC2)CCC3)cc1 ZINC000643523194 1039068668 /nfs/dbraw/zinc/06/86/68/1039068668.db2.gz XHBABPNZTQOIQQ-SJORKVTESA-N 2 0 341.524 4.228 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)ccc1Br ZINC000414812825 1039076521 /nfs/dbraw/zinc/07/65/21/1039076521.db2.gz RYQWLLNLGTYEGS-ZDUSSCGKSA-N 2 0 333.273 4.067 20 0 EIADRP CSc1ccccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000481187265 1039090981 /nfs/dbraw/zinc/09/09/81/1039090981.db2.gz ZAKFLJTZFYBXGZ-XLIONFOSSA-N 2 0 340.536 4.409 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cnc(C3CCCCC3)s2)C[C@@H]1C ZINC000552071570 1039095950 /nfs/dbraw/zinc/09/59/50/1039095950.db2.gz PIUOXVGACWSHQS-DOTOQJQBSA-N 2 0 335.561 4.495 20 0 EIADRP CC[C@@H]1CCCC[C@@H]1[NH2+]CC1(C[NH2+][C@@H]2CCCC[C@@H]2CC)COC1 ZINC000481189165 1039096417 /nfs/dbraw/zinc/09/64/17/1039096417.db2.gz JCOVERUEOQPRJY-JVSBHGNQSA-N 2 0 336.564 4.120 20 0 EIADRP CC[C@@H]1CCCC[C@H]1[NH2+]CC1(C[NH2+][C@H]2CCCC[C@H]2CC)COC1 ZINC000481189166 1039097083 /nfs/dbraw/zinc/09/70/83/1039097083.db2.gz JCOVERUEOQPRJY-WTGUMLROSA-N 2 0 336.564 4.120 20 0 EIADRP CCc1ccc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)nc1 ZINC000555381658 1039134997 /nfs/dbraw/zinc/13/49/97/1039134997.db2.gz ZXMHOFFRAQESJA-SFHVURJKSA-N 2 0 329.532 4.121 20 0 EIADRP C[C@H]([NH2+]CCCCc1cccc(C(F)(F)F)c1)[C@H]1CCC[NH2+]C1 ZINC000414819312 1039155063 /nfs/dbraw/zinc/15/50/63/1039155063.db2.gz HEVOINRIHIJWBF-HOCLYGCPSA-N 2 0 328.422 4.006 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccccc2OC)cc1 ZINC000120577967 1039179830 /nfs/dbraw/zinc/17/98/30/1039179830.db2.gz VRLMXGCWRTXUKW-QGZVFWFLSA-N 2 0 326.484 4.388 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000414822943 1039183415 /nfs/dbraw/zinc/18/34/15/1039183415.db2.gz NMQCTTKSLYKUFK-FMKPAKJESA-N 2 0 328.422 4.004 20 0 EIADRP F/C=C(\CCc1ccc(F)cc1)C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001168360357 1039205425 /nfs/dbraw/zinc/20/54/25/1039205425.db2.gz OVDDSPWNRBQQSP-QGOAFFKASA-N 2 0 334.454 4.076 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2OC(F)F)C1 ZINC000481296912 1039234887 /nfs/dbraw/zinc/23/48/87/1039234887.db2.gz BDIMYOLMVBQDEG-GJZGRUSLSA-N 2 0 348.437 4.434 20 0 EIADRP Cc1nc2c(s1)[C@@H]([NH2+]C1CCC([NH+]3CCC(C)CC3)CC1)CCC2 ZINC000090775319 1039297701 /nfs/dbraw/zinc/29/77/01/1039297701.db2.gz YBBHXJMFXAXHPG-TVPLGVNVSA-N 2 0 347.572 4.462 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CC(C)(C)c3ccccc32)c1 ZINC000481326525 1039300235 /nfs/dbraw/zinc/30/02/35/1039300235.db2.gz ZUNDOIVSOWLHHL-OAQYLSRUSA-N 2 0 338.495 4.139 20 0 EIADRP CC[C@@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1c(C)noc1C ZINC000090886760 1039318678 /nfs/dbraw/zinc/31/86/78/1039318678.db2.gz GPHUMWFGSRCGHX-IFXJQAMLSA-N 2 0 345.487 4.034 20 0 EIADRP CCC[N@H+](C)C[C@H]1CCN(CCOc2cc(Cl)ccc2Cl)C1 ZINC000478042474 1039364843 /nfs/dbraw/zinc/36/48/43/1039364843.db2.gz PRTZFRLMFLXUSB-CQSZACIVSA-N 2 0 345.314 4.036 20 0 EIADRP C[N@@H+]1CC[C@@H]2C[NH+](C3CCC(c4ccc(Cl)cc4)CC3)C[C@@H]2C1 ZINC001168345098 1039382970 /nfs/dbraw/zinc/38/29/70/1039382970.db2.gz NMJCSEWGQJMMLN-NNVNDSJASA-N 2 0 332.919 4.250 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccc(Br)s1 ZINC000555613908 1039430695 /nfs/dbraw/zinc/43/06/95/1039430695.db2.gz DCAYZAAVGKFDMW-CYBMUJFWSA-N 2 0 345.350 4.427 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)[C@@H](C)c2nc3ccccc3s2)CC1 ZINC000121732142 1039441437 /nfs/dbraw/zinc/44/14/37/1039441437.db2.gz FFXBBTJKPNOBST-CVEARBPZSA-N 2 0 345.556 4.500 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)[C@@H](C)c2nc3ccccc3s2)CC1 ZINC000121732295 1039446525 /nfs/dbraw/zinc/44/65/25/1039446525.db2.gz FFXBBTJKPNOBST-HZPDHXFCSA-N 2 0 345.556 4.500 20 0 EIADRP C[NH+](C)C[C@@]12C[C@@H]1C[N@@H+](C1CCC(c3ccc(Cl)cc3)CC1)C2 ZINC001168347475 1039497141 /nfs/dbraw/zinc/49/71/41/1039497141.db2.gz LTMUMIJWLMAJLY-LNXHZJMOSA-N 2 0 332.919 4.250 20 0 EIADRP COc1ccc2oc(C[NH2+]CCCC[N@@H+]3CCCC[C@H]3C)cc2c1 ZINC000478346936 1039687659 /nfs/dbraw/zinc/68/76/59/1039687659.db2.gz UXWHIZCWJIJSPV-MRXNPFEDSA-N 2 0 330.472 4.186 20 0 EIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000643536848 1039758322 /nfs/dbraw/zinc/75/83/22/1039758322.db2.gz WZZXHHXAXMNLIC-QZTJIDSGSA-N 2 0 326.509 4.072 20 0 EIADRP C[C@@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000414850111 1039776314 /nfs/dbraw/zinc/77/63/14/1039776314.db2.gz YTEOIKWXDPUECS-HOCLYGCPSA-N 2 0 328.422 4.006 20 0 EIADRP CCc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)o1 ZINC000481733366 1039797613 /nfs/dbraw/zinc/79/76/13/1039797613.db2.gz FDHPXQPXIJAZLV-OAHLLOKOSA-N 2 0 332.513 4.466 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)CCN1C ZINC000481740609 1039803024 /nfs/dbraw/zinc/80/30/24/1039803024.db2.gz MUTHHPPYNRGWLB-LPTQZCDUSA-N 2 0 344.449 4.321 20 0 EIADRP COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000123027940 1039849859 /nfs/dbraw/zinc/84/98/59/1039849859.db2.gz NNVATNFYXWUSQQ-GOSISDBHSA-N 2 0 338.495 4.450 20 0 EIADRP Clc1ccccc1-c1ccc(C[NH2+][C@@H]2CC23CC[NH2+]CC3)s1 ZINC000666952447 1039851752 /nfs/dbraw/zinc/85/17/52/1039851752.db2.gz WTFDPSAHNBQMGE-QGZVFWFLSA-N 2 0 332.900 4.300 20 0 EIADRP Clc1ccc(CCCC[NH2+][C@H]2CC23CC[NH2+]CC3)cc1Cl ZINC000666953699 1039853124 /nfs/dbraw/zinc/85/31/24/1039853124.db2.gz FMRCKVZFUOQJPL-INIZCTEOSA-N 2 0 327.299 4.048 20 0 EIADRP CN1CC[C@H]([NH2+]CCc2ccc3ccccc3n2)C[C@@H]1c1ccccc1 ZINC000551029285 1039886011 /nfs/dbraw/zinc/88/60/11/1039886011.db2.gz CBIANMYTINVFEZ-JTHBVZDNSA-N 2 0 345.490 4.202 20 0 EIADRP COc1ccc(Cl)cc1[C@@H](CC(C)C)[NH2+]CCCC[NH+](C)C ZINC000552978191 1039893199 /nfs/dbraw/zinc/89/31/99/1039893199.db2.gz DSMGOMSLLPCEPN-QGZVFWFLSA-N 2 0 326.912 4.367 20 0 EIADRP CCC[C@H]([NH2+]C1CC[NH+](CCCOC)CC1)c1ccc(Cl)cc1 ZINC000481928418 1039899776 /nfs/dbraw/zinc/89/97/76/1039899776.db2.gz AAAJFDGGHOBZMI-IBGZPJMESA-N 2 0 338.923 4.272 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)Cc2ccccc2C(F)(F)F)C1 ZINC000481925961 1039900044 /nfs/dbraw/zinc/90/00/44/1039900044.db2.gz NPJTUSBBKCEGNF-JKSUJKDBSA-N 2 0 342.449 4.346 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@@H](C)Cc2ccccc2C(F)(F)F)CC1 ZINC000481926214 1039901403 /nfs/dbraw/zinc/90/14/03/1039901403.db2.gz WSWLXFVVVXWPOG-HNNXBMFYSA-N 2 0 342.449 4.491 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H](CC(C)C)c2ccccc2C)CC1 ZINC000481937028 1039907006 /nfs/dbraw/zinc/90/70/06/1039907006.db2.gz WAUGNAISHLVYIP-OAQYLSRUSA-N 2 0 332.532 4.173 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000481976521 1039923404 /nfs/dbraw/zinc/92/34/04/1039923404.db2.gz ZKVNESKRTDIRKC-CZUORRHYSA-N 2 0 347.503 4.256 20 0 EIADRP C[C@H](CC[NH+](C)C)N[C@@H](C)c1ccc2ccccc2c1OC(F)F ZINC000481962675 1039927103 /nfs/dbraw/zinc/92/71/03/1039927103.db2.gz PXLDXRCXIUKOJG-KGLIPLIRSA-N 2 0 336.426 4.432 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CC[C@@](C)(c2ccc(C)cc2)C1 ZINC000435034226 1040024793 /nfs/dbraw/zinc/02/47/93/1040024793.db2.gz CDTYTEKXAVOXKE-JOCHJYFZSA-N 2 0 346.478 4.048 20 0 EIADRP C[C@@H]([NH2+]CCc1ccc2[nH]ccc2c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000514633513 1040068984 /nfs/dbraw/zinc/06/89/84/1040068984.db2.gz GARKPRQOZDCAPG-XMSQKQJNSA-N 2 0 347.506 4.211 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1cccc(Br)c1 ZINC000551264741 1040125509 /nfs/dbraw/zinc/12/55/09/1040125509.db2.gz MZOJFDPXMPFWNM-HNNXBMFYSA-N 2 0 339.321 4.366 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)C1 ZINC000482336225 1040183890 /nfs/dbraw/zinc/18/38/90/1040183890.db2.gz RVECHZWGPGIUIM-LSDHHAIUSA-N 2 0 328.422 4.476 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc(F)c1 ZINC000482442765 1040250815 /nfs/dbraw/zinc/25/08/15/1040250815.db2.gz XCIACAPNNAVCIN-MJGOQNOKSA-N 2 0 326.459 4.041 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cccs1 ZINC000482443015 1040252094 /nfs/dbraw/zinc/25/20/94/1040252094.db2.gz FCYNTBQBECHXDS-RTBURBONSA-N 2 0 328.525 4.353 20 0 EIADRP C[C@@H]1Cc2ccccc2[C@H]1[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000482456273 1040253654 /nfs/dbraw/zinc/25/36/54/1040253654.db2.gz ZGWQUNFJGWFIJH-RFWXGWTQSA-N 2 0 334.507 4.074 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@H](Cc3ccccc3)C3CC3)C2)cc1 ZINC000482452122 1040262830 /nfs/dbraw/zinc/26/28/30/1040262830.db2.gz ABHIMGHYFMWALQ-ISKFKSNPSA-N 2 0 348.534 4.162 20 0 EIADRP Cc1cccnc1C(C)(C)C[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1 ZINC000514820437 1040272455 /nfs/dbraw/zinc/27/24/55/1040272455.db2.gz MMJJLVIZNWDSHU-XLIONFOSSA-N 2 0 343.559 4.300 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2ccccc2Br)CC1 ZINC000482509781 1040308991 /nfs/dbraw/zinc/30/89/91/1040308991.db2.gz KXXTWWWMTBPFPR-AWEZNQCLSA-N 2 0 339.321 4.222 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(OCC)c(OCC)c2)CC1 ZINC000482509979 1040309102 /nfs/dbraw/zinc/30/91/02/1040309102.db2.gz LZTGYYRRQQKCBQ-QGZVFWFLSA-N 2 0 348.531 4.257 20 0 EIADRP CS[C@@H]1CC[C@@H]1[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000425355396 1040324578 /nfs/dbraw/zinc/32/45/78/1040324578.db2.gz ONSDLGZCCGPXPX-ZWKOTPCHSA-N 2 0 338.948 4.036 20 0 EIADRP CC(C[NH2+]C1CC[NH+](CC2CC2)CC1)(c1ccccc1)c1ccccc1 ZINC001168356268 1040325372 /nfs/dbraw/zinc/32/53/72/1040325372.db2.gz NEQCWWKNOJEHCW-UHFFFAOYSA-N 2 0 348.534 4.457 20 0 EIADRP CS[C@H]1CC[C@H]1[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000425355390 1040325981 /nfs/dbraw/zinc/32/59/81/1040325981.db2.gz ONSDLGZCCGPXPX-MSOLQXFVSA-N 2 0 338.948 4.036 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](CCO)CC1)c1ccc(C2CCCCC2)cc1 ZINC000482545030 1040344595 /nfs/dbraw/zinc/34/45/95/1040344595.db2.gz WPUVOLVCQCOOBP-GOSISDBHSA-N 2 0 344.543 4.089 20 0 EIADRP COc1ccccc1-c1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000435397706 1040360147 /nfs/dbraw/zinc/36/01/47/1040360147.db2.gz JMWNAPAHPFEIRW-YOFSQIOKSA-N 2 0 336.479 4.077 20 0 EIADRP CC(C)COc1ccc(C(C)(C)C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000482643062 1040403417 /nfs/dbraw/zinc/40/34/17/1040403417.db2.gz ODJBWYZZBYIQOU-MJGOQNOKSA-N 2 0 332.532 4.071 20 0 EIADRP CC[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551572363 1040420304 /nfs/dbraw/zinc/42/03/04/1040420304.db2.gz IWOWZDWQTVLZHI-GHTZIAJQSA-N 2 0 330.516 4.218 20 0 EIADRP CCC1(Cc2ccccc2)CC[NH+]([C@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000479540581 1040446374 /nfs/dbraw/zinc/44/63/74/1040446374.db2.gz GHACOGIEPKFVBY-SFTDATJTSA-N 2 0 326.528 4.348 20 0 EIADRP C[C@@H]([NH2+]CCCc1ccccc1F)c1cccc(OCC[NH+](C)C)c1 ZINC000479550418 1040454820 /nfs/dbraw/zinc/45/48/20/1040454820.db2.gz BUXWIQOKLMWUGW-QGZVFWFLSA-N 2 0 344.474 4.050 20 0 EIADRP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1ccc2ncccc2c1 ZINC000479606060 1040507425 /nfs/dbraw/zinc/50/74/25/1040507425.db2.gz XKTHLLWGXTTYRX-UHFFFAOYSA-N 2 0 325.500 4.369 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(CC)cc2)[C@H](C)C1 ZINC000479876914 1040739909 /nfs/dbraw/zinc/73/99/09/1040739909.db2.gz VJCIZYFQVPBEGG-LQWHRVPQSA-N 2 0 332.532 4.037 20 0 EIADRP C[C@H](NCC(C)(C)C[NH+](C)C)c1cc(Cl)ccc1OC(F)F ZINC000479862785 1040751088 /nfs/dbraw/zinc/75/10/88/1040751088.db2.gz SFCFMPYRKUOVNG-NSHDSACASA-N 2 0 334.838 4.180 20 0 EIADRP C[C@@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1ccccc1OC(F)F ZINC000483188978 1040764083 /nfs/dbraw/zinc/76/40/83/1040764083.db2.gz YHOXJVZEFABAIP-CZUORRHYSA-N 2 0 328.447 4.305 20 0 EIADRP CCCOc1ccc(C[N@H+](C)[C@H]2CC[NH+](CC)C[C@@H]2C)cc1OCC ZINC000539817498 1040809562 /nfs/dbraw/zinc/80/95/62/1040809562.db2.gz OJNBFMMYFKFRMO-HKUYNNGSSA-N 2 0 348.531 4.036 20 0 EIADRP C[NH+]1CCC2(CCC[N@@H+]2Cc2ccc(-c3cccc(F)c3F)o2)CC1 ZINC000483332354 1040817070 /nfs/dbraw/zinc/81/70/70/1040817070.db2.gz BHUMESLIPQCPAY-UHFFFAOYSA-N 2 0 346.421 4.285 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1nc2c(s1)CCCC2 ZINC000537883072 1040872678 /nfs/dbraw/zinc/87/26/78/1040872678.db2.gz QQVZAXXVLDWKCE-BBWFWOEESA-N 2 0 349.588 4.431 20 0 EIADRP Cc1ccoc1C[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000462750714 1040898398 /nfs/dbraw/zinc/89/83/98/1040898398.db2.gz QFTPXPPLMJERMT-UHFFFAOYSA-N 2 0 340.511 4.413 20 0 EIADRP FC(F)(F)CCC(CCC(F)(F)F)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000924648685 1040939203 /nfs/dbraw/zinc/93/92/03/1040939203.db2.gz NKTSGVNRJFXZIB-NSHDSACASA-N 2 0 346.359 4.114 20 0 EIADRP Cc1cc(N2CCC(C[NH+](C)C)CC2)c2cc(Cl)cc(C)c2[nH+]1 ZINC000462794753 1040948787 /nfs/dbraw/zinc/94/87/87/1040948787.db2.gz WTLCSEAUBJZTIH-UHFFFAOYSA-N 2 0 331.891 4.283 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)o1 ZINC000483654653 1040950164 /nfs/dbraw/zinc/95/01/64/1040950164.db2.gz OJXVVOZISDNUCT-WMZOPIPTSA-N 2 0 344.499 4.200 20 0 EIADRP C[C@@H](CC[NH2+][C@@H](C)c1ccc2c(c1)COC2)[N@H+](C)Cc1ccccc1 ZINC000483672076 1040962505 /nfs/dbraw/zinc/96/25/05/1040962505.db2.gz PPUYZLPVPHLNLJ-ROUUACIJSA-N 2 0 338.495 4.278 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@@H]3C)cc2)cc1 ZINC000537988486 1040963392 /nfs/dbraw/zinc/96/33/92/1040963392.db2.gz VGGQQABYWYUOLS-GSHUGGBRSA-N 2 0 338.495 4.181 20 0 EIADRP C[C@@]1(C[NH2+]Cc2cnc3ccccc3c2)CC[N@H+](Cc2ccccc2)C1 ZINC000311774215 1040967424 /nfs/dbraw/zinc/96/74/24/1040967424.db2.gz JUORDUDQWAULLH-QHCPKHFHSA-N 2 0 345.490 4.237 20 0 EIADRP c1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH2+][C@H]4CCCSCC4)C[C@@H]3C2)cc1 ZINC000898519254 1040971689 /nfs/dbraw/zinc/97/16/89/1040971689.db2.gz OBFQDPVLDUINKF-WOZUAGRISA-N 2 0 344.568 4.162 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCOc2ccccc2C)cc1 ZINC000537992285 1040989085 /nfs/dbraw/zinc/98/90/85/1040989085.db2.gz XIWDKGBXDUNWLQ-KRWDZBQOSA-N 2 0 335.451 4.219 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cc3c(cccc3F)[nH]2)c1 ZINC000436233419 1041000697 /nfs/dbraw/zinc/00/06/97/1041000697.db2.gz OMWMUUPYTGHOCI-UHFFFAOYSA-N 2 0 325.431 4.049 20 0 EIADRP C(NC1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCC[N@@H+]1C1CCCCC1 ZINC000436299355 1041065234 /nfs/dbraw/zinc/06/52/34/1041065234.db2.gz JTPIIKIQTKGQJX-QFIPXVFZSA-N 2 0 347.591 4.170 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000436315438 1041082801 /nfs/dbraw/zinc/08/28/01/1041082801.db2.gz PKUMMOQJYBTHLZ-RUEOWNRQSA-N 2 0 340.433 4.270 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@H]3C)cc2)cs1 ZINC000480272826 1041154257 /nfs/dbraw/zinc/15/42/57/1041154257.db2.gz DYRDXGVCGBITEV-BKEDOTJMSA-N 2 0 343.540 4.498 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cc(Cl)cc(Cl)c1 ZINC000484289492 1041194295 /nfs/dbraw/zinc/19/42/95/1041194295.db2.gz FXQQQBPMPTVTEA-WBMJQRKESA-N 2 0 333.303 4.001 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000484470336 1041246987 /nfs/dbraw/zinc/24/69/87/1041246987.db2.gz RZTYJGSHOKXDLL-IMJJTQAJSA-N 2 0 344.421 4.151 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@H]1CC2c3ccccc3C1c1ccccc12 ZINC000540194449 1041270953 /nfs/dbraw/zinc/27/09/53/1041270953.db2.gz ITZWRVHOUMJDPF-MNNVLDMHSA-N 2 0 346.518 4.214 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]C[C@H]1CC2c3ccccc3C1c1ccccc12 ZINC000540194441 1041271039 /nfs/dbraw/zinc/27/10/39/1041271039.db2.gz ITZWRVHOUMJDPF-BGUQPKOPSA-N 2 0 346.518 4.214 20 0 EIADRP COc1ccc(Cl)cc1[C@H](CC(C)C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000538408211 1041324170 /nfs/dbraw/zinc/32/41/70/1041324170.db2.gz SZHHEKBJFVZTOO-SFHVURJKSA-N 2 0 336.907 4.287 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000554742382 1041373323 /nfs/dbraw/zinc/37/33/23/1041373323.db2.gz VRNLIMIBTQTOJZ-OAQYLSRUSA-N 2 0 337.511 4.318 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1C[C@H]1c1ccccc1 ZINC000463162022 1041379238 /nfs/dbraw/zinc/37/92/38/1041379238.db2.gz JZSOVVDYWQIKTR-FCHUYYIVSA-N 2 0 335.495 4.176 20 0 EIADRP c1ccc2c(c1)-c1ccccc1C2C[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001168369150 1041379744 /nfs/dbraw/zinc/37/97/44/1041379744.db2.gz XZRLEEPQOFVLBY-UHFFFAOYSA-N 2 0 332.491 4.263 20 0 EIADRP c1ccc(CCN2CCC([NH2+]CC3(Cc4ccccc4)CC3)CC2)cc1 ZINC000463191657 1041408988 /nfs/dbraw/zinc/40/89/88/1041408988.db2.gz MUWWPCXYVNYJGE-UHFFFAOYSA-N 2 0 348.534 4.306 20 0 EIADRP C[C@@H]([NH2+]C1(c2ccc(F)cc2)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000538554214 1041417395 /nfs/dbraw/zinc/41/73/95/1041417395.db2.gz SACZNMBNKKMYJK-MRXNPFEDSA-N 2 0 342.458 4.106 20 0 EIADRP Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000924668091 1041438628 /nfs/dbraw/zinc/43/86/28/1041438628.db2.gz OIPCMYGZFPIQCS-HZPDHXFCSA-N 2 0 341.499 4.374 20 0 EIADRP Cc1cccc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c1Br ZINC000904349851 1041444655 /nfs/dbraw/zinc/44/46/55/1041444655.db2.gz DENBNWRRDZKVDZ-ZDUSSCGKSA-N 2 0 333.273 4.067 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc(F)cc1N(C)C ZINC000480636941 1041448157 /nfs/dbraw/zinc/44/81/57/1041448157.db2.gz ZRINPCLMHWUCLF-QGZVFWFLSA-N 2 0 335.511 4.054 20 0 EIADRP C[C@H]([NH2+]C1(Cc2ccccc2)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000480661598 1041452047 /nfs/dbraw/zinc/45/20/47/1041452047.db2.gz KOSHNZUSUTYJMR-SFHVURJKSA-N 2 0 338.495 4.053 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1Nc1ccc2c(c1)nc(C(C)(C)C)n2C ZINC000538627239 1041459685 /nfs/dbraw/zinc/45/96/85/1041459685.db2.gz CQXJSYYYIJEEAP-IJEWVQPXSA-N 2 0 328.504 4.011 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2(Cc3ccccc3)CC2)CC1 ZINC000480689173 1041472869 /nfs/dbraw/zinc/47/28/69/1041472869.db2.gz MBMGMIIJJJBMKF-NQIIRXRSSA-N 2 0 326.528 4.394 20 0 EIADRP COc1ccc([C@H](CCC(C)C)[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000480692420 1041475866 /nfs/dbraw/zinc/47/58/66/1041475866.db2.gz IGUSJXWGIZQOAW-ZJOUEHCJSA-N 2 0 330.516 4.389 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)[C@@H]1CCOC1 ZINC000480703451 1041480041 /nfs/dbraw/zinc/48/00/41/1041480041.db2.gz YPRHDNPTZCZWAM-OSZJIOELSA-N 2 0 344.543 4.069 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000195132181 1041484507 /nfs/dbraw/zinc/48/45/07/1041484507.db2.gz WJKCORPLOJQRGP-WMZOPIPTSA-N 2 0 342.458 4.007 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cnc(C3CC3)s2)CC1 ZINC000538721342 1041489147 /nfs/dbraw/zinc/48/91/47/1041489147.db2.gz DDRYBWSEMDZQAI-INIZCTEOSA-N 2 0 347.572 4.497 20 0 EIADRP CC[C@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000480733987 1041495566 /nfs/dbraw/zinc/49/55/66/1041495566.db2.gz BLHRAZKPJLFGAW-IKGGRYGDSA-N 2 0 338.948 4.427 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1nc2c(s1)CCCC2 ZINC000538985194 1041601420 /nfs/dbraw/zinc/60/14/20/1041601420.db2.gz VSPDVMAITAPJMW-INIZCTEOSA-N 2 0 335.561 4.329 20 0 EIADRP C[C@@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000516738419 1041722757 /nfs/dbraw/zinc/72/27/57/1041722757.db2.gz HXFDSJHHHJMLMD-AWEZNQCLSA-N 2 0 344.421 4.310 20 0 EIADRP Cn1cncc1CCC[NH2+][C@@](C)(Cc1ccccc1)c1ccccc1 ZINC000516782695 1041752098 /nfs/dbraw/zinc/75/20/98/1041752098.db2.gz ZQMYMUYZACDGNO-QFIPXVFZSA-N 2 0 333.479 4.100 20 0 EIADRP COc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(C)c1 ZINC000540962864 1041753468 /nfs/dbraw/zinc/75/34/68/1041753468.db2.gz XRCHRDRUYPJUDB-NQIIRXRSSA-N 2 0 338.495 4.004 20 0 EIADRP CC(C)[NH2+]CCC[NH2+][C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000516921158 1041810441 /nfs/dbraw/zinc/81/04/41/1041810441.db2.gz GGOCKVRSJBZPOF-MRXNPFEDSA-N 2 0 347.503 4.304 20 0 EIADRP CC1(C)[C@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C[C@@H]1c1ccccc1 ZINC000464071240 1041853851 /nfs/dbraw/zinc/85/38/51/1041853851.db2.gz HDTCFAKQOWDEEG-FGZHOGPDSA-N 2 0 349.522 4.470 20 0 EIADRP CC1(C)[C@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C[C@H]1c1ccccc1 ZINC000464071239 1041854071 /nfs/dbraw/zinc/85/40/71/1041854071.db2.gz HDTCFAKQOWDEEG-FCHUYYIVSA-N 2 0 349.522 4.470 20 0 EIADRP CC(C)Oc1cccc(C[NH2+]CCC[N@H+](C)Cc2ccccc2)c1 ZINC000301193032 1041895141 /nfs/dbraw/zinc/89/51/41/1041895141.db2.gz MRRBOTPVQUJBCY-UHFFFAOYSA-N 2 0 326.484 4.086 20 0 EIADRP CC[C@@H](CCc1ccc(Br)cc1)[NH2+]C1CCC([NH3+])CC1 ZINC000437784058 1041898907 /nfs/dbraw/zinc/89/89/07/1041898907.db2.gz YBPYCBQVMMWOJD-CGZBRXJRSA-N 2 0 339.321 4.020 20 0 EIADRP Cc1ccc2cc(C[NH2+]C[C@@H]3CCC[N@@H+](CC(C)C)C3)ccc2n1 ZINC000437775696 1041907052 /nfs/dbraw/zinc/90/70/52/1041907052.db2.gz OBRQKVGMCCFAQU-IBGZPJMESA-N 2 0 325.500 4.001 20 0 EIADRP CC[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)CC(F)(F)F ZINC000402688704 1041946848 /nfs/dbraw/zinc/94/68/48/1041946848.db2.gz HENLUERVXJSJIO-XYJFISCASA-N 2 0 342.449 4.465 20 0 EIADRP CC[C@@H]1CCC[C@@H](C[N@H+](C)C2CCN(CCc3ccccn3)CC2)C1 ZINC000541536595 1041999366 /nfs/dbraw/zinc/99/93/66/1041999366.db2.gz CWDFCQMVGIDHCD-WOJBJXKFSA-N 2 0 343.559 4.237 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000402757739 1042004619 /nfs/dbraw/zinc/00/46/19/1042004619.db2.gz GDVVHUYJVJMJAI-ZOBUZTSGSA-N 2 0 328.422 4.075 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCCOCc2ccccc2)C1 ZINC000541579333 1042014791 /nfs/dbraw/zinc/01/47/91/1042014791.db2.gz WQKWBZKFLLMJIS-IRLDBZIGSA-N 2 0 344.543 4.180 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@H](C)C[NH+](C)C ZINC000425945133 1042033593 /nfs/dbraw/zinc/03/35/93/1042033593.db2.gz JOLZMWAQPTXENL-STQMWFEESA-N 2 0 335.492 4.106 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)CC(F)(F)F ZINC000402796793 1042040706 /nfs/dbraw/zinc/04/07/06/1042040706.db2.gz VYJVFJGJJHIOAA-DZJNRPSUSA-N 2 0 340.433 4.075 20 0 EIADRP CC(C)Oc1ccccc1C[NH2+]CCCC[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000517537498 1042069582 /nfs/dbraw/zinc/06/95/82/1042069582.db2.gz VZJUCCNFFKJOCC-OALUTQOASA-N 2 0 332.532 4.322 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccc(OC(F)(F)F)cc1 ZINC000517567408 1042082682 /nfs/dbraw/zinc/08/26/82/1042082682.db2.gz LQVPNFJTBLKOJC-QGZVFWFLSA-N 2 0 338.373 4.285 20 0 EIADRP CCCC[C@@H](CC)C[N@@H+]1CCC[C@@]2(CCC[NH+](C[C@H](C)CO)C2)C1 ZINC001280201522 1042113497 /nfs/dbraw/zinc/11/34/97/1042113497.db2.gz SMDWAPFRCSZCJC-PWRODBHTSA-N 2 0 338.580 4.009 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](CSC)c2ccc(C(F)(F)F)cc2)C1 ZINC000541916178 1042179074 /nfs/dbraw/zinc/17/90/74/1042179074.db2.gz DTIGOMLQKZAYKM-BBRMVZONSA-N 2 0 346.462 4.041 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1ccc(NC(C)=O)cc1 ZINC000541917805 1042179232 /nfs/dbraw/zinc/17/92/32/1042179232.db2.gz DBDWLGMDTQFXOB-PBEJRMEISA-N 2 0 345.531 4.196 20 0 EIADRP C[C@H](c1cccc(F)c1)[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464836212 1042181041 /nfs/dbraw/zinc/18/10/41/1042181041.db2.gz JNMBOWHEOLUMBR-IEBWSBKVSA-N 2 0 326.459 4.341 20 0 EIADRP C([C@H]1CCC2(CCCC2)O1)[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000669927526 1042329453 /nfs/dbraw/zinc/32/94/53/1042329453.db2.gz GOJUTYVMPORKRW-HXUWFJFHSA-N 2 0 334.548 4.066 20 0 EIADRP C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000467378201 1042405265 /nfs/dbraw/zinc/40/52/65/1042405265.db2.gz RBYQSKPGMGXXND-AWEZNQCLSA-N 2 0 340.433 4.100 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414972323 1042444538 /nfs/dbraw/zinc/44/45/38/1042444538.db2.gz XPHCJSLIHZKEHY-PBHICJAKSA-N 2 0 328.422 4.148 20 0 EIADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000414989503 1042556424 /nfs/dbraw/zinc/55/64/24/1042556424.db2.gz HFJZHOQQHBZWDY-HIFRSBDPSA-N 2 0 334.410 4.048 20 0 EIADRP CC(C)(C)OC1CC([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000492144019 1042565154 /nfs/dbraw/zinc/56/51/54/1042565154.db2.gz NXHGOVHJRSLDBU-BWQRXAFVSA-N 2 0 342.527 4.118 20 0 EIADRP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000414992713 1042571006 /nfs/dbraw/zinc/57/10/06/1042571006.db2.gz BZBWMARKLUDGJD-JLJPHGGASA-N 2 0 346.412 4.230 20 0 EIADRP C[C@@H]([NH2+]CCCc1cccc(F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492326085 1042613828 /nfs/dbraw/zinc/61/38/28/1042613828.db2.gz BBAFCNLNSXYOKN-WIYYLYMNSA-N 2 0 340.486 4.259 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+]Cc2cccc(-c3ccncc3)c2)C1 ZINC000439479476 1042656328 /nfs/dbraw/zinc/65/63/28/1042656328.db2.gz UHZVQLYGCWMGFC-KDURUIRLSA-N 2 0 337.511 4.206 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]C[C@@H](C)C[NH+]2CCCCC2)C1 ZINC000467388694 1042716450 /nfs/dbraw/zinc/71/64/50/1042716450.db2.gz IFNWEZXRBMULOV-MISYRCLQSA-N 2 0 329.532 4.128 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2cscc2C(F)(F)F)CC1 ZINC000518843060 1042719724 /nfs/dbraw/zinc/71/97/24/1042719724.db2.gz SBNLYHKIOQXKDP-UHFFFAOYSA-N 2 0 334.451 4.369 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000415006326 1042803689 /nfs/dbraw/zinc/80/36/89/1042803689.db2.gz QIFKHLKIHBFUAY-UKPHBRMFSA-N 2 0 328.422 4.134 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H]2CCCOc3c(Cl)cc(C)cc32)CC1 ZINC000519055855 1042805222 /nfs/dbraw/zinc/80/52/22/1042805222.db2.gz AYUCGYNQEIBEKA-GOSISDBHSA-N 2 0 336.907 4.184 20 0 EIADRP c1ccc([C@@H]2C[C@@H]([NH2+]CCC[C@H]3CCCCO3)CCN2C2CC2)cc1 ZINC000639047121 1042819362 /nfs/dbraw/zinc/81/93/62/1042819362.db2.gz KAPBHAGTWQZLOV-NNWRFLSQSA-N 2 0 342.527 4.293 20 0 EIADRP C[C@@H](Cc1cccc(F)c1)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC001168447782 1042824948 /nfs/dbraw/zinc/82/49/48/1042824948.db2.gz HLOFBQOYZSEPHZ-KRWDZBQOSA-N 2 0 326.459 4.142 20 0 EIADRP C[C@H]([NH2+]Cc1coc2ccccc12)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311129921 1042854025 /nfs/dbraw/zinc/85/40/25/1042854025.db2.gz WJBKMGOAOKRSBJ-HKUYNNGSSA-N 2 0 334.463 4.433 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+]CCc2c[nH]c3ccc(Cl)cc23)CC1 ZINC000178004974 1042856045 /nfs/dbraw/zinc/85/60/45/1042856045.db2.gz ABLFACIVNVTOFF-UHFFFAOYSA-N 2 0 333.907 4.216 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C2CC[NH+](CC3CC3)CC2)c2ccccc12 ZINC000178254522 1042861869 /nfs/dbraw/zinc/86/18/69/1042861869.db2.gz WCYSNPOUDPZBDL-MRXNPFEDSA-N 2 0 338.495 4.373 20 0 EIADRP COCCC[C@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000178439905 1042866560 /nfs/dbraw/zinc/86/65/60/1042866560.db2.gz WIOTYGOJIQUFAB-SFHVURJKSA-N 2 0 332.532 4.356 20 0 EIADRP CC1(c2ccccc2)CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001168002814 1042886393 /nfs/dbraw/zinc/88/63/93/1042886393.db2.gz ZFPRYNLLEXZSLE-CBQGHPETSA-N 2 0 338.539 4.446 20 0 EIADRP Clc1ccc2c(c1)CC[C@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000089215573 1042940351 /nfs/dbraw/zinc/94/03/51/1042940351.db2.gz KBLIYIVMTTXLAM-HXUWFJFHSA-N 2 0 341.886 4.229 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)[C@H](OC)c1ccccc1 ZINC000493915907 1042975599 /nfs/dbraw/zinc/97/55/99/1042975599.db2.gz GGEYUNGIIGEPJN-GCJKJVERSA-N 2 0 340.511 4.394 20 0 EIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000493897352 1042978880 /nfs/dbraw/zinc/97/88/80/1042978880.db2.gz NOUYNRSJRKELIV-GCJKJVERSA-N 2 0 338.495 4.148 20 0 EIADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000493978307 1042990340 /nfs/dbraw/zinc/99/03/40/1042990340.db2.gz RMCJMPHOFFAYNX-XMSQKQJNSA-N 2 0 340.511 4.393 20 0 EIADRP C[C@@H]1CC(n2c3ccccc3nc2C[NH3+])C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168007384 1043016494 /nfs/dbraw/zinc/01/64/94/1043016494.db2.gz RVXLTIIIXJXPQS-IAGOWNOFSA-N 2 0 348.494 4.109 20 0 EIADRP C[C@@H]1CC([NH2+]C[C@H]2CCC(F)(F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168008298 1043045585 /nfs/dbraw/zinc/04/55/85/1043045585.db2.gz XFBLKTQKRAJEJF-NUJGCVRESA-N 2 0 336.470 4.453 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+]CC2CCC(C(F)(F)F)CC2)ccc1F ZINC000183710447 1043054922 /nfs/dbraw/zinc/05/49/22/1043054922.db2.gz JUBNXQTZQIPBIZ-UHFFFAOYSA-N 2 0 346.412 4.346 20 0 EIADRP CC[C@@H]1C[C@H](C[N@H+](C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000507813146 1043056516 /nfs/dbraw/zinc/05/65/16/1043056516.db2.gz JDTJNAOBNBVIIP-WSWWRLHASA-N 2 0 344.543 4.177 20 0 EIADRP CCO[C@H]1C[C@@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C12CCCCC2 ZINC000766187433 1043157357 /nfs/dbraw/zinc/15/73/57/1043157357.db2.gz MMJBVNQTENXNJV-UXHICEINSA-N 2 0 334.548 4.111 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(OC(C)(C)C)cc1 ZINC000185201659 1043164503 /nfs/dbraw/zinc/16/45/03/1043164503.db2.gz CDGMAICIAUYSJM-INIZCTEOSA-N 2 0 330.516 4.389 20 0 EIADRP c1c[nH]c([C@H]2CCC[N@H+]2CCCCC[NH+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000077266673 1043273052 /nfs/dbraw/zinc/27/30/52/1043273052.db2.gz GYDGRFNBCFSBRP-OYRHEFFESA-N 2 0 340.515 4.487 20 0 EIADRP COC1(C[NH2+][C@H](C)C2CC[NH+](C)CC2)CCC(c2ccccc2)CC1 ZINC000672614323 1043303759 /nfs/dbraw/zinc/30/37/59/1043303759.db2.gz JWIQFOUXKYTRKK-OSFYOIPJSA-N 2 0 344.543 4.049 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000474027739 1043432671 /nfs/dbraw/zinc/43/26/71/1043432671.db2.gz CIQWBZBIJUSQIQ-HXUWFJFHSA-N 2 0 328.500 4.024 20 0 EIADRP CCc1nc(C)c(CN(C)[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)o1 ZINC000428242686 1043461896 /nfs/dbraw/zinc/46/18/96/1043461896.db2.gz WEBWELBOWQSTNO-LPHOPBHVSA-N 2 0 341.499 4.030 20 0 EIADRP C[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1ccc(Oc2ccccc2)cn1 ZINC000521025732 1043498218 /nfs/dbraw/zinc/49/82/18/1043498218.db2.gz IVTPZZSCZLWDME-FTRWYGJKSA-N 2 0 325.456 4.042 20 0 EIADRP C([NH2+][C@@H](C1CCC1)C1CCCCC1)C1CC[NH+](C2CCOCC2)CC1 ZINC000658069850 1043739689 /nfs/dbraw/zinc/73/96/89/1043739689.db2.gz JTMJYMGCIPGLPU-JOCHJYFZSA-N 2 0 348.575 4.216 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000190810823 1043739876 /nfs/dbraw/zinc/73/98/76/1043739876.db2.gz NLXSSHGMIHDVPZ-UHFFFAOYSA-N 2 0 336.401 4.365 20 0 EIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000494592884 1043836118 /nfs/dbraw/zinc/83/61/18/1043836118.db2.gz VGOIGLAGBKSVCT-ZXDFIECXSA-N 2 0 344.543 4.395 20 0 EIADRP CC[NH+](CC)CCCN1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 ZINC000191814594 1043849123 /nfs/dbraw/zinc/84/91/23/1043849123.db2.gz IMZMBZPGHCZOHI-ZDUSSCGKSA-N 2 0 349.466 4.073 20 0 EIADRP c1cc2cc(CC[NH2+]C3CC[NH+](C4CCCCC4)CC3)ccc2[nH]1 ZINC000442810920 1043852793 /nfs/dbraw/zinc/85/27/93/1043852793.db2.gz NUYLLCYPKFIMCY-UHFFFAOYSA-N 2 0 325.500 4.097 20 0 EIADRP C[C@H]1CC([NH2+]CCCc2ccccn2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168014451 1043855435 /nfs/dbraw/zinc/85/54/35/1043855435.db2.gz LGQMTLHPYSUDFD-OALUTQOASA-N 2 0 337.511 4.045 20 0 EIADRP C[C@H](c1ccc(OC(F)F)cc1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000067457438 1043955874 /nfs/dbraw/zinc/95/58/74/1043955874.db2.gz JYGBULFAXQYRFY-CQSZACIVSA-N 2 0 326.431 4.013 20 0 EIADRP C[C@H](CCCC(C)(C)O)[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168015052 1043967243 /nfs/dbraw/zinc/96/72/43/1043967243.db2.gz ONLONCYDDAXERZ-QYZOEREBSA-N 2 0 346.559 4.347 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000521860128 1044032292 /nfs/dbraw/zinc/03/22/92/1044032292.db2.gz VZQXXDFNQNMWMH-DVOMOZLQSA-N 2 0 345.487 4.044 20 0 EIADRP c1ccc(SC2(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)CCCC2)cc1 ZINC000166560275 1044050535 /nfs/dbraw/zinc/05/05/35/1044050535.db2.gz LSAGWGNZEOWXAD-ZWKOTPCHSA-N 2 0 330.541 4.308 20 0 EIADRP C[C@@H]1C[C@@H](n2nc(C[NH3+])c3ccccc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168015209 1044077957 /nfs/dbraw/zinc/07/79/57/1044077957.db2.gz PNWDVTXTZZQDQT-IZZQQSIFSA-N 2 0 348.494 4.109 20 0 EIADRP Clc1cccc2c1C[C@@H]([NH2+]CC1CC[NH+](CC3CCCC3)CC1)C2 ZINC001168710048 1044082298 /nfs/dbraw/zinc/08/22/98/1044082298.db2.gz WHCPNNBBQCGTNP-IBGZPJMESA-N 2 0 346.946 4.299 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2[C@H]2CCOC2)cc1 ZINC000474044876 1044275623 /nfs/dbraw/zinc/27/56/23/1044275623.db2.gz JKKMRXBHEUSDRM-BHDDXSALSA-N 2 0 344.543 4.213 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]2[C@@H]2CCOC2)cc1 ZINC000474044878 1044275690 /nfs/dbraw/zinc/27/56/90/1044275690.db2.gz JKKMRXBHEUSDRM-BHIFYINESA-N 2 0 344.543 4.213 20 0 EIADRP C[C@@H](Cc1cccc(F)c1)[NH+]1CCC([NH3+])(c2cccc(Cl)c2)CC1 ZINC001168470170 1044277868 /nfs/dbraw/zinc/27/78/68/1044277868.db2.gz XDEWLUUUICLHKU-HNNXBMFYSA-N 2 0 346.877 4.360 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCCC[C@H]1[C@H]1CCOC1 ZINC000474046375 1044284172 /nfs/dbraw/zinc/28/41/72/1044284172.db2.gz NDVFJQFHLMFXCK-FDFHNCONSA-N 2 0 344.543 4.213 20 0 EIADRP c1coc([C@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccccc2)c1 ZINC000326894898 1044322622 /nfs/dbraw/zinc/32/26/22/1044322622.db2.gz JEWCWBHSKWDJKL-OAQYLSRUSA-N 2 0 333.435 4.023 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCCC[C@@H]2[C@@H]2CCOC2)c1 ZINC000474085260 1044421064 /nfs/dbraw/zinc/42/10/64/1044421064.db2.gz WSHNGWGHGGVVFO-YPAWHYETSA-N 2 0 344.543 4.213 20 0 EIADRP CC(C)CCC[C@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1ccccc1 ZINC000675742421 1044471303 /nfs/dbraw/zinc/47/13/03/1044471303.db2.gz OZBWIYHYPYQBAU-NRFANRHFSA-N 2 0 345.575 4.170 20 0 EIADRP C[C@@H]([NH2+]CC1(c2c(F)cccc2F)CCCC1)C1CC[NH+](C)CC1 ZINC000675797705 1044493150 /nfs/dbraw/zinc/49/31/50/1044493150.db2.gz ORXAHCNVVPJNTR-OAHLLOKOSA-N 2 0 336.470 4.097 20 0 EIADRP c1cncc([C@@H]([NH2+]C2CC[NH+](CC3CC3)CC2)C2CCCCC2)c1 ZINC000675812142 1044512122 /nfs/dbraw/zinc/51/21/22/1044512122.db2.gz ITUXOHTYBWCQRD-NRFANRHFSA-N 2 0 327.516 4.167 20 0 EIADRP C[C@H](CC[NH2+][C@@H](C[C@@H]1CCOC1)c1ccc(F)cc1)[NH+]1CCCCC1 ZINC000494976016 1044552939 /nfs/dbraw/zinc/55/29/39/1044552939.db2.gz OGVBHQSADHXCLF-LQWHRVPQSA-N 2 0 348.506 4.148 20 0 EIADRP c1ccc(C[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C2CCCCC2)cc1 ZINC000480742558 1044573054 /nfs/dbraw/zinc/57/30/54/1044573054.db2.gz CKUDWWFRSXWQEU-FKBYEOEOSA-N 2 0 326.528 4.394 20 0 EIADRP C[C@H](CC1CCC1)[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000675928555 1044582900 /nfs/dbraw/zinc/58/29/00/1044582900.db2.gz LOYPHPCBWRCKHC-LJQANCHMSA-N 2 0 344.543 4.226 20 0 EIADRP C[C@H]1CC([NH2+]Cc2ccc3ocnc3c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168024329 1044606770 /nfs/dbraw/zinc/60/67/70/1044606770.db2.gz FDDAYYRGGPFLSR-IRXDYDNUSA-N 2 0 349.478 4.359 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3ncoc3c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168024418 1044615977 /nfs/dbraw/zinc/61/59/77/1044615977.db2.gz GHGCMILFAAYWFE-XEMDLRDOSA-N 2 0 349.478 4.359 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc2ccncc2s1 ZINC000657828290 1044706272 /nfs/dbraw/zinc/70/62/72/1044706272.db2.gz RGGSDTBXHMIRGQ-CQSZACIVSA-N 2 0 325.481 4.209 20 0 EIADRP [NH3+]C12CC(CC[N@H+]3CC=C(c4cc(Cl)cc(Cl)c4)CC3)(C1)C2 ZINC001205000882 1044796341 /nfs/dbraw/zinc/79/63/41/1044796341.db2.gz MDTBMSPMBTVFBO-UHFFFAOYSA-N 2 0 337.294 4.354 20 0 EIADRP CC(C)[C@H](C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)c1ccccc1 ZINC000474260908 1044824569 /nfs/dbraw/zinc/82/45/69/1044824569.db2.gz WSSFXGNHLCCGCD-QFIPXVFZSA-N 2 0 344.543 4.003 20 0 EIADRP C[NH+](C)C[C@H]1CC[N@H+](CCCCc2ccc(Cl)c(Cl)c2)C1 ZINC000474273496 1044831626 /nfs/dbraw/zinc/83/16/26/1044831626.db2.gz LWLWYJSWXCIFIE-OAHLLOKOSA-N 2 0 329.315 4.200 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCCN(Cc2cccs2)C1)C(C)(C)C(F)F ZINC000657861474 1044833748 /nfs/dbraw/zinc/83/37/48/1044833748.db2.gz TVGCUDSIDLIMQX-UONOGXRCSA-N 2 0 330.488 4.230 20 0 EIADRP CCn1c2ccccc2c2cc(C[NH2+]C[C@H]3CC[N@H+](CC)C3)ccc21 ZINC000327321134 1044834214 /nfs/dbraw/zinc/83/42/14/1044834214.db2.gz ZXNQIDJRHWMTOA-GOSISDBHSA-N 2 0 335.495 4.246 20 0 EIADRP Cc1ccc(CCC[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)cn1 ZINC000474278097 1044837043 /nfs/dbraw/zinc/83/70/43/1044837043.db2.gz OAHJTUGDBCSJKP-FQEVSTJZSA-N 2 0 343.559 4.299 20 0 EIADRP Cc1ccc([C@@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C2CCC2)o1 ZINC000543592816 1044875296 /nfs/dbraw/zinc/87/52/96/1044875296.db2.gz CZQBPNARIRTXNG-NRFANRHFSA-N 2 0 339.483 4.330 20 0 EIADRP CC(C)[NH+]1CCC(N2CC[NH+](C[C@H](C)CC3CCCCC3)CC2)CC1 ZINC000543630748 1044990271 /nfs/dbraw/zinc/99/02/71/1044990271.db2.gz AOFFIQFHFIAVFP-HXUWFJFHSA-N 2 0 349.607 4.083 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](CC(c3ccccc3)c3ccccc3)CC[C@@H]21 ZINC000509069623 1045054093 /nfs/dbraw/zinc/05/40/93/1045054093.db2.gz LDCIJLFNCAIJGV-GMAHTHKFSA-N 2 0 334.507 4.235 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](CC(c3ccccc3)c3ccccc3)CC[C@@H]21 ZINC000509069621 1045055720 /nfs/dbraw/zinc/05/57/20/1045055720.db2.gz LDCIJLFNCAIJGV-GGAORHGYSA-N 2 0 334.507 4.235 20 0 EIADRP COC1(C[C@H](C)[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)CCC1 ZINC000429402535 1045083915 /nfs/dbraw/zinc/08/39/15/1045083915.db2.gz IZBZQAHCIDPFQL-FHWLQOOXSA-N 2 0 344.543 4.080 20 0 EIADRP c1ccc([C@@H]2C[C@@H](N[C@H]3CC[N@@H+]4CCC[C@@H]4C3)c3ccccc3O2)cc1 ZINC000922887090 1045085533 /nfs/dbraw/zinc/08/55/33/1045085533.db2.gz YXDDQWCLAJJRSN-KPYOPSEVSA-N 2 0 348.490 4.468 20 0 EIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(-n3ccnc3C)c(F)c2)oc1C ZINC000282416860 1045138665 /nfs/dbraw/zinc/13/86/65/1045138665.db2.gz YKMRVVIXGAGAMG-ZDUSSCGKSA-N 2 0 327.403 4.380 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1Cc2cccc(Cl)c2C1 ZINC001168741224 1045229529 /nfs/dbraw/zinc/22/95/29/1045229529.db2.gz XLFIOEUITOUGAD-BZSNNMDCSA-N 2 0 332.919 4.146 20 0 EIADRP C[C@@H](CC[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000237565532 1045390019 /nfs/dbraw/zinc/39/00/19/1045390019.db2.gz REHDFNYQZCUUTD-UNMCSNQZSA-N 2 0 336.523 4.334 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccsc1Br ZINC000388884148 1045477653 /nfs/dbraw/zinc/47/76/53/1045477653.db2.gz JTJIJVJEGNZKCV-LBPRGKRZSA-N 2 0 333.339 4.111 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCc3cc(F)ccc32)cc1 ZINC000325990632 1045521699 /nfs/dbraw/zinc/52/16/99/1045521699.db2.gz CSTKKZPKOZHRTM-OAQYLSRUSA-N 2 0 326.459 4.445 20 0 EIADRP CC[NH+](CC)Cc1ccccc1Nc1ccc(OCC[NH+](C)C)cc1 ZINC001211994381 1045566214 /nfs/dbraw/zinc/56/62/14/1045566214.db2.gz WQSAHEHCLSJGRT-UHFFFAOYSA-N 2 0 341.499 4.212 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000397560521 1045643857 /nfs/dbraw/zinc/64/38/57/1045643857.db2.gz QYYXIDBPGAZQCO-GOSISDBHSA-N 2 0 340.486 4.259 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000397592065 1045679433 /nfs/dbraw/zinc/67/94/33/1045679433.db2.gz KEOPPSKWJPUCND-SFHVURJKSA-N 2 0 338.495 4.258 20 0 EIADRP C[NH+](C)CC1CC[NH+](Cc2ccc(SC(F)(F)F)cc2)CC1 ZINC000768301759 1045783663 /nfs/dbraw/zinc/78/36/63/1045783663.db2.gz KVRXLTSFXGTESS-UHFFFAOYSA-N 2 0 332.435 4.072 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCSc1ccccc1 ZINC000397977361 1045819514 /nfs/dbraw/zinc/81/95/14/1045819514.db2.gz KZLAHAZGPLXGSG-NQIIRXRSSA-N 2 0 340.536 4.279 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc2c(c1)COC(C)(C)O2 ZINC000768677087 1045825773 /nfs/dbraw/zinc/82/57/73/1045825773.db2.gz IGFVFQDAJRASOZ-QGZVFWFLSA-N 2 0 346.515 4.076 20 0 EIADRP c1nc(C2CCCC2)sc1CN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246818780 1045831404 /nfs/dbraw/zinc/83/14/04/1045831404.db2.gz RHCXCGHKTMYJSZ-LPHOPBHVSA-N 2 0 345.556 4.249 20 0 EIADRP CCc1ccccc1C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001170205351 1045926232 /nfs/dbraw/zinc/92/62/32/1045926232.db2.gz KRXUEXMWGBFESP-QHCPKHFHSA-N 2 0 334.507 4.347 20 0 EIADRP C[C@@H](Cc1ccccc1Cl)[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC001170257260 1045959628 /nfs/dbraw/zinc/95/96/28/1045959628.db2.gz XIYDSLMNIZNDJA-INIZCTEOSA-N 2 0 346.902 4.001 20 0 EIADRP C[C@H](Cc1ccccc1Cl)[NH+]1CCC(C2CC[NH+](C)CC2)CC1 ZINC001170285588 1045991125 /nfs/dbraw/zinc/99/11/25/1045991125.db2.gz SMBKZHKHCDFOGU-MRXNPFEDSA-N 2 0 334.935 4.325 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2coc(-c3cccc(F)c3)n2)CC1 ZINC000123393046 1046011502 /nfs/dbraw/zinc/01/15/02/1046011502.db2.gz MCPFLAGROJEYDT-UHFFFAOYSA-N 2 0 345.462 4.035 20 0 EIADRP CCC[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@H](O)c1ccccc1 ZINC000793235710 1046182406 /nfs/dbraw/zinc/18/24/06/1046182406.db2.gz BAAOBPGUSZIDAJ-FCHUYYIVSA-N 2 0 344.543 4.275 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccccc1Br ZINC000123618599 1046188758 /nfs/dbraw/zinc/18/87/58/1046188758.db2.gz UISBBDFMTDUXRK-AWEZNQCLSA-N 2 0 347.300 4.362 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cccc(Cl)c1 ZINC000162567850 1046351130 /nfs/dbraw/zinc/35/11/30/1046351130.db2.gz ZZWWCHLGXPIXKF-OAHLLOKOSA-N 2 0 332.875 4.131 20 0 EIADRP CC[N@H+](CCC1CC[NH+](C[C@@H]2CC2(Cl)Cl)CC1)CC1CC1 ZINC000771475330 1046408325 /nfs/dbraw/zinc/40/83/25/1046408325.db2.gz IYAUZLSOTJECTM-INIZCTEOSA-N 2 0 333.347 4.014 20 0 EIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@@H+](C3CC3)C1)CCCO2 ZINC000126535776 1046495951 /nfs/dbraw/zinc/49/59/51/1046495951.db2.gz XDDJVTJLBSAVKD-OXQOHEQNSA-N 2 0 328.500 4.098 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000771926701 1046518026 /nfs/dbraw/zinc/51/80/26/1046518026.db2.gz HKARKQKIUNZADM-UHFFFAOYSA-N 2 0 336.401 4.399 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cc3ccccc3nc2Cl)CC1 ZINC000917060504 1046599944 /nfs/dbraw/zinc/59/99/44/1046599944.db2.gz ZMWVPLNZNUGJQJ-UHFFFAOYSA-N 2 0 345.918 4.442 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC)c3ccccc23)C[C@H]1C ZINC000536659335 1046607740 /nfs/dbraw/zinc/60/77/40/1046607740.db2.gz WUPZOLPGGRKQMT-SJLPKXTDSA-N 2 0 326.484 4.153 20 0 EIADRP CCCCOc1ccc(C[N@H+](C)[C@H]2CC[NH+](CC)C[C@H]2C)cc1OC ZINC000536662347 1046630722 /nfs/dbraw/zinc/63/07/22/1046630722.db2.gz YEVPUQCZOXRDQR-MJGOQNOKSA-N 2 0 348.531 4.036 20 0 EIADRP CC(C)[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1F ZINC000459440653 1046667830 /nfs/dbraw/zinc/66/78/30/1046667830.db2.gz NYMDOQMPGBHWSQ-HXUWFJFHSA-N 2 0 345.437 4.316 20 0 EIADRP Cc1ccccc1[C@@H](CC(F)(F)F)NC1CC[NH+](C2CC2)CC1 ZINC000459525741 1046752243 /nfs/dbraw/zinc/75/22/43/1046752243.db2.gz VRPXGWJXXPXNEN-QGZVFWFLSA-N 2 0 326.406 4.205 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCc4c3cccc4F)CC2)CC1 ZINC000536826216 1046808344 /nfs/dbraw/zinc/80/83/44/1046808344.db2.gz JFZAYPMKHQKXRT-MYKUNDNFSA-N 2 0 330.491 4.446 20 0 EIADRP COc1cccc2c1C[C@H]([NH2+][C@H](C)c1ccc(-n3ccnc3C)cc1)C2 ZINC000459722637 1046864707 /nfs/dbraw/zinc/86/47/07/1046864707.db2.gz IDSVSYGRCBUHQY-DNVCBOLYSA-N 2 0 347.462 4.007 20 0 EIADRP C[N@@H+]1CCC[C@H](CC[NH2+]C2CC(c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000459726847 1046865056 /nfs/dbraw/zinc/86/50/56/1046865056.db2.gz BWUGPPLJBVSNFQ-MXWWQKGMSA-N 2 0 340.433 4.273 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@H]1c1ccccc1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000459730180 1046866721 /nfs/dbraw/zinc/86/67/21/1046866721.db2.gz LNWYHFCAVKASNX-PBNJOUANSA-N 2 0 338.470 4.182 20 0 EIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]C3CCC(C(F)F)CC3)CC2)C1 ZINC000459713204 1046868783 /nfs/dbraw/zinc/86/87/83/1046868783.db2.gz NZJYVQDSHMUDJQ-USSHROBNSA-N 2 0 328.491 4.443 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](c2ccccc2OC)C2CCCC2)C1 ZINC000536959191 1046870994 /nfs/dbraw/zinc/87/09/94/1046870994.db2.gz KUXJAFHGOMGCCV-UTKZUKDTSA-N 2 0 330.516 4.248 20 0 EIADRP CCc1ccc([C@H]([NH2+]C2CC[NH+](CCCOC)CC2)C(C)C)cc1 ZINC000536999217 1046891473 /nfs/dbraw/zinc/89/14/73/1046891473.db2.gz DERBUBRKHVZXJM-OAQYLSRUSA-N 2 0 332.532 4.037 20 0 EIADRP Cc1nc(F)ccc1C[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000787202671 1046949060 /nfs/dbraw/zinc/94/90/60/1046949060.db2.gz SKZDGJHTROITJB-INIZCTEOSA-N 2 0 333.495 4.006 20 0 EIADRP C[C@@H]1CCCC[C@@H]1C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000537160731 1046997301 /nfs/dbraw/zinc/99/73/01/1046997301.db2.gz GNFZKWUUZQXYLP-GGPKGHCWSA-N 2 0 342.527 4.391 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H]2COCc3cccc(Cl)c32)C1 ZINC000788524998 1047202129 /nfs/dbraw/zinc/20/21/29/1047202129.db2.gz ADTAJWLIMVPGOI-CRAIPNDOSA-N 2 0 336.907 4.013 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCc3ccc(Cl)nc32)C1 ZINC000788538619 1047216439 /nfs/dbraw/zinc/21/64/39/1047216439.db2.gz HZVLETKVVVJAOJ-UXLLHSPISA-N 2 0 335.923 4.070 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)c1cc[nH]c(=O)c1 ZINC000788530259 1047228398 /nfs/dbraw/zinc/22/83/98/1047228398.db2.gz WQMDQLIXXPNGJY-SJORKVTESA-N 2 0 339.483 4.012 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)[C@@]1(C)CCCO1 ZINC000556235956 1047600345 /nfs/dbraw/zinc/60/03/45/1047600345.db2.gz KQPARIKCOFEPCD-DBXWQHBBSA-N 2 0 330.516 4.108 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H](c3ccncc3)C3CC3)CC2)C1 ZINC000898322242 1047615294 /nfs/dbraw/zinc/61/52/94/1047615294.db2.gz IGTZEOQTCPNHHE-MAODMQOUSA-N 2 0 327.516 4.165 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H](c2ccncc2)C2CC2)CC1 ZINC000898322389 1047616248 /nfs/dbraw/zinc/61/62/48/1047616248.db2.gz KJRQLUABEYKPRQ-MAODMQOUSA-N 2 0 327.516 4.165 20 0 EIADRP C[C@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000556242196 1047622109 /nfs/dbraw/zinc/62/21/09/1047622109.db2.gz RJIGLFQNEXNFOK-QGQQZZQASA-N 2 0 334.507 4.290 20 0 EIADRP CC(C)Oc1ccc(C[NH2+][C@@H]2CCN(C)[C@H](c3ccccc3)C2)cc1 ZINC000550606177 1047747162 /nfs/dbraw/zinc/74/71/62/1047747162.db2.gz FNEDSKRBVSTLST-IRLDBZIGSA-N 2 0 338.495 4.399 20 0 EIADRP CC[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(Br)cc1 ZINC000130630971 1047757709 /nfs/dbraw/zinc/75/77/09/1047757709.db2.gz XUKJOKUTTCUMQS-QGZVFWFLSA-N 2 0 339.321 4.222 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H](c2ccncc2C(F)(F)F)C2CC2)CC1 ZINC001168305820 1047777490 /nfs/dbraw/zinc/77/74/90/1047777490.db2.gz NPWPYVIMNCBHRJ-MQBCKMQZSA-N 2 0 341.421 4.014 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cccc(C2CC2)c1 ZINC000550622183 1047777565 /nfs/dbraw/zinc/77/75/65/1047777565.db2.gz IWXZAMYJUYWRKS-KRWDZBQOSA-N 2 0 338.495 4.355 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc(C2CC2)c1 ZINC000550629446 1047781172 /nfs/dbraw/zinc/78/11/72/1047781172.db2.gz QVJGVMBURCECDX-KSZLIROESA-N 2 0 330.516 4.104 20 0 EIADRP Cc1cccc(O[C@H](C)C[NH2+][C@@H]2CCN(C)[C@@H](c3ccccc3)C2)c1 ZINC000550666092 1047810797 /nfs/dbraw/zinc/81/07/97/1047810797.db2.gz UQPDQSWAOYQUKT-SYYKKAFVSA-N 2 0 338.495 4.187 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1 ZINC000556585046 1047832202 /nfs/dbraw/zinc/83/22/02/1047832202.db2.gz FODJKCKQWQREHU-CDHQVMDDSA-N 2 0 330.516 4.040 20 0 EIADRP CC1(C)[C@@H]2C[C@@H]([NH+]3CCC([NH3+])(Cc4ccc(Cl)cc4)CC3)C[C@@H]21 ZINC001170736818 1047908900 /nfs/dbraw/zinc/90/89/00/1047908900.db2.gz CMUBIZWHXWZZDW-NNZMDNLPSA-N 2 0 332.919 4.110 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171066045 1047937142 /nfs/dbraw/zinc/93/71/42/1047937142.db2.gz GCPPFZDAVBWWOB-HWOWSKLDSA-N 2 0 341.326 4.313 20 0 EIADRP CC(C)[C@@H](NCC[C@@H](C)[N@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000498939036 1047991884 /nfs/dbraw/zinc/99/18/84/1047991884.db2.gz FDXHNMPIJDWPHW-DYESRHJHSA-N 2 0 343.490 4.418 20 0 EIADRP COc1ccc([C@@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c(C)c1OC ZINC000556871736 1048090758 /nfs/dbraw/zinc/09/07/58/1048090758.db2.gz WSCZTVCTFHVERA-CRAIPNDOSA-N 2 0 336.520 4.029 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](CC[C@H](O)c2ccccc2)CC1 ZINC000808734392 1048094887 /nfs/dbraw/zinc/09/48/87/1048094887.db2.gz VAPVNPFNPWHYNX-UGKGYDQZSA-N 2 0 344.543 4.087 20 0 EIADRP C[N@@H+](Cc1ccc(C(F)(F)F)cc1Cl)CC1CC[NH+](C)CC1 ZINC001143712628 1048170787 /nfs/dbraw/zinc/17/07/87/1048170787.db2.gz YMGQFRBPLWEVIB-UHFFFAOYSA-N 2 0 334.813 4.132 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@H]2CCc3cc(Cl)ccc3C2)C[C@](C)(C[NH3+])C1 ZINC001171100196 1048178762 /nfs/dbraw/zinc/17/87/62/1048178762.db2.gz PFAITRAOMLASLR-BJLQDIEVSA-N 2 0 334.935 4.331 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@@H]2CCc3cc(Cl)ccc3C2)C[C@](C)(C[NH3+])C1 ZINC001171100198 1048179308 /nfs/dbraw/zinc/17/93/08/1048179308.db2.gz PFAITRAOMLASLR-HBFSDRIKSA-N 2 0 334.935 4.331 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171116228 1048279806 /nfs/dbraw/zinc/27/98/06/1048279806.db2.gz LMEZNVGDTGRZGV-AQNXPRMDSA-N 2 0 334.935 4.440 20 0 EIADRP Cc1c(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)cccc1C(F)(F)F ZINC001143929729 1048297758 /nfs/dbraw/zinc/29/77/58/1048297758.db2.gz YTUFKRRMBFGJNC-UHFFFAOYSA-N 2 0 340.433 4.322 20 0 EIADRP Cc1ccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)s1 ZINC000499140408 1048337343 /nfs/dbraw/zinc/33/73/43/1048337343.db2.gz VVMJPZVXHNBMIK-REPLKXPHSA-N 2 0 326.509 4.342 20 0 EIADRP c1ccc([C@@H]2CC[C@H]([NH2+]CC3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000132608025 1048369466 /nfs/dbraw/zinc/36/94/66/1048369466.db2.gz SUHIWPFVIXEILL-RTWAWAEBSA-N 2 0 335.495 4.224 20 0 EIADRP c1ccc(CCC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499163144 1048371931 /nfs/dbraw/zinc/37/19/31/1048371931.db2.gz UEGQAMLYHRTDNE-NUNAXRQHSA-N 2 0 334.507 4.404 20 0 EIADRP Clc1cc2c(cc1Cl)C[C@H]([NH2+]CCCC[NH+]1CCCC1)CC2 ZINC001171139686 1048427192 /nfs/dbraw/zinc/42/71/92/1048427192.db2.gz POCQOYNCSIXSGM-MRXNPFEDSA-N 2 0 341.326 4.316 20 0 EIADRP CCc1cc(C[N@H+](C)Cc2ccc(-n3ccnc3)cc2)cc(CC)c1O ZINC001144150209 1048461049 /nfs/dbraw/zinc/46/10/49/1048461049.db2.gz DYZNVQLYPUNXNO-UHFFFAOYSA-N 2 0 349.478 4.335 20 0 EIADRP C[NH+](C)[C@H]1CC[C@@H]([NH2+][C@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171150765 1048501074 /nfs/dbraw/zinc/50/10/74/1048501074.db2.gz SZLKRACOFTVNKC-HRCADAONSA-N 2 0 341.326 4.313 20 0 EIADRP Cc1cc(F)ccc1[C@H](C)[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000815575485 1048536534 /nfs/dbraw/zinc/53/65/34/1048536534.db2.gz SRZIXWDAOWFUDA-ICSRJNTNSA-N 2 0 340.486 4.349 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(SC(F)F)cc1 ZINC000844922292 1048549271 /nfs/dbraw/zinc/54/92/71/1048549271.db2.gz ANZIYSYACBSDSU-LLVKDONJSA-N 2 0 340.414 4.450 20 0 EIADRP Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3cc[nH+]c(N4CCCCC4)c3)c2c1 ZINC001171166156 1048611004 /nfs/dbraw/zinc/61/10/04/1048611004.db2.gz BXXYTCSWNZRRJY-QGZVFWFLSA-N 2 0 348.494 4.214 20 0 EIADRP Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3ccc([C@@H]4CCC[NH2+]4)cc3)c2c1 ZINC001171169624 1048619805 /nfs/dbraw/zinc/61/98/05/1048619805.db2.gz QMKMZAYAFHTIJW-IERDGZPVSA-N 2 0 333.479 4.253 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCN(Cc2cc(-c3ccc(Cl)cc3)no2)C1 ZINC000076003075 1048833975 /nfs/dbraw/zinc/83/39/75/1048833975.db2.gz DFENAYZJWVUGIN-HNNXBMFYSA-N 2 0 347.890 4.159 20 0 EIADRP CC[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(OC)c(C[NH+](CC)CC)c2)CCO1 ZINC000817586688 1049019398 /nfs/dbraw/zinc/01/93/98/1049019398.db2.gz QCCWXQRRBTVELF-LSTHTHJFSA-N 2 0 348.531 4.145 20 0 EIADRP Cc1ccc(C)c([C@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000817894615 1049053174 /nfs/dbraw/zinc/05/31/74/1049053174.db2.gz NLLVCODARRYFIL-UCNVEGJOSA-N 2 0 336.479 4.210 20 0 EIADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CCCN1c2ccccc2Sc2ccccc21 ZINC000817913018 1049057683 /nfs/dbraw/zinc/05/76/83/1049057683.db2.gz TYPAKHZJVZHTOH-JKSUJKDBSA-N 2 0 341.524 4.395 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H]1[NH2+]CCCN1c2ccccc2Sc2ccccc21 ZINC000817912691 1049059556 /nfs/dbraw/zinc/05/95/56/1049059556.db2.gz RDJXATOOSPLVSU-CVEARBPZSA-N 2 0 339.508 4.149 20 0 EIADRP COc1ccccc1[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)C1CCCC1 ZINC000817947679 1049063925 /nfs/dbraw/zinc/06/39/25/1049063925.db2.gz FMRJIGRQWZMIFI-QFIPXVFZSA-N 2 0 338.495 4.218 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(F)c(Cl)cc1Cl ZINC000817947189 1049065166 /nfs/dbraw/zinc/06/51/66/1049065166.db2.gz MIZSYVQKVBDJQX-NSHDSACASA-N 2 0 341.257 4.485 20 0 EIADRP Cc1c([C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cnn1-c1ccccc1 ZINC000817962510 1049069672 /nfs/dbraw/zinc/06/96/72/1049069672.db2.gz JGSODUYDVFNHTA-CVEARBPZSA-N 2 0 334.467 4.051 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2C[NH3+])ccc1SC(F)F ZINC000817960102 1049070829 /nfs/dbraw/zinc/07/08/29/1049070829.db2.gz KNYMNEZWLGMZAZ-IACUBPJLSA-N 2 0 344.471 4.178 20 0 EIADRP FC(F)Sc1ccc2c(c1)CCC[C@H]2[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000817976644 1049074798 /nfs/dbraw/zinc/07/47/98/1049074798.db2.gz QCXMIIYYSZTLHQ-CVEARBPZSA-N 2 0 338.467 4.110 20 0 EIADRP Cc1c([C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cnn1-c1ccccc1 ZINC000817981779 1049077502 /nfs/dbraw/zinc/07/75/02/1049077502.db2.gz NPORQOQAJFWIML-JTSKRJEESA-N 2 0 348.494 4.312 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]3C[C@H]3C2)cc1C[NH+]1CCCCC1 ZINC000818359345 1049149545 /nfs/dbraw/zinc/14/95/45/1049149545.db2.gz JKPZWVDIZLATGO-BOLBYERCSA-N 2 0 328.500 4.130 20 0 EIADRP C[NH+](C)CC[C@@H]([NH2+][C@H]1CCc2c(F)cc(F)cc2C1)c1ccccc1 ZINC001171335783 1049357426 /nfs/dbraw/zinc/35/74/26/1049357426.db2.gz ATQNHPUSZQFFND-GHTZIAJQSA-N 2 0 344.449 4.105 20 0 EIADRP Fc1cccc2c1C[C@@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CC2 ZINC001170947236 1049502126 /nfs/dbraw/zinc/50/21/26/1049502126.db2.gz UDAKFYVPWYASRN-FQEVSTJZSA-N 2 0 338.470 4.069 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@H]2CCc3c(F)cc(F)cc3C2)CC1 ZINC001171359571 1049509998 /nfs/dbraw/zinc/50/99/98/1049509998.db2.gz FCVAHWPHBHCKKD-BZSNNMDCSA-N 2 0 336.470 4.065 20 0 EIADRP CC(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cc(F)cc(F)c2C1 ZINC001170681251 1049523627 /nfs/dbraw/zinc/52/36/27/1049523627.db2.gz NKUKVLOSACCJQK-BZSNNMDCSA-N 2 0 336.470 4.050 20 0 EIADRP CCCCC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)c1ccccc1 ZINC000773069300 1049565563 /nfs/dbraw/zinc/56/55/63/1049565563.db2.gz NXNBSPAQALVQKW-BDTNDASRSA-N 2 0 344.543 4.275 20 0 EIADRP CCC(CC)[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2c(F)cccc2C1 ZINC001171414154 1049645732 /nfs/dbraw/zinc/64/57/32/1049645732.db2.gz NQKOXKYZILIEFM-BHIYHBOVSA-N 2 0 332.507 4.444 20 0 EIADRP C[NH+](C)CC[C@@H]([NH2+][C@@H]1CCc2cc(F)c(F)cc2C1)c1ccccc1 ZINC001171454973 1049709938 /nfs/dbraw/zinc/70/99/38/1049709938.db2.gz XXYISNKAVNGLTM-WIYYLYMNSA-N 2 0 344.449 4.105 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1CCc2cc(F)c(F)cc2C1 ZINC001171495140 1049721874 /nfs/dbraw/zinc/72/18/74/1049721874.db2.gz XTNDEBFJWRHBDH-GBESFXJTSA-N 2 0 348.481 4.161 20 0 EIADRP c1cc(N2CCC[N@@H+](Cc3ccc(C4CCCC4)cc3)CC2)cc[nH+]1 ZINC001171554462 1049754103 /nfs/dbraw/zinc/75/41/03/1049754103.db2.gz HXWLLUPVXQCZDO-UHFFFAOYSA-N 2 0 335.495 4.452 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)CC1(C)C ZINC001171613748 1049765424 /nfs/dbraw/zinc/76/54/24/1049765424.db2.gz PDCWQEIKIZNPNS-UHFFFAOYSA-N 3 0 343.559 4.023 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CC2CC[NH+](C3CCCCC3)CC2)CC1(C)C ZINC001171622964 1049767944 /nfs/dbraw/zinc/76/79/44/1049767944.db2.gz FLIIEOAGSBACDX-UHFFFAOYSA-N 3 0 349.607 4.272 20 0 EIADRP COc1ccc(CC2([NH2+]C3CC(C)(C)[NH+](C)C(C)(C)C3)CC2)cc1 ZINC001171627518 1049769021 /nfs/dbraw/zinc/76/90/21/1049769021.db2.gz UGGNRMDRJKWQNA-UHFFFAOYSA-N 2 0 330.516 4.011 20 0 EIADRP CCC(CC)[N@@H+](C1CC(C)(C)[NH+](C)C(C)(C)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001171627126 1049769442 /nfs/dbraw/zinc/76/94/42/1049769442.db2.gz LBTIFNBFZFOPBC-SAABIXHNSA-N 3 0 337.596 4.398 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]C2(c3cccc(F)c3)CCOCC2)CC1(C)C ZINC001171627541 1049769787 /nfs/dbraw/zinc/76/97/87/1049769787.db2.gz VOPAMXQSMOFKAY-UHFFFAOYSA-N 2 0 348.506 4.072 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC001171658590 1049772027 /nfs/dbraw/zinc/77/20/27/1049772027.db2.gz TXNNNIOJXHZJKC-NZQKXSOJSA-N 2 0 336.523 4.428 20 0 EIADRP C[NH+]1C(C)(C)CC([NH+]2CCC(COc3ccccc3)CC2)CC1(C)C ZINC001171637894 1049779868 /nfs/dbraw/zinc/77/98/68/1049779868.db2.gz RGGLZVWUAXKYAD-UHFFFAOYSA-N 2 0 344.543 4.429 20 0 EIADRP C[NH2+]Cc1ccc2c(ccn2[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC001171744479 1049790187 /nfs/dbraw/zinc/79/01/87/1049790187.db2.gz HARYVHNJWSHJRN-LAUBAEHRSA-N 2 0 333.479 4.196 20 0 EIADRP C[C@@H]1C[C@@H](n2c(C[NH3+])cc3cccc(F)c32)C[N@@H+]1Cc1ccccc1 ZINC001171741663 1049801422 /nfs/dbraw/zinc/80/14/22/1049801422.db2.gz QSJMHHDTQCOPDE-DNVCBOLYSA-N 2 0 337.442 4.075 20 0 EIADRP Fc1cccc2c1C[C@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)CC2 ZINC001170997068 1049808131 /nfs/dbraw/zinc/80/81/31/1049808131.db2.gz QMHYUUJDASMPIQ-RTBURBONSA-N 2 0 330.491 4.023 20 0 EIADRP CC[NH+](CC)CCCC[NH2+][C@@H](C)Cc1ccc(C(F)(F)F)cc1 ZINC001171958968 1049822503 /nfs/dbraw/zinc/82/25/03/1049822503.db2.gz MMUHFNYBDCKYAC-HNNXBMFYSA-N 2 0 330.438 4.348 20 0 EIADRP CC1(C)C[C@H]([NH2+]CCc2cccs2)CC[N@@H+]1Cc1ccccc1 ZINC001171963614 1049825796 /nfs/dbraw/zinc/82/57/96/1049825796.db2.gz IICPWFNMWWCHSN-GOSISDBHSA-N 2 0 328.525 4.323 20 0 EIADRP CCCC[N@H+](C)CCCN[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171964550 1049826509 /nfs/dbraw/zinc/82/65/09/1049826509.db2.gz GTLKQKJBUPOLHO-OAQYLSRUSA-N 2 0 345.575 4.141 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001171974437 1049835982 /nfs/dbraw/zinc/83/59/82/1049835982.db2.gz UHCUKPZPAMQEDT-HNNXBMFYSA-N 2 0 340.433 4.054 20 0 EIADRP CC1(C)C[C@H](n2ncc3c2cccc3C[NH3+])CC[N@@H+]1Cc1ccccc1 ZINC001171981987 1049838284 /nfs/dbraw/zinc/83/82/84/1049838284.db2.gz FSZWIBFUCBRRQG-LJQANCHMSA-N 2 0 348.494 4.111 20 0 EIADRP CC1(C)C[C@@H](n2ncc3cccc(C[NH3+])c32)CC[N@@H+]1Cc1ccccc1 ZINC001171982083 1049838307 /nfs/dbraw/zinc/83/83/07/1049838307.db2.gz HCNRTDDKFHTOLZ-FQEVSTJZSA-N 2 0 348.494 4.111 20 0 EIADRP CC1(C)C[C@@H]([NH+]2CC[C@@H](c3ccncc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171983734 1049838851 /nfs/dbraw/zinc/83/88/51/1049838851.db2.gz GNPYKHHGKJIARF-YADHBBJMSA-N 2 0 349.522 4.314 20 0 EIADRP CCCC[NH+]1CCC([N@H+](C)[C@H]2CCc3cc(F)cc(F)c3C2)CC1 ZINC001170717255 1049839175 /nfs/dbraw/zinc/83/91/75/1049839175.db2.gz URWWURVVBLBJFN-SFHVURJKSA-N 2 0 336.470 4.018 20 0 EIADRP CC1(C)C[C@@H]([NH+]2CC[C@@H](c3ccccn3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171983815 1049839677 /nfs/dbraw/zinc/83/96/77/1049839677.db2.gz GWHZCPGRAPDMNJ-RTWAWAEBSA-N 2 0 349.522 4.314 20 0 EIADRP CC1(C)C[C@H]([NH+]2CC[C@@H](c3cccnc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171985387 1049840845 /nfs/dbraw/zinc/84/08/45/1049840845.db2.gz WAWRLKIWNLBWIJ-FGZHOGPDSA-N 2 0 349.522 4.314 20 0 EIADRP C[N@H+](CCc1cccnc1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076445 1049843878 /nfs/dbraw/zinc/84/38/78/1049843878.db2.gz YQBUQILZRJSANY-NUNAXRQHSA-N 2 0 349.522 4.142 20 0 EIADRP CO[C@H]1CC[C@@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172078805 1049846680 /nfs/dbraw/zinc/84/66/80/1049846680.db2.gz IXJKXAMNDOMHJC-YPHBOWRQSA-N 2 0 342.527 4.119 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H](N2CC(c4cccnc4)C2)C3)cc1 ZINC001172084534 1049847325 /nfs/dbraw/zinc/84/73/25/1049847325.db2.gz YMFFQKQELOIIHH-JKHIJQBDSA-N 2 0 347.506 4.067 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Br)s1 ZINC001172103745 1049855465 /nfs/dbraw/zinc/85/54/65/1049855465.db2.gz XDUHJBGCTDZDSX-LPWJVIDDSA-N 2 0 343.334 4.177 20 0 EIADRP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1C(F)(F)F ZINC001172106010 1049857307 /nfs/dbraw/zinc/85/73/07/1049857307.db2.gz MDTDWHUTXURRPI-PHZGNYQRSA-N 2 0 326.406 4.119 20 0 EIADRP C[N@H+](Cc1cccc(C(F)(F)F)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172124294 1049859577 /nfs/dbraw/zinc/85/95/77/1049859577.db2.gz KKJWEGURDRXURG-FVQHAEBGSA-N 2 0 326.406 4.153 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1CSc2ccccc2C1 ZINC001172206332 1049864612 /nfs/dbraw/zinc/86/46/12/1049864612.db2.gz ONPOOHUOZSJKIU-OTWHNJEPSA-N 2 0 330.541 4.042 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1CSc2ccccc2C1 ZINC001172206330 1049864684 /nfs/dbraw/zinc/86/46/84/1049864684.db2.gz ONPOOHUOZSJKIU-GBESFXJTSA-N 2 0 330.541 4.042 20 0 EIADRP c1ccc2c(c1)C[C@H]([NH2+]C1CC[NH+](CC3CCCCC3)CC1)CS2 ZINC001172205714 1049864757 /nfs/dbraw/zinc/86/47/57/1049864757.db2.gz WXNBQBGCMKYDED-FQEVSTJZSA-N 2 0 344.568 4.338 20 0 EIADRP c1ccc2c(c1)C[C@@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CS2 ZINC001172193925 1049868416 /nfs/dbraw/zinc/86/84/16/1049868416.db2.gz PLNLUEOTEJJYAD-HXUWFJFHSA-N 2 0 338.520 4.089 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H](CC2CCC2)c2cccc(F)c2)CC1 ZINC001172248618 1049872308 /nfs/dbraw/zinc/87/23/08/1049872308.db2.gz KVMXVQPBWSBRPT-NRFANRHFSA-N 2 0 348.506 4.148 20 0 EIADRP C[C@@H]1CC[C@@H]([NH+]2CCC3(CC[N@H+](Cc4ccoc4)C3)CC2)C[C@@H]1C ZINC001172379937 1049885683 /nfs/dbraw/zinc/88/56/83/1049885683.db2.gz UJZIVSXLMXZTKI-WSTZPKSXSA-N 2 0 330.516 4.392 20 0 EIADRP COc1ccccc1CN1CCC([NH2+][C@@H]2CC[C@H](C)[C@H](C)C2)CC1 ZINC001172359716 1049895120 /nfs/dbraw/zinc/89/51/20/1049895120.db2.gz NHSAEIGPZTWBSO-SQGPQFPESA-N 2 0 330.516 4.074 20 0 EIADRP COc1ccccc1CN1CCC([NH2+][C@@H]2CC[C@H](C)[C@@H](C)C2)CC1 ZINC001172359709 1049895493 /nfs/dbraw/zinc/89/54/93/1049895493.db2.gz NHSAEIGPZTWBSO-ABSDTBQOSA-N 2 0 330.516 4.074 20 0 EIADRP COc1ccc(CN2CCC([NH2+][C@@H]3CC[C@@H](C)[C@H](C)C3)CC2)cc1 ZINC001172359542 1049895501 /nfs/dbraw/zinc/89/55/01/1049895501.db2.gz KCLAXRZSLYCSBC-MBOZVWFJSA-N 2 0 330.516 4.074 20 0 EIADRP CCCCCC[C@H](CCC)[NH+]1CCN(CC2CC[NH+](C)CC2)CC1 ZINC001172382930 1049903438 /nfs/dbraw/zinc/90/34/38/1049903438.db2.gz IQURWQZRGUOWHC-NRFANRHFSA-N 2 0 337.596 4.085 20 0 EIADRP CC(C)OCC[C@H](C)[NH+]1CCC2(CC[C@H]2[N@H+](C)Cc2ccco2)CC1 ZINC001172446144 1049914198 /nfs/dbraw/zinc/91/41/98/1049914198.db2.gz ISHMXWZCLOJJIJ-AZUAARDMSA-N 2 0 348.531 4.160 20 0 EIADRP CC(C)OCC[C@@H](C)[N@@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001172453241 1049916476 /nfs/dbraw/zinc/91/64/76/1049916476.db2.gz FRPUHDBNGXOMTI-IRLDBZIGSA-N 2 0 344.543 4.178 20 0 EIADRP CC(C)COCC[C@H](C)[N@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172467181 1049919962 /nfs/dbraw/zinc/91/99/62/1049919962.db2.gz IVMOEAGMUDMLMZ-JBACZVJFSA-N 2 0 332.532 4.210 20 0 EIADRP C[NH+]1CCC(C2CC[NH+]([C@H]3CC[C@@H](c4ccccc4)C3)CC2)CC1 ZINC001172563644 1049934782 /nfs/dbraw/zinc/93/47/82/1049934782.db2.gz LNNQEKSDRKNVIY-YADHBBJMSA-N 2 0 326.528 4.377 20 0 EIADRP CC(C)[PH+](CC[NH2+][C@H]1CCN(Cc2ccccc2)C(=O)C1)C(C)C ZINC001172679422 1049963024 /nfs/dbraw/zinc/96/30/24/1049963024.db2.gz MOAHGFQCOXAEMR-IBGZPJMESA-N 2 0 348.471 4.066 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2sc(-c3ccccc3F)nc2C)C1 ZINC000246858965 1050003686 /nfs/dbraw/zinc/00/36/86/1050003686.db2.gz CWXYCSHDNGMBCU-HIFRSBDPSA-N 2 0 347.503 4.250 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2sc(-c3ccccc3F)nc2C)C1 ZINC000246858980 1050004184 /nfs/dbraw/zinc/00/41/84/1050004184.db2.gz CWXYCSHDNGMBCU-UKRRQHHQSA-N 2 0 347.503 4.250 20 0 EIADRP C[C@H](N[C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(Br)s1 ZINC000246945109 1050006212 /nfs/dbraw/zinc/00/62/12/1050006212.db2.gz HCUDNDCJLJLKLP-SDDRHHMPSA-N 2 0 331.323 4.034 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1cncc(F)c1 ZINC000246959050 1050007865 /nfs/dbraw/zinc/00/78/65/1050007865.db2.gz ILVWQLCTZKDODH-IAGOWNOFSA-N 2 0 341.474 4.446 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1F ZINC000248404758 1050053540 /nfs/dbraw/zinc/05/35/40/1050053540.db2.gz QQSGFBNKVBVSOF-ZOBUZTSGSA-N 2 0 334.479 4.138 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)CCCS2 ZINC000249181281 1050094540 /nfs/dbraw/zinc/09/45/40/1050094540.db2.gz IIFXFDGMSHGQPO-APWZRJJASA-N 2 0 348.556 4.332 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000249270303 1050096312 /nfs/dbraw/zinc/09/63/12/1050096312.db2.gz JZQMFMKZEQMDBW-SJORKVTESA-N 2 0 328.422 4.349 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc3ccccc3)C1)CC2 ZINC001172825420 1050166747 /nfs/dbraw/zinc/16/67/47/1050166747.db2.gz GXKYYGRURNLFIJ-QPPBQGQZSA-N 2 0 348.534 4.354 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([NH2+][C@@H]1CCN(Cc3ccccc3)C[C@H]1C)CC2 ZINC001172837770 1050173574 /nfs/dbraw/zinc/17/35/74/1050173574.db2.gz MWUAHBKSJWLZRK-CTUHWIOQSA-N 2 0 348.534 4.353 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccc(Cl)nc3)cc2)C1 ZINC001177256641 1050176132 /nfs/dbraw/zinc/17/61/32/1050176132.db2.gz KIPRVWUNWUHNCM-INIZCTEOSA-N 2 0 343.902 4.257 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2cn(C)nc2C2CCCCC2)C1 ZINC001177299276 1050179945 /nfs/dbraw/zinc/17/99/45/1050179945.db2.gz NJEBONZTLZTNCI-GOSISDBHSA-N 2 0 346.563 4.070 20 0 EIADRP CCOc1c(Cl)cccc1C[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC001177299247 1050180413 /nfs/dbraw/zinc/18/04/13/1050180413.db2.gz METZTIGLMJEHSP-INIZCTEOSA-N 2 0 338.923 4.340 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@H](C)Cc2c(F)cccc2Cl)CC1 ZINC001172852052 1050190631 /nfs/dbraw/zinc/19/06/31/1050190631.db2.gz NKUSOZHXFQEUHD-CQSZACIVSA-N 2 0 326.887 4.120 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)[C@@H](C)Cc2ccc(F)cc2Cl)CC1 ZINC001172869329 1050206808 /nfs/dbraw/zinc/20/68/08/1050206808.db2.gz ZKLOXGVHKKOTRY-HNNXBMFYSA-N 2 0 340.914 4.462 20 0 EIADRP C[C@@H](C[NH2+]Cc1cccc(Oc2ccccn2)c1)C[NH+]1CCCCC1 ZINC001177416512 1050209542 /nfs/dbraw/zinc/20/95/42/1050209542.db2.gz QXRSZHVWZQUSTM-SFHVURJKSA-N 2 0 339.483 4.086 20 0 EIADRP C[C@@H](CSc1ccc(Cl)cc1)[NH2+]C1CCC(CC[NH3+])CC1 ZINC001172879474 1050220383 /nfs/dbraw/zinc/22/03/83/1050220383.db2.gz MXWDXTUTRYCJRQ-HLIUYOAVSA-N 2 0 326.937 4.318 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH2+]CCC[NH+]1CCCCC1 ZINC001172881694 1050222806 /nfs/dbraw/zinc/22/28/06/1050222806.db2.gz HOXNYGBYSAZFRG-OAHLLOKOSA-N 2 0 326.937 4.286 20 0 EIADRP CC[C@@H](C)CN(C)c1ccc(F)cc1C[NH2+]CCC1CC[NH+](C)CC1 ZINC001177744594 1050291613 /nfs/dbraw/zinc/29/16/13/1050291613.db2.gz XPOXNURFMMBRHZ-QGZVFWFLSA-N 2 0 349.538 4.130 20 0 EIADRP C[C@@H](Cc1ccc(OC(F)(F)F)cc1)[NH2+]C1CCC(CC[NH3+])CC1 ZINC001173075713 1050291938 /nfs/dbraw/zinc/29/19/38/1050291938.db2.gz MFQHWPQRZXEYDU-HLIUYOAVSA-N 2 0 344.421 4.013 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](CCO)c2cccc(Cl)c2)CC1 ZINC001173104284 1050304349 /nfs/dbraw/zinc/30/43/49/1050304349.db2.gz MEZPDORDVQHQAI-ACBHZAAOSA-N 2 0 338.923 4.006 20 0 EIADRP CC[NH+](CC)C1CCC(n2cc(CC[NH3+])c3cccc(C)c32)CC1 ZINC001173102500 1050305657 /nfs/dbraw/zinc/30/56/57/1050305657.db2.gz YXWPZQSIJPHPII-UHFFFAOYSA-N 2 0 327.516 4.276 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccccc2N2CCCCC2)CC1 ZINC001173106823 1050308079 /nfs/dbraw/zinc/30/80/79/1050308079.db2.gz DSPZFJPPFZIORL-UHFFFAOYSA-N 2 0 343.559 4.420 20 0 EIADRP CC[NH+](CC)C1CCC(n2c3ccc(F)cc3c3c2C[NH2+]CC3)CC1 ZINC001173114182 1050309845 /nfs/dbraw/zinc/30/98/45/1050309845.db2.gz YUDJXZILJCNUBG-UHFFFAOYSA-N 2 0 343.490 4.252 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@@H](Oc3ccccc3C)C2)CC1 ZINC001173112198 1050310040 /nfs/dbraw/zinc/31/00/40/1050310040.db2.gz SMSVAQANODZVDG-XVAXZDLZSA-N 2 0 344.543 4.491 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC(Oc3cccc(C)c3)CC2)CC1 ZINC001173113314 1050310248 /nfs/dbraw/zinc/31/02/48/1050310248.db2.gz NAJSQFIKZGRVCS-UHFFFAOYSA-N 2 0 344.543 4.491 20 0 EIADRP CC[NH+](CC)C1CCC([N@H+]2CC=C(c3ccc(OC)cc3)CC2)CC1 ZINC001173112624 1050310485 /nfs/dbraw/zinc/31/04/85/1050310485.db2.gz AWGVALAQEVLIFL-UHFFFAOYSA-N 2 0 342.527 4.437 20 0 EIADRP CC(C)([NH3+])CCNCCC(C)(C)[NH2+]C1CCC2(CCCCC2)CC1 ZINC001173115858 1050312717 /nfs/dbraw/zinc/31/27/17/1050312717.db2.gz CNIGPNJNKQLMQG-UHFFFAOYSA-N 2 0 337.596 4.355 20 0 EIADRP C[C@@H](C[NH2+]C1CCC(Oc2ccccc2)CC1)CC(C)(C)CC[NH3+] ZINC001173199120 1050343499 /nfs/dbraw/zinc/34/34/99/1050343499.db2.gz TWRDUVIUWCCVDZ-PGYGNJIDSA-N 2 0 332.532 4.367 20 0 EIADRP FC(F)(F)Sc1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000775023999 1050347643 /nfs/dbraw/zinc/34/76/43/1050347643.db2.gz PSVOOKWYXGRCPX-UHFFFAOYSA-N 2 0 344.446 4.263 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)C2CCC(Oc3ccccc3)CC2)CC1 ZINC001173204436 1050363032 /nfs/dbraw/zinc/36/30/32/1050363032.db2.gz PBCIDIAUSCIGTC-UHFFFAOYSA-N 2 0 344.543 4.429 20 0 EIADRP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001173207339 1050368553 /nfs/dbraw/zinc/36/85/53/1050368553.db2.gz QVKQXBUGCXEIDV-PMOQBDJRSA-N 2 0 348.534 4.481 20 0 EIADRP CCCC[C@H](CC(C)C)[NH2+]C1(C(=O)OC(C)(C)C)CCC([NH3+])CC1 ZINC001173249300 1050376055 /nfs/dbraw/zinc/37/60/55/1050376055.db2.gz IPIZXCMBQSVAFY-OHTSDLOESA-N 2 0 340.552 4.163 20 0 EIADRP CC[C@H]1CC[C@@H]([N@H+](Cc2cccc(OC)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173271847 1050392548 /nfs/dbraw/zinc/39/25/48/1050392548.db2.gz RMIPXAIPMTYXTP-FRYIKTPZSA-N 2 0 330.516 4.346 20 0 EIADRP CCSC[C@H](C)[NH+]1CCC(N(C)Cc2ccc(Cl)cc2)CC1 ZINC001173313557 1050406019 /nfs/dbraw/zinc/40/60/19/1050406019.db2.gz CPNWMBAZDFPTJJ-HNNXBMFYSA-N 2 0 340.964 4.378 20 0 EIADRP [NH3+]C1(Cc2cccnc2)CC[NH+]([C@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173346167 1050436602 /nfs/dbraw/zinc/43/66/02/1050436602.db2.gz ZQKRCIQZRPUJPQ-FQEVSTJZSA-N 2 0 341.543 4.311 20 0 EIADRP CC[N@@H+]1CC[C@@H](n2cc(C[NH2+]Cc3ccccc3)c3ccccc32)C1 ZINC001173367370 1050442733 /nfs/dbraw/zinc/44/27/33/1050442733.db2.gz GXBCXPQXBXQQMQ-HXUWFJFHSA-N 2 0 333.479 4.198 20 0 EIADRP CSCc1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC001178458103 1050474058 /nfs/dbraw/zinc/47/40/58/1050474058.db2.gz PTDPNSDNBIBCTM-QFBILLFUSA-N 2 0 332.557 4.292 20 0 EIADRP CC(C)Oc1ccc(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC001178457722 1050474293 /nfs/dbraw/zinc/47/42/93/1050474293.db2.gz CGLPVPRKQIHJMJ-HKUYNNGSSA-N 2 0 330.516 4.216 20 0 EIADRP CC[N@H+]1C[C@@H]2C[NH+]([C@@H](C)CCc3ccc(Cl)c(Cl)c3)C[C@@H]2C1 ZINC001173551151 1050488501 /nfs/dbraw/zinc/48/85/01/1050488501.db2.gz QYJWWIJXKUVYGU-CWRNSKLLSA-N 2 0 341.326 4.198 20 0 EIADRP CCOC(=O)[C@H]1CC12CCC([NH2+]CC[PH+](C(C)C)C(C)C)CC2 ZINC001173609911 1050507549 /nfs/dbraw/zinc/50/75/49/1050507549.db2.gz VZSLNADSYYRQQZ-TVRKMHQQSA-N 2 0 341.476 4.387 20 0 EIADRP Cc1cccc2cc(C[NH2+]CC3CC[NH+](C4CC4)CC3)c(Cl)nc12 ZINC001178605809 1050515807 /nfs/dbraw/zinc/51/58/07/1050515807.db2.gz QTNNBPSTUMSXOM-UHFFFAOYSA-N 2 0 343.902 4.161 20 0 EIADRP Cc1cc(C[NH2+]CCCCC[NH+]2CCCC2)ccc1Br ZINC001178811798 1050559405 /nfs/dbraw/zinc/55/94/05/1050559405.db2.gz YCZFKDYPAWEQKC-UHFFFAOYSA-N 2 0 339.321 4.113 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ccsc2)ccc1OC ZINC000182423719 1050650681 /nfs/dbraw/zinc/65/06/81/1050650681.db2.gz JPMMXTUSPBJOBI-OAHLLOKOSA-N 2 0 332.513 4.449 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2nc(-c3ccccc3)cs2)CC1 ZINC000093688526 1050660974 /nfs/dbraw/zinc/66/09/74/1050660974.db2.gz SXVAKVQIOIDOTO-UHFFFAOYSA-N 2 0 343.540 4.364 20 0 EIADRP C[NH+]1CCC(C[NH2+]Cc2ccc(Cl)cc2)(c2ccccc2)CC1 ZINC001179369873 1050684951 /nfs/dbraw/zinc/68/49/51/1050684951.db2.gz MSZZIMFVULZFGA-UHFFFAOYSA-N 2 0 328.887 4.093 20 0 EIADRP CN(C)Cc1csc(C[NH2+][C@H]2CCCC[C@H](c3ccccc3)C2)n1 ZINC001179607789 1050732045 /nfs/dbraw/zinc/73/20/45/1050732045.db2.gz JXZVVJYMOHPRSB-ROUUACIJSA-N 2 0 343.540 4.411 20 0 EIADRP CCCCCCOc1cccc(C[NH2+][C@@H]2CC[C@@H]3C[N@H+](C)C[C@@H]23)c1 ZINC001179816795 1050786557 /nfs/dbraw/zinc/78/65/57/1050786557.db2.gz NTXGFHPXNHPHEP-HMXCVIKNSA-N 2 0 330.516 4.076 20 0 EIADRP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000152995068 1050924211 /nfs/dbraw/zinc/92/42/11/1050924211.db2.gz HWNZODOSUZOXCJ-CAOSSQGBSA-N 2 0 340.433 4.414 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21)C1CCCC1 ZINC001180301654 1050945775 /nfs/dbraw/zinc/94/57/75/1050945775.db2.gz OUDFYHZMGVUPNG-ZHNGQKSSSA-N 2 0 326.528 4.455 20 0 EIADRP CO[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC001180350279 1050964287 /nfs/dbraw/zinc/96/42/87/1050964287.db2.gz XOTYMGOJWPLFAR-VLCRHTCISA-N 2 0 344.543 4.082 20 0 EIADRP Cc1ccc(-c2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)s2)cc1 ZINC000620109489 1051024885 /nfs/dbraw/zinc/02/48/85/1051024885.db2.gz JLZQDFKRUGVFEU-ZWKOTPCHSA-N 2 0 326.509 4.440 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC001180810298 1051088100 /nfs/dbraw/zinc/08/81/00/1051088100.db2.gz KZVSXISZRZMZFE-HZPDHXFCSA-N 2 0 342.449 4.491 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@@H](C)SC)cc1C[NH+]1CCCCC1 ZINC000183378190 1051102901 /nfs/dbraw/zinc/10/29/01/1051102901.db2.gz WTMDLUBOAOHFFD-CVEARBPZSA-N 2 0 336.545 4.083 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CCc2ccsc2)ccc1OC ZINC000775365188 1051134529 /nfs/dbraw/zinc/13/45/29/1051134529.db2.gz PAHFXVCTRHNTAA-MRXNPFEDSA-N 2 0 346.540 4.492 20 0 EIADRP C(CCC[NH2+][C@@H]1CC[C@@H]2SCCS[C@@H]12)CCC[NH+]1CCCC1 ZINC000775385092 1051176697 /nfs/dbraw/zinc/17/66/97/1051176697.db2.gz IXZRFYXGVGZKRO-SQNIBIBYSA-N 2 0 342.618 4.002 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](C)c1ccccc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000544573857 1051194161 /nfs/dbraw/zinc/19/41/61/1051194161.db2.gz ZKSAYQHFDGPYIQ-QZTJIDSGSA-N 2 0 326.484 4.081 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2cccc(OC3CCCC3)c2)c1 ZINC000077506823 1051217772 /nfs/dbraw/zinc/21/77/72/1051217772.db2.gz YJFYGMOUHARVRY-UHFFFAOYSA-N 2 0 338.495 4.359 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)C1 ZINC000163218333 1051241829 /nfs/dbraw/zinc/24/18/29/1051241829.db2.gz COIYEYQSBOTCQA-DOTOQJQBSA-N 2 0 343.540 4.419 20 0 EIADRP CC(C)C[N@H+](CC[C@@H]1CCC[NH+]1C)Cc1ccc(F)c(Cl)c1 ZINC001174916076 1051246474 /nfs/dbraw/zinc/24/64/74/1051246474.db2.gz OCJGGDMBIDVXRE-INIZCTEOSA-N 2 0 326.887 4.421 20 0 EIADRP CC(C)c1ccc(C[N@@H+]2CCO[C@@H](CCC[NH+](C)C)C2)c(C(C)C)c1 ZINC001174933821 1051257666 /nfs/dbraw/zinc/25/76/66/1051257666.db2.gz OWLWOSKBVPOHLJ-NRFANRHFSA-N 2 0 346.559 4.476 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)[C@H]1CC1(C)C ZINC001181656162 1051270573 /nfs/dbraw/zinc/27/05/73/1051270573.db2.gz PJGHGOIWTFLYIA-WOJBJXKFSA-N 2 0 330.516 4.074 20 0 EIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(C)c(Cl)n1 ZINC001175062436 1051314431 /nfs/dbraw/zinc/31/44/31/1051314431.db2.gz QFGIHNQZVCXVBF-UHFFFAOYSA-N 2 0 331.891 4.127 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc[nH]2)cc1C[NH+]1CCCCC1 ZINC000775425291 1051316772 /nfs/dbraw/zinc/31/67/72/1051316772.db2.gz XOENLWBRRLWMMG-DLBZAZTESA-N 2 0 341.499 4.421 20 0 EIADRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2cccc(C(F)(F)F)c2Cl)CC1 ZINC001205546372 1051318671 /nfs/dbraw/zinc/31/86/71/1051318671.db2.gz UOSBIZJMDCXUFL-AWEZNQCLSA-N 2 0 338.776 4.012 20 0 EIADRP C=Cc1ccc(CC[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC001181945462 1051358683 /nfs/dbraw/zinc/35/86/83/1051358683.db2.gz MFCASKALIGYAED-XXBNENTESA-N 2 0 334.507 4.372 20 0 EIADRP COC1CCC(C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)CC1 ZINC001182196751 1051423616 /nfs/dbraw/zinc/42/36/16/1051423616.db2.gz VYPCYJWRXXRGSQ-IRQNMHNUSA-N 2 0 344.543 4.084 20 0 EIADRP COc1ccc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)cc1C ZINC001191550824 1051486303 /nfs/dbraw/zinc/48/63/03/1051486303.db2.gz MNCYHIQYUCQHHO-IBGZPJMESA-N 2 0 344.543 4.480 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](CCOC2CCCCC2)CC1 ZINC001191551558 1051486320 /nfs/dbraw/zinc/48/63/20/1051486320.db2.gz RADWJIYNAWKWTJ-IBGZPJMESA-N 2 0 336.564 4.312 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1ccc2cc(OC)ccc2c1 ZINC000163256000 1051564240 /nfs/dbraw/zinc/56/42/40/1051564240.db2.gz FLZBKIBHOAJHLJ-IIBYNOLFSA-N 2 0 326.484 4.231 20 0 EIADRP CC[C@@H](c1ccccc1)[NH+]1CCC(CCC[N@H+](C)CCOC)CC1 ZINC001192325452 1051691186 /nfs/dbraw/zinc/69/11/86/1051691186.db2.gz NOBGPIDVPQEETD-NRFANRHFSA-N 2 0 332.532 4.208 20 0 EIADRP C[C@]1(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C[C@@H]1c1ccccc1 ZINC001182780625 1051711193 /nfs/dbraw/zinc/71/11/93/1051711193.db2.gz ANCMXQMTACHXRE-DHIUTWEWSA-N 2 0 349.522 4.077 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000158103681 1051713460 /nfs/dbraw/zinc/71/34/60/1051713460.db2.gz VWGONZGOKZVIMA-KGLIPLIRSA-N 2 0 346.462 4.333 20 0 EIADRP CC[C@H](CC1CCCCC1)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC001182843367 1051713466 /nfs/dbraw/zinc/71/34/66/1051713466.db2.gz CRBIPLUDKHRENG-HXUWFJFHSA-N 2 0 336.564 4.216 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc2cc(OC)ccc2c1 ZINC000158161898 1051722195 /nfs/dbraw/zinc/72/21/95/1051722195.db2.gz HJHWZLDLJJYTKR-KKSFZXQISA-N 2 0 326.484 4.231 20 0 EIADRP CO[C@@H](C[NH+]1CCC(CCC[NH+]2CCCC2)CC1)C1CCCCC1 ZINC001192402032 1051724209 /nfs/dbraw/zinc/72/42/09/1051724209.db2.gz RIZABEOZIMHXGE-NRFANRHFSA-N 2 0 336.564 4.170 20 0 EIADRP Cn1cncc1CC[NH2+]C1(c2ccc(C(C)(C)C)cc2)CCCC1 ZINC001192584096 1051768125 /nfs/dbraw/zinc/76/81/25/1051768125.db2.gz FMYQIYUAIOPNRR-UHFFFAOYSA-N 2 0 325.500 4.319 20 0 EIADRP C[C@H](CCc1c[nH]c2ccccc12)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC001183074269 1051773152 /nfs/dbraw/zinc/77/31/52/1051773152.db2.gz CWGIHRTYRVKUCO-QGZVFWFLSA-N 2 0 339.527 4.201 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1cccc(OC(F)(F)F)c1 ZINC000775549669 1051816013 /nfs/dbraw/zinc/81/60/13/1051816013.db2.gz ZGZFYQFQQKMWJZ-ZFWWWQNUSA-N 2 0 330.394 4.110 20 0 EIADRP Cc1cc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)ccc1C(F)(F)F ZINC001183257363 1051818414 /nfs/dbraw/zinc/81/84/14/1051818414.db2.gz YYBLQUVBOUANRT-UHFFFAOYSA-N 2 0 340.433 4.322 20 0 EIADRP C[C@H]1CC[N@H+](Cc2ccc(SC(F)(F)F)cc2)CC[C@@H]1C[NH3+] ZINC001205618042 1051843637 /nfs/dbraw/zinc/84/36/37/1051843637.db2.gz QWIXBGCGQDSBAQ-GXTWGEPZSA-N 2 0 332.435 4.105 20 0 EIADRP [NH3+]Cc1ccc(Nc2ccc3c(c2)C[N@@H+](Cc2ccccc2)C3)cc1 ZINC001175968817 1051852678 /nfs/dbraw/zinc/85/26/78/1051852678.db2.gz KMMOHMWFJFVABI-UHFFFAOYSA-N 2 0 329.447 4.405 20 0 EIADRP C[C@@]12C[NH+](Cc3ccccc3)C[C@@H]1C[N@@H+](CC[C@H]1CCCC1(F)F)C2 ZINC001175974393 1051856868 /nfs/dbraw/zinc/85/68/68/1051856868.db2.gz UUXHMSUGLUUFPK-HSALFYBXSA-N 2 0 348.481 4.266 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1cccc(SC(F)(F)F)c1 ZINC001183885345 1051913889 /nfs/dbraw/zinc/91/38/89/1051913889.db2.gz IFLGRNMZVYLNRL-LBPRGKRZSA-N 2 0 332.435 4.291 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+][C@H]1CC[C@](C)(c2ccccc2)C1)c1cccnc1 ZINC001183919254 1051928468 /nfs/dbraw/zinc/92/84/68/1051928468.db2.gz HXVPKHKAUOOSPB-FKBYEOEOSA-N 2 0 337.511 4.174 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CC(C)(C)C3CCOCC3)CC2)C1 ZINC001184046473 1051943390 /nfs/dbraw/zinc/94/33/90/1051943390.db2.gz VVWBLVSLFKLBMU-XLIONFOSSA-N 2 0 336.564 4.072 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCC(C)(C)CO1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001184045760 1051944162 /nfs/dbraw/zinc/94/41/62/1051944162.db2.gz QCTHVMYNINRUCM-SESVDKBCSA-N 2 0 344.543 4.082 20 0 EIADRP CC(C)C[C@H](Cc1cccc(Cl)c1)[NH2+]C[C@@H]1C[NH+]2CCC1CC2 ZINC001184135913 1051952675 /nfs/dbraw/zinc/95/26/75/1051952675.db2.gz XGSRNGFBYKSCGB-UYAOXDASSA-N 2 0 334.935 4.229 20 0 EIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)c1 ZINC000163574287 1051995117 /nfs/dbraw/zinc/99/51/17/1051995117.db2.gz RNZOCDSJJSYAQY-KRWDZBQOSA-N 2 0 345.531 4.054 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccc(OC)cc2)c1 ZINC000163568640 1051995371 /nfs/dbraw/zinc/99/53/71/1051995371.db2.gz KSTIPEHDQDJCIS-QGZVFWFLSA-N 2 0 326.484 4.388 20 0 EIADRP C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1cccc(C(F)(F)F)c1 ZINC000294243315 1052057135 /nfs/dbraw/zinc/05/71/35/1052057135.db2.gz PIYKJWXSYLFHQM-AWEZNQCLSA-N 2 0 349.400 4.420 20 0 EIADRP Cc1ccsc1[C@@H](C)[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000165309837 1052058656 /nfs/dbraw/zinc/05/86/56/1052058656.db2.gz DLVLXDIJMLATDM-IEBWSBKVSA-N 2 0 328.525 4.272 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cc(Cl)sc1Cl ZINC000165983916 1052081264 /nfs/dbraw/zinc/08/12/64/1052081264.db2.gz LIEQRJFOGNGPEY-MNOVXSKESA-N 2 0 339.332 4.062 20 0 EIADRP FC(F)(F)c1ccc(C2([NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@@H]4C3)CCC2)cc1 ZINC000622043786 1052084957 /nfs/dbraw/zinc/08/49/57/1052084957.db2.gz LRZPEMSXJWATQO-JKIFEVAISA-N 2 0 338.417 4.062 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1ccc(-c2nc3ccccc3[nH]2)cc1 ZINC000167510863 1052120057 /nfs/dbraw/zinc/12/00/57/1052120057.db2.gz PEXOPKSNMZTDDZ-ZOCZFRKYSA-N 2 0 348.494 4.048 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1ccc(-c2nc3ccccc3[nH]2)cc1 ZINC000167511106 1052120881 /nfs/dbraw/zinc/12/08/81/1052120881.db2.gz PEXOPKSNMZTDDZ-WHSLLNHNSA-N 2 0 348.494 4.048 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccc2scnc2c1 ZINC001177127970 1052227786 /nfs/dbraw/zinc/22/77/86/1052227786.db2.gz YOFJGTFCOGZTNC-UHFFFAOYSA-N 2 0 339.508 4.428 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cccc3n[nH]cc32)cc1 ZINC000623357510 1052632358 /nfs/dbraw/zinc/63/23/58/1052632358.db2.gz SQSUXTHUOMPMIB-QGZVFWFLSA-N 2 0 348.494 4.227 20 0 EIADRP CC(C)Oc1ccc(CC[C@@H](C)[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623363356 1052635621 /nfs/dbraw/zinc/63/56/21/1052635621.db2.gz PTOYWPKJNXCLKN-IEBWSBKVSA-N 2 0 332.532 4.257 20 0 EIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623487709 1052664323 /nfs/dbraw/zinc/66/43/23/1052664323.db2.gz NVIMUUGRBODESG-HIFRSBDPSA-N 2 0 328.422 4.099 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC1(C)C ZINC000623512573 1052667211 /nfs/dbraw/zinc/66/72/11/1052667211.db2.gz NDWUPDWBVIOXQX-XIRDDKMYSA-N 2 0 340.433 4.414 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(Cl)s1)c1cccc(OCC[NH+](C)C)c1 ZINC000177861134 1052693487 /nfs/dbraw/zinc/69/34/87/1052693487.db2.gz GRBLIHIMUHVPKG-CYBMUJFWSA-N 2 0 338.904 4.193 20 0 EIADRP CC[C@H](C)c1ccc([C@@H](C)[NH2+][C@H]2CCN(C3CC[NH+](C)CC3)C2)cc1 ZINC000623893125 1052831056 /nfs/dbraw/zinc/83/10/56/1052831056.db2.gz GANPGBCJOPKCKM-UEXGIBASSA-N 2 0 343.559 4.019 20 0 EIADRP CC[C@H](C)c1ccc([C@@H](C)[NH2+][C@@H]2CCN(C3CC[NH+](C)CC3)C2)cc1 ZINC000623893126 1052831190 /nfs/dbraw/zinc/83/11/90/1052831190.db2.gz GANPGBCJOPKCKM-WAOWUJCRSA-N 2 0 343.559 4.019 20 0 EIADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(F)cc1C(F)(F)F ZINC000623957665 1052841794 /nfs/dbraw/zinc/84/17/94/1052841794.db2.gz PYPUZDJPIFHTKD-GFCCVEGCSA-N 2 0 332.385 4.227 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCCc3c4cc(Cl)ccc4[nH]c32)C1 ZINC000624008858 1052855303 /nfs/dbraw/zinc/85/53/03/1052855303.db2.gz JAIOGDYYBSBVMY-UVBSCNOISA-N 2 0 331.891 4.129 20 0 EIADRP COc1ccc(C[C@H](C)C[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1F ZINC000185301370 1053016354 /nfs/dbraw/zinc/01/63/54/1053016354.db2.gz DRMVODBCXMOTLQ-INIZCTEOSA-N 2 0 348.506 4.010 20 0 EIADRP CSc1ccc(OCC[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185763766 1053021174 /nfs/dbraw/zinc/02/11/74/1053021174.db2.gz FCLCYPLZUYMXKA-DLBZAZTESA-N 2 0 348.556 4.030 20 0 EIADRP C[C@H]([NH2+]Cc1cc(F)cc2cccnc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185722894 1053021538 /nfs/dbraw/zinc/02/15/38/1053021538.db2.gz FBDFHONQBNRCFN-RDJZCZTQSA-N 2 0 341.474 4.117 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000381131098 1053054928 /nfs/dbraw/zinc/05/49/28/1053054928.db2.gz KHCIPDQMARXAJU-ICSRJNTNSA-N 2 0 338.495 4.258 20 0 EIADRP CC(C)c1ccccc1C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000850361708 1053133467 /nfs/dbraw/zinc/13/34/67/1053133467.db2.gz BMXBVCIIHRKGAM-UHFFFAOYSA-N 2 0 337.511 4.207 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc2c(c1)CCCO2 ZINC000850457045 1053234615 /nfs/dbraw/zinc/23/46/15/1053234615.db2.gz FPPOJNVWOYMCJC-ABSDTBQOSA-N 2 0 342.527 4.315 20 0 EIADRP Cc1cc(F)ccc1[C@H](C)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000850514253 1053274682 /nfs/dbraw/zinc/27/46/82/1053274682.db2.gz LUDYRXPJDBXXIB-KRWDZBQOSA-N 2 0 341.474 4.092 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]C[C@@]2(C)CC2(F)F)ccc1OC ZINC000850536866 1053301040 /nfs/dbraw/zinc/30/10/40/1053301040.db2.gz OIFQRZBCIHYKGG-RDTXWAMCSA-N 2 0 340.458 4.233 20 0 EIADRP Cc1c(C)c(C)c(C[N@@H+]2CCCN(c3cc[nH+]cc3)CC2)c(C)c1C ZINC001195537092 1053429900 /nfs/dbraw/zinc/42/99/00/1053429900.db2.gz XZSBCSMTZROHRL-UHFFFAOYSA-N 2 0 337.511 4.336 20 0 EIADRP Fc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1Cl ZINC000159637395 1053495093 /nfs/dbraw/zinc/49/50/93/1053495093.db2.gz XNZVANNBENMDBU-UHFFFAOYSA-N 2 0 332.850 4.365 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)s1 ZINC000765307578 1053502925 /nfs/dbraw/zinc/50/29/25/1053502925.db2.gz ZXFMQNKWSQYDHZ-JKSUJKDBSA-N 2 0 332.513 4.409 20 0 EIADRP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1cccc(F)c1 ZINC000765361054 1053515836 /nfs/dbraw/zinc/51/58/36/1053515836.db2.gz VDLWRZFSXBFLNH-FGSXEWAUSA-N 2 0 340.486 4.429 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2csc(-c3ccc(F)cc3)n2)CC1 ZINC000865765973 1053589191 /nfs/dbraw/zinc/58/91/91/1053589191.db2.gz VJAMHKGEWUZHDU-UHFFFAOYSA-N 2 0 347.503 4.302 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@H](C)CCc2cncc3ccccc32)CC1 ZINC000866225835 1053656476 /nfs/dbraw/zinc/65/64/76/1053656476.db2.gz GLJPNSKKKINBKE-GOSISDBHSA-N 2 0 339.527 4.266 20 0 EIADRP CC1(C)C[N@H+](CCCCF)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001196545102 1053696400 /nfs/dbraw/zinc/69/64/00/1053696400.db2.gz KUSFFNITZGBRTG-FQEVSTJZSA-N 2 0 332.507 4.359 20 0 EIADRP COc1ccc(C(C)C)cc1C[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC001196798263 1053758853 /nfs/dbraw/zinc/75/88/53/1053758853.db2.gz JWHITCLCDMFJTB-UHFFFAOYSA-N 2 0 330.516 4.126 20 0 EIADRP Cc1cccnc1[C@H]1CCC[C@H]([NH2+]C2CCC(C)([NH+](C)C)CC2)C1 ZINC000866518133 1053763620 /nfs/dbraw/zinc/76/36/20/1053763620.db2.gz TVVYHTJJIAVIHX-SVCPCHAPSA-N 2 0 329.532 4.269 20 0 EIADRP C[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1cc(-c2ccccc2)n(C)n1 ZINC000866516911 1053764916 /nfs/dbraw/zinc/76/49/16/1053764916.db2.gz DUSOLXXBYXNYIY-AFJQURTJSA-N 2 0 340.515 4.001 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@@H]2CCOC(C)(C)C2)ccc1OC ZINC000121109530 1053767034 /nfs/dbraw/zinc/76/70/34/1053767034.db2.gz HHLRBCFUCMNSMK-VQIMIIECSA-N 2 0 348.531 4.145 20 0 EIADRP COc1ccc(C)cc1C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386612528 1053802385 /nfs/dbraw/zinc/80/23/85/1053802385.db2.gz KQHGRCAASPCOBQ-AZUAARDMSA-N 2 0 338.495 4.004 20 0 EIADRP CC(C)C[N@@H+](Cc1nsc2ccccc21)CC1CC[NH+](C)CC1 ZINC001197194274 1053851203 /nfs/dbraw/zinc/85/12/03/1053851203.db2.gz KWIXOVBRMLCPPX-UHFFFAOYSA-N 2 0 331.529 4.096 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CC[C@@H]2CC2(Cl)Cl)CC1 ZINC000857064914 1054168554 /nfs/dbraw/zinc/16/85/54/1054168554.db2.gz GEJNDEKAJRIHOY-IIAWOOMASA-N 2 0 333.347 4.203 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2ccc(F)cc2C(F)(F)F)CC1 ZINC001203917312 1054266966 /nfs/dbraw/zinc/26/69/66/1054266966.db2.gz MTGTYJKJINVIBM-UHFFFAOYSA-N 2 0 344.396 4.341 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCOC4(CCCC4)C3)CC2)CC1 ZINC000872051988 1054364788 /nfs/dbraw/zinc/36/47/88/1054364788.db2.gz LXXZWIRGCZYEOS-GPJFCIFZSA-N 2 0 334.548 4.111 20 0 EIADRP CCOc1cccc([C@H](C)[NH2+]Cc2cccc(C[N@H+](C)CC)c2)c1 ZINC000123940138 1054381695 /nfs/dbraw/zinc/38/16/95/1054381695.db2.gz OFFODTACZPTHFY-KRWDZBQOSA-N 2 0 326.484 4.388 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCOC3(CCCCC3)C2)C1 ZINC001199319405 1054390114 /nfs/dbraw/zinc/39/01/14/1054390114.db2.gz AWWHHRCZKBFZIX-ZCNNSNEGSA-N 2 0 336.564 4.216 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCCc3ccccc3C2)C1 ZINC001199319978 1054390695 /nfs/dbraw/zinc/39/06/95/1054390695.db2.gz GJAGRXXJGCVLFZ-XQBPLPMBSA-N 2 0 328.544 4.282 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCOC3(CCCCC3)C2)C1 ZINC001199319403 1054390850 /nfs/dbraw/zinc/39/08/50/1054390850.db2.gz AWWHHRCZKBFZIX-HSALFYBXSA-N 2 0 336.564 4.216 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2ncccc12)c1ccc(OCC[NH+](C)C)cc1 ZINC000872124268 1054403419 /nfs/dbraw/zinc/40/34/19/1054403419.db2.gz IHLZANIUPKHYMG-QGZVFWFLSA-N 2 0 349.478 4.026 20 0 EIADRP CCC[C@H](C)CCC[C@H](C)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000858430855 1054488711 /nfs/dbraw/zinc/48/87/11/1054488711.db2.gz IDZQOQKGRFSYCS-OALUTQOASA-N 2 0 338.580 4.462 20 0 EIADRP C[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC001199963329 1054504068 /nfs/dbraw/zinc/50/40/68/1054504068.db2.gz WJORURSJCVQHEV-WFASDCNBSA-N 2 0 329.315 4.387 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873267871 1054517803 /nfs/dbraw/zinc/51/78/03/1054517803.db2.gz LARJONVFBVMMNO-OLZOCXBDSA-N 2 0 347.503 4.296 20 0 EIADRP C[C@H]([NH2+][C@@H](C)C1CC[NH2+]CC1)c1ccc(SCC(F)F)cc1 ZINC000873271923 1054519001 /nfs/dbraw/zinc/51/90/01/1054519001.db2.gz MGCQVBRNYZJGLG-STQMWFEESA-N 2 0 328.472 4.083 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC(c2c[nH]c3ccc(F)cc32)CC1 ZINC000347536530 1054533108 /nfs/dbraw/zinc/53/31/08/1054533108.db2.gz HYJJZXMJOPNMNW-SFHVURJKSA-N 2 0 343.490 4.361 20 0 EIADRP Cc1cccc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c1C ZINC000060952660 1054734139 /nfs/dbraw/zinc/73/41/39/1054734139.db2.gz LJIRBZFAZDDONI-UHFFFAOYSA-N 2 0 328.525 4.367 20 0 EIADRP COc1ccc2cc(C[NH2+]CCC[N@@H+]3CCCC[C@@H]3C)ccc2c1 ZINC000061029124 1054739310 /nfs/dbraw/zinc/73/93/10/1054739310.db2.gz RZXBLTGKBSYICQ-KRWDZBQOSA-N 2 0 326.484 4.203 20 0 EIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2cccc(F)c2)C[N@@H+]1Cc1ccccc1 ZINC001201492553 1054819242 /nfs/dbraw/zinc/81/92/42/1054819242.db2.gz RJRIQKQDHLBWOC-FXAWDEMLSA-N 2 0 326.459 4.216 20 0 EIADRP CCC(CC)C[NH+]1CCC2(CC([N@H+](C)Cc3ccncc3)C2)CC1 ZINC001201525224 1054843721 /nfs/dbraw/zinc/84/37/21/1054843721.db2.gz DKFFRSBPJBHPNU-UHFFFAOYSA-N 2 0 329.532 4.194 20 0 EIADRP CCOc1ccc(C[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cc1 ZINC001201608768 1054864098 /nfs/dbraw/zinc/86/40/98/1054864098.db2.gz PRFGNEKNMYKUKM-UHFFFAOYSA-N 2 0 330.516 4.218 20 0 EIADRP CCCCCC[NH+]1CCC2(C[C@H]([N@H+](C)Cc3ccccc3)CO2)CC1 ZINC001201750111 1054894718 /nfs/dbraw/zinc/89/47/18/1054894718.db2.gz HMHZMZAGCHOEKC-NRFANRHFSA-N 2 0 344.543 4.322 20 0 EIADRP CCCCCC[NH+]1CCC2(CC([N@H+](C)Cc3ccncc3)C2)CC1 ZINC001201750032 1054895043 /nfs/dbraw/zinc/89/50/43/1054895043.db2.gz FCJDOGCODYFVGC-UHFFFAOYSA-N 2 0 329.532 4.338 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cccc(OC(F)F)c2)CC1 ZINC000065352909 1054915477 /nfs/dbraw/zinc/91/54/77/1054915477.db2.gz JBMHWKUQUSRZCG-UHFFFAOYSA-N 2 0 340.458 4.232 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2cc3c(ccnc3Cl)o2)CC1 ZINC000876768716 1054956038 /nfs/dbraw/zinc/95/60/38/1054956038.db2.gz LPXHEUQVINZXGH-UHFFFAOYSA-N 2 0 335.879 4.035 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cccc(Cl)c2N)cc1 ZINC000876900062 1054978995 /nfs/dbraw/zinc/97/89/95/1054978995.db2.gz VKCOALKSZGFQCS-UHFFFAOYSA-N 2 0 331.891 4.054 20 0 EIADRP C[N@H+](Cc1ccccc1)[C@@H]1COC2(C1)CC[NH+](CCC(C)(C)C)CC2 ZINC001202072760 1055003160 /nfs/dbraw/zinc/00/31/60/1055003160.db2.gz BJLRWLVUUDRYMJ-FQEVSTJZSA-N 2 0 344.543 4.178 20 0 EIADRP [NH3+]CCCC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)c1ccc(F)cc1F ZINC000902445445 1055035354 /nfs/dbraw/zinc/03/53/54/1055035354.db2.gz LWKXWHUMVBHLCS-KRWWSPQJSA-N 2 0 340.483 4.151 20 0 EIADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1cc2nc(Cl)ccc2s1 ZINC000877567858 1055083627 /nfs/dbraw/zinc/08/36/27/1055083627.db2.gz CEODUDQRORLNOO-UHFFFAOYSA-N 2 0 325.909 4.160 20 0 EIADRP Cc1ccc(C[NH+]2CCCCC2)cc1N[C@H]1CCCC[C@@H]1[NH+](C)C ZINC001168602339 1055102946 /nfs/dbraw/zinc/10/29/46/1055102946.db2.gz MLQIJWSGJHHIIF-FPOVZHCZSA-N 2 0 329.532 4.266 20 0 EIADRP C[NH+]1CCC(C[NH2+]C2CCC(C(F)F)CC2)(c2ccccc2)CC1 ZINC000877718782 1055112154 /nfs/dbraw/zinc/11/21/54/1055112154.db2.gz SYTARQUPLRTRMH-UHFFFAOYSA-N 2 0 336.470 4.064 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)C2CCC(C(F)(F)F)CC2)C1 ZINC000474710960 1055997682 /nfs/dbraw/zinc/99/76/82/1055997682.db2.gz JZUPHWQZICZLLK-XNIRIUNOSA-N 2 0 334.470 4.454 20 0 EIADRP CC[N@H+](CCC1CC[NH+](CC2(CC)CCOCC2)CC1)CC1CC1 ZINC000542860295 1056335060 /nfs/dbraw/zinc/33/50/60/1056335060.db2.gz YEXZHTHAYZNDLJ-UHFFFAOYSA-N 2 0 336.564 4.027 20 0 EIADRP Cc1cccc(O[C@H]2CCCC[C@@H]2[NH2+]C2CC[NH+](C(C)C)CC2)c1 ZINC000542935091 1056804773 /nfs/dbraw/zinc/80/47/73/1056804773.db2.gz ASQFHJLIRJWLPS-SFTDATJTSA-N 2 0 330.516 4.147 20 0 EIADRP C[C@H](C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000188148670 1060133469 /nfs/dbraw/zinc/13/34/69/1060133469.db2.gz UNCDKBBRJUTRME-XOKHGSTOSA-N 2 0 326.406 4.025 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)c(OC)c1 ZINC000766514443 1060471097 /nfs/dbraw/zinc/47/10/97/1060471097.db2.gz XDPLUDJRCKSLAP-WWDZGPRUSA-N 2 0 346.515 4.152 20 0 EIADRP Cc1nc2c(s1)[C@H]([NH2+]C1CCC([NH+]3CCCCC3)CC1)CCC2 ZINC000766513318 1060483995 /nfs/dbraw/zinc/48/39/95/1060483995.db2.gz PZCKLBYFCRTQOH-LEOMRAHMSA-N 2 0 333.545 4.216 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H]1CCCc3cc(Br)ccc31)C2 ZINC001169101518 1060636654 /nfs/dbraw/zinc/63/66/54/1060636654.db2.gz TZEYQEIFWNTAQB-XLMAVXFVSA-N 2 0 349.316 4.041 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CCCc1ccc(Cl)cc1Cl)C2 ZINC001169101881 1060638127 /nfs/dbraw/zinc/63/81/27/1060638127.db2.gz VXDDJCCFSFWRMG-MUJYYYPQSA-N 2 0 327.299 4.141 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@H]1c1ccc(C(F)(F)F)cc1)C2 ZINC001169154261 1060671620 /nfs/dbraw/zinc/67/16/20/1060671620.db2.gz PCDDHHYQTQGNMG-MLHJIOFPSA-N 2 0 338.417 4.468 20 0 EIADRP CC[NH+](CC)Cc1cncc(N2CCC[C@H]([NH3+])c3cc(C)ccc32)c1 ZINC001169689402 1060899588 /nfs/dbraw/zinc/89/95/88/1060899588.db2.gz DNSSUJMYVSAVLL-FQEVSTJZSA-N 2 0 338.499 4.164 20 0 EIADRP C[N@@H+]1CCC[C@@H]1CCN1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000767370731 1061213923 /nfs/dbraw/zinc/21/39/23/1061213923.db2.gz DTVZWJPXPHGDJA-PBHICJAKSA-N 2 0 326.406 4.327 20 0 EIADRP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(Br)cc1 ZINC000036991667 522562364 /nfs/dbraw/zinc/56/23/64/522562364.db2.gz LVSRREZYZJLHHH-HMQMGEFJSA-N 2 0 337.305 4.115 20 0 EIADRP C[N@H+](CC1CCN(c2cc[nH+]cc2)CC1)CC1CCC(F)(F)CC1 ZINC000459379964 1032156217 /nfs/dbraw/zinc/15/62/17/1032156217.db2.gz YTCSPPQSXWATEM-UHFFFAOYSA-N 2 0 337.458 4.055 20 0 EIADRP COc1cc(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)ccc1C ZINC000194238605 1032248220 /nfs/dbraw/zinc/24/82/20/1032248220.db2.gz WXVXFPFSZGGODW-UHFFFAOYSA-N 2 0 326.484 4.134 20 0 EIADRP c1cc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cs1 ZINC000245690704 1032378274 /nfs/dbraw/zinc/37/82/74/1032378274.db2.gz KERXFEVETHJNSK-ACDBMABISA-N 2 0 326.509 4.076 20 0 EIADRP C[N@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)C[C@@H]1CCCCC1(F)F ZINC000450455630 1032511454 /nfs/dbraw/zinc/51/14/54/1032511454.db2.gz OFYUOHGZROAWRC-OALUTQOASA-N 2 0 336.470 4.266 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)O[C@@H](C)C1)c1ccsc1 ZINC000177890467 1032522935 /nfs/dbraw/zinc/52/29/35/1032522935.db2.gz KCJAFKGVPRKVAG-ULQDDVLXSA-N 2 0 344.524 4.208 20 0 EIADRP CC[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1OC ZINC000179468330 1032561470 /nfs/dbraw/zinc/56/14/70/1032561470.db2.gz ZGEIGVPXVYOOJQ-FQEVSTJZSA-N 2 0 339.483 4.048 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cccc(C(C)=O)c2)CC1)CC1CC1 ZINC000450656145 1032623866 /nfs/dbraw/zinc/62/38/66/1032623866.db2.gz UWRXHULVDCCLKD-UHFFFAOYSA-N 2 0 342.527 4.223 20 0 EIADRP c1c2c(cc3c1OCCC[C@H]3[NH2+][C@H]1CC[NH2+]C3(CCC3)C1)CCCC2 ZINC000643546501 1018895614 /nfs/dbraw/zinc/89/56/14/1018895614.db2.gz PMNWDVOCZAEYSC-AZUAARDMSA-N 2 0 340.511 4.043 20 0 EIADRP CCOc1ccc([C@@H](CC)[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1OCC ZINC000643546045 1018897755 /nfs/dbraw/zinc/89/77/55/1018897755.db2.gz HITQEUCZHHHWOL-QZTJIDSGSA-N 2 0 346.515 4.199 20 0 EIADRP C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccc(-c4cccc(F)c4)s3)C2)C1 ZINC000430163194 1018933767 /nfs/dbraw/zinc/93/37/67/1018933767.db2.gz LDBWNLWXCLRQRV-IBGZPJMESA-N 2 0 330.472 4.082 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(Cl)cn1 ZINC000274903661 1019846424 /nfs/dbraw/zinc/84/64/24/1019846424.db2.gz LRMSLAJXXPACFW-OAHLLOKOSA-N 2 0 329.875 4.182 20 0 EIADRP c1ccc(CSCCC[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000535627061 1020011571 /nfs/dbraw/zinc/01/15/71/1020011571.db2.gz RPBWSOVUWQQMQL-CTNGQTDRSA-N 2 0 344.568 4.259 20 0 EIADRP CSC1(C[NH2+]C2CCC(C)(c3ccccc3)CC2)CC[NH+](C)CC1 ZINC000579891303 1020494366 /nfs/dbraw/zinc/49/43/66/1020494366.db2.gz LSZBLEFVMYKDAU-UHFFFAOYSA-N 2 0 346.584 4.304 20 0 EIADRP CCN1CC[NH+](CCCC[NH2+]C2CCC(C3CCCCC3)CC2)CC1 ZINC000683471425 1020849455 /nfs/dbraw/zinc/84/94/55/1020849455.db2.gz JCLYHQKBFAZCOD-UHFFFAOYSA-N 2 0 349.607 4.133 20 0 EIADRP O[C@@H]1CCC[C@@H]1[NH+]1CCC([NH2+]C2CCC(C3CCCCC3)CC2)CC1 ZINC000683470519 1020849666 /nfs/dbraw/zinc/84/96/66/1020849666.db2.gz QNZQRJBTXDCTRT-IJZHQTRZSA-N 2 0 348.575 4.093 20 0 EIADRP Cc1ccc(-c2ncc(C[NH2+]C[C@H](C)Cn3ccnc3)s2)cc1C ZINC000655718740 1020914902 /nfs/dbraw/zinc/91/49/02/1020914902.db2.gz LXJXPNYJSSCBDZ-AWEZNQCLSA-N 2 0 340.496 4.049 20 0 EIADRP CCC[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cccc(C(F)(F)F)c1 ZINC000655804898 1020972379 /nfs/dbraw/zinc/97/23/79/1020972379.db2.gz FKRNBCHPDBWXSJ-XKQJLSEDSA-N 2 0 328.422 4.476 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](c2cccc(F)c2)c2cccc(Cl)c2)C1 ZINC000655805527 1020972784 /nfs/dbraw/zinc/97/27/84/1020972784.db2.gz OYMSTELSZCDKSF-KPOBHBOGSA-N 2 0 346.877 4.498 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000655803927 1020975152 /nfs/dbraw/zinc/97/51/52/1020975152.db2.gz IPBJWNJOXCJSIO-QXRTWZOPSA-N 2 0 340.433 4.271 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc2ccccc2c1OC(F)F ZINC000655807548 1020976453 /nfs/dbraw/zinc/97/64/53/1020976453.db2.gz PINGGQCZBRACBT-OFQRWUPVSA-N 2 0 348.437 4.432 20 0 EIADRP Cc1cnc(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(C)c1 ZINC000655806799 1020977808 /nfs/dbraw/zinc/97/78/08/1020977808.db2.gz FBUWTRCFOGBUBR-KOUNCHBCSA-N 2 0 349.522 4.026 20 0 EIADRP Cc1cc([C@@H](C)NCc2ccccc2C[N@@H+]2CCC[C@H](C)C2)no1 ZINC000340469565 1021074095 /nfs/dbraw/zinc/07/40/95/1021074095.db2.gz KUUGVSOTNDOMBY-DOTOQJQBSA-N 2 0 327.472 4.066 20 0 EIADRP c1ccc([C@H](C[C@@H]2CCOC2)[NH2+]CCCCC[NH+]2CCCC2)cc1 ZINC000340479265 1021101790 /nfs/dbraw/zinc/10/17/90/1021101790.db2.gz LMFRNFMEDCPRGK-FPOVZHCZSA-N 2 0 330.516 4.010 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+]CC3CC[NH+](C)CC3)cc2)cs1 ZINC000892507291 1021206420 /nfs/dbraw/zinc/20/64/20/1021206420.db2.gz WXMBQZNOZOXGHA-AWEZNQCLSA-N 2 0 329.513 4.111 20 0 EIADRP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+]CC2CC[NH+](C)CC2)cc1 ZINC000468443865 1021215424 /nfs/dbraw/zinc/21/54/24/1021215424.db2.gz HDBSWRLPIRLBTK-IBGZPJMESA-N 2 0 344.543 4.284 20 0 EIADRP c1cnc(N2CCCCC2)c(NC2=CC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC001210706183 1021564977 /nfs/dbraw/zinc/56/49/77/1021564977.db2.gz USCKZZRLFFXLHD-GOSISDBHSA-N 2 0 326.488 4.016 20 0 EIADRP CC[C@@H]1CN(Cc2csc(-c3ccc(Cl)cc3)n2)CC[C@H]1[NH3+] ZINC000647499079 1021636260 /nfs/dbraw/zinc/63/62/60/1021636260.db2.gz YXOJAEDGEZCDTE-MLGOLLRUSA-N 2 0 335.904 4.023 20 0 EIADRP Cc1nc(C)c([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000272354307 1021641602 /nfs/dbraw/zinc/64/16/02/1021641602.db2.gz RCBQXHMQMONGAC-YZVOILCLSA-N 2 0 343.540 4.321 20 0 EIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+][C@H](Cc1nccn1C)c1ccccc1 ZINC000683819210 1021694933 /nfs/dbraw/zinc/69/49/33/1021694933.db2.gz OIMDCWYVUSOHDE-WEYGHZABSA-N 2 0 349.478 4.070 20 0 EIADRP c1cc2cc(C[NH+]3CCC(C[NH+]4CCCCCC4)CC3)ccc2cn1 ZINC000683825775 1021718554 /nfs/dbraw/zinc/71/85/54/1021718554.db2.gz VPPGBAUMPXURGP-UHFFFAOYSA-N 2 0 337.511 4.323 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(C)c1 ZINC000414064965 1021774399 /nfs/dbraw/zinc/77/43/99/1021774399.db2.gz NUPMDZMPLFFIDZ-GOSISDBHSA-N 2 0 338.495 4.450 20 0 EIADRP C[C@H](c1cccc2ccccc21)[NH+]1CCC([C@H]2OCCC[C@H]2[NH3+])CC1 ZINC000580294957 1021827695 /nfs/dbraw/zinc/82/76/95/1021827695.db2.gz BTLCMYNLDKGBJS-NPFVIJTESA-N 2 0 338.495 4.119 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCc2ccc(OC)cc21 ZINC000173227952 1021872731 /nfs/dbraw/zinc/87/27/31/1021872731.db2.gz CLBSGZHUOMXVNJ-JOCHJYFZSA-N 2 0 338.495 4.314 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)c(C)c1 ZINC000414113145 1021873553 /nfs/dbraw/zinc/87/35/53/1021873553.db2.gz KFANZXJSEIQZOU-HNNXBMFYSA-N 2 0 330.447 4.055 20 0 EIADRP Clc1ccc([C@@H]2CCC[C@@H]([NH2+][C@@H]3CCn4ccnc4C3)C2)cc1 ZINC000414131995 1021901356 /nfs/dbraw/zinc/90/13/56/1021901356.db2.gz LRWRQGSCOZPAGS-KBAYOESNSA-N 2 0 329.875 4.167 20 0 EIADRP C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](C)CCCc1cncn1C ZINC000584537606 1022013051 /nfs/dbraw/zinc/01/30/51/1022013051.db2.gz NNNJCZVGHXJZKO-CYBMUJFWSA-N 2 0 325.378 4.065 20 0 EIADRP CC1CC[NH+](Cc2cccc(C[NH2+]Cc3ccc4[nH]cnc4c3)c2)CC1 ZINC000518775988 1022022376 /nfs/dbraw/zinc/02/23/76/1022022376.db2.gz PAODBEPEFRRIRC-UHFFFAOYSA-N 2 0 348.494 4.085 20 0 EIADRP CC[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccccc1OC(F)F ZINC000414172934 1022028099 /nfs/dbraw/zinc/02/80/99/1022028099.db2.gz FUCDELJDGFKITB-ZBFHGGJFSA-N 2 0 326.431 4.061 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c[nH+]cn3c1)CCCS2 ZINC000414178408 1022037544 /nfs/dbraw/zinc/03/75/44/1022037544.db2.gz JNCCHJNGRJJUSA-SFHVURJKSA-N 2 0 339.464 4.060 20 0 EIADRP C[C@H](c1ccccn1)[NH+](C)CCCCC[N@@H+](C)[C@H](C)c1ccccn1 ZINC000245549918 1033030691 /nfs/dbraw/zinc/03/06/91/1033030691.db2.gz ZQYBDWGAHIUQIV-RTBURBONSA-N 2 0 340.515 4.333 20 0 EIADRP C[C@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1nccs1 ZINC000414219422 1022190020 /nfs/dbraw/zinc/19/00/20/1022190020.db2.gz HGLICUNTTHPDFQ-ZLPCBKJTSA-N 2 0 329.513 4.237 20 0 EIADRP Cc1ccc(-c2ncc(C[NH+]3CCC(C[NH+](C)C)CC3)s2)cc1C ZINC000656250117 1022194391 /nfs/dbraw/zinc/19/43/91/1022194391.db2.gz JEPQMWMZJULFSX-UHFFFAOYSA-N 2 0 343.540 4.201 20 0 EIADRP c1ccc(CC2(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)CCCCC2)cc1 ZINC000471592361 1022201109 /nfs/dbraw/zinc/20/11/09/1022201109.db2.gz DJPQTPURGMURLR-RTWAWAEBSA-N 2 0 326.528 4.396 20 0 EIADRP CSc1ccc(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)s1 ZINC000580604567 1022295982 /nfs/dbraw/zinc/29/59/82/1022295982.db2.gz XPCYEPKKAHWCOO-KRWDZBQOSA-N 2 0 346.565 4.124 20 0 EIADRP COc1ccsc1[C@H](C)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000471602661 1022308064 /nfs/dbraw/zinc/30/80/64/1022308064.db2.gz CTHLLGUDIXOTHK-SOLBZPMBSA-N 2 0 344.524 4.318 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)cnc1F ZINC000892580206 1022311885 /nfs/dbraw/zinc/31/18/85/1022311885.db2.gz HZBCECIVGMFNNI-QGZVFWFLSA-N 2 0 341.474 4.193 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](C[C@H]2CC(C)(C)OC2(C)C)C1 ZINC001167424512 1022319964 /nfs/dbraw/zinc/31/99/64/1022319964.db2.gz KUTWADINFHPBPO-CEXWTWQISA-N 2 0 336.564 4.167 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1cncc(Br)c1 ZINC000580659956 1022349613 /nfs/dbraw/zinc/34/96/13/1022349613.db2.gz MARLMWJFOQTYLG-KGLIPLIRSA-N 2 0 342.325 4.005 20 0 EIADRP Cc1nc([C@H](C)[NH2+]CC2CC[NH+](CCc3ccccc3)CC2)cs1 ZINC000378206377 1022514590 /nfs/dbraw/zinc/51/45/90/1022514590.db2.gz YZNMDDBVWMBZDD-INIZCTEOSA-N 2 0 343.540 4.057 20 0 EIADRP C[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Br)s1 ZINC000088163909 1022548663 /nfs/dbraw/zinc/54/86/63/1022548663.db2.gz XDUHJBGCTDZDSX-ODWCKFRGSA-N 2 0 343.334 4.177 20 0 EIADRP COc1cccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000310891194 1022680586 /nfs/dbraw/zinc/68/05/86/1022680586.db2.gz KPYVCGHXNWWOMP-ICSRJNTNSA-N 2 0 338.495 4.258 20 0 EIADRP CSC1(C[NH2+]C/C(C)=C/c2ccc(Cl)cc2)CC[NH+](C)CC1 ZINC000568970889 1022687949 /nfs/dbraw/zinc/68/79/49/1022687949.db2.gz MXBHPOZBTQBHDZ-NTCAYCPXSA-N 2 0 338.948 4.160 20 0 EIADRP CC[NH+](CC)CCCC1CCN(Cc2cnc(Cl)s2)CC1 ZINC000182792111 1022828833 /nfs/dbraw/zinc/82/88/33/1022828833.db2.gz OULWWXVMDKKSAN-UHFFFAOYSA-N 2 0 329.941 4.131 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)ccc1Br ZINC000378489589 1022843611 /nfs/dbraw/zinc/84/36/11/1022843611.db2.gz CTXBTYNBLSYSPU-BPUTZDHNSA-N 2 0 337.305 4.035 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2cnn(C(C)C)c2)c1 ZINC000163569541 1022917254 /nfs/dbraw/zinc/91/72/54/1022917254.db2.gz UPAXIKJMSJHDAA-QGZVFWFLSA-N 2 0 328.504 4.157 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2cnn(C(C)C)c2)cc1 ZINC000163577527 1022951280 /nfs/dbraw/zinc/95/12/80/1022951280.db2.gz ABVWCPGMZZMTGW-QGZVFWFLSA-N 2 0 328.504 4.157 20 0 EIADRP c1ccc(C[C@@H]([NH2+]Cc2ccc3c(c2)C[NH2+]CC3)c2ccccc2)cc1 ZINC000581315843 1023007081 /nfs/dbraw/zinc/00/70/81/1023007081.db2.gz VLQJWYSKYQZIAV-XMMPIXPASA-N 2 0 342.486 4.406 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cccc(F)c1 ZINC000187896923 1023021774 /nfs/dbraw/zinc/02/17/74/1023021774.db2.gz AXXLFSJKUIKUCY-LJQANCHMSA-N 2 0 330.447 4.007 20 0 EIADRP COc1ccc([C@H]([NH2+][C@@H](C)C2CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000396471671 1023039476 /nfs/dbraw/zinc/03/94/76/1023039476.db2.gz YBZVXCAHNXRHEO-HTAPYJJXSA-N 2 0 338.495 4.105 20 0 EIADRP Cn1ccnc1C[C@@H]([NH2+]CCc1ccc(Cl)cc1)c1ccccc1 ZINC000656503601 1023073472 /nfs/dbraw/zinc/07/34/72/1023073472.db2.gz OACZXRTYSBJQKN-LJQANCHMSA-N 2 0 339.870 4.190 20 0 EIADRP Cn1ccnc1C[C@H]([NH2+]CCc1cccc(Cl)c1)c1ccccc1 ZINC000656503602 1023073961 /nfs/dbraw/zinc/07/39/61/1023073961.db2.gz OZAPBAXWLHWTEX-IBGZPJMESA-N 2 0 339.870 4.190 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1cnn(C)c1 ZINC000156181738 1023092688 /nfs/dbraw/zinc/09/26/88/1023092688.db2.gz UJLZUMHKENOZQR-UWJYYQICSA-N 2 0 340.515 4.035 20 0 EIADRP Cc1c(Cl)c(C[NH+]2CCC([C@@H]3CCC[NH2+]3)CC2)nc2ccccc12 ZINC000261746386 1023314685 /nfs/dbraw/zinc/31/46/85/1023314685.db2.gz UEAOVRQOPQKMSM-KRWDZBQOSA-N 2 0 343.902 4.161 20 0 EIADRP CC[N@H+](CCC[NH+]1CCCC1)Cc1ccc(Cl)c2cccnc12 ZINC000584808406 1023333875 /nfs/dbraw/zinc/33/38/75/1023333875.db2.gz PKQFXGPCHPUGIN-UHFFFAOYSA-N 2 0 331.891 4.196 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CCC[NH2+]C(C)C ZINC000581542475 1023348027 /nfs/dbraw/zinc/34/80/27/1023348027.db2.gz ZVJJFWSHGOJHHT-ZDUSSCGKSA-N 2 0 335.492 4.296 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+]Cc1ccc(-c2ccccc2Br)cc1 ZINC000415018885 1023393535 /nfs/dbraw/zinc/39/35/35/1023393535.db2.gz HGIQJPFTGCMSMW-CQSZACIVSA-N 2 0 347.300 4.333 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1ccccc1Br)c1ccccc1 ZINC000415061471 1023413665 /nfs/dbraw/zinc/41/36/65/1023413665.db2.gz YEWMEZMJKWGKPX-KRWDZBQOSA-N 2 0 333.273 4.019 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1cc(F)cc(C(F)(F)F)c1)c1ccccc1 ZINC000415061546 1023413874 /nfs/dbraw/zinc/41/38/74/1023413874.db2.gz YKHWGXQFXDTEPB-KRWDZBQOSA-N 2 0 340.364 4.414 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000415073219 1023425174 /nfs/dbraw/zinc/42/51/74/1023425174.db2.gz ARHFEDUGPLIBPD-OCCSQVGLSA-N 2 0 349.931 4.422 20 0 EIADRP COc1ccc([C@H]([NH2+]C2CCC([NH3+])CC2)c2ccccc2Cl)cc1 ZINC000415090863 1023442754 /nfs/dbraw/zinc/44/27/54/1023442754.db2.gz PLXQHZZMZDKZNL-PMTKGXAQSA-N 2 0 344.886 4.298 20 0 EIADRP CC(C)C[C@H](C[NH+]1CCC([C@H]2C[C@@H]([NH3+])CCO2)CC1)c1ccccc1 ZINC000415120014 1023451696 /nfs/dbraw/zinc/45/16/96/1023451696.db2.gz GDEUWXOCDOFTQG-BHIFYINESA-N 2 0 344.543 4.035 20 0 EIADRP CC(C)C[C@H](C[NH+]1CCC([C@@H]2C[C@@H]([NH3+])CCO2)CC1)c1ccccc1 ZINC000415120018 1023452134 /nfs/dbraw/zinc/45/21/34/1023452134.db2.gz GDEUWXOCDOFTQG-FSSWDIPSSA-N 2 0 344.543 4.035 20 0 EIADRP Cc1nc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c(C)s1 ZINC000397532264 1023454698 /nfs/dbraw/zinc/45/46/98/1023454698.db2.gz ZZBGRGKTVSOJNU-OAHLLOKOSA-N 2 0 343.540 4.323 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ccc2c(c1)OCCCO2 ZINC000119956227 1023458754 /nfs/dbraw/zinc/45/87/54/1023458754.db2.gz YEISMWNZOZUPGT-SJORKVTESA-N 2 0 334.504 4.009 20 0 EIADRP CC[N@H+](C)C[C@@H]1CC[NH+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500075194 1023485200 /nfs/dbraw/zinc/48/52/00/1023485200.db2.gz OOSYAWYCRPPOLI-GJZGRUSLSA-N 2 0 328.422 4.083 20 0 EIADRP C[C@H](C[N@H+](C)[C@@H]1CCN(C)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097665 1023499606 /nfs/dbraw/zinc/49/96/06/1023499606.db2.gz MWQQZHXQQMZTDO-CKEIUWERSA-N 2 0 328.422 4.223 20 0 EIADRP Clc1ccc(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)c2ncccc12 ZINC000656786258 1023526158 /nfs/dbraw/zinc/52/61/58/1023526158.db2.gz QZGBFCIHRSXHGD-INIZCTEOSA-N 2 0 343.902 4.100 20 0 EIADRP c1sc(-c2ccccc2)nc1C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656786256 1023526256 /nfs/dbraw/zinc/52/62/56/1023526256.db2.gz QYYUKPQVPIYOAI-GOSISDBHSA-N 2 0 341.524 4.022 20 0 EIADRP Clc1cc2cccnc2c(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)c1 ZINC000656784757 1023530011 /nfs/dbraw/zinc/53/00/11/1023530011.db2.gz CDJSWECQVRUBRD-KRWDZBQOSA-N 2 0 343.902 4.100 20 0 EIADRP c1nc(-c2ccccc2)sc1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000656785969 1023536223 /nfs/dbraw/zinc/53/62/23/1023536223.db2.gz OMPUKQUGCOIHLW-SFHVURJKSA-N 2 0 341.524 4.022 20 0 EIADRP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)C1 ZINC000684370753 1023541770 /nfs/dbraw/zinc/54/17/70/1023541770.db2.gz BBCMQYGSETWIEE-NHCUHLMSSA-N 2 0 330.516 4.110 20 0 EIADRP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)C1 ZINC000684370750 1023542037 /nfs/dbraw/zinc/54/20/37/1023542037.db2.gz BBCMQYGSETWIEE-LEWJYISDSA-N 2 0 330.516 4.110 20 0 EIADRP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)C1 ZINC000684370480 1023544703 /nfs/dbraw/zinc/54/47/03/1023544703.db2.gz VLQINWURUKZIDY-JRGCBEDISA-N 2 0 330.516 4.108 20 0 EIADRP C[N@H+](CCCNCc1ccccc1Br)Cc1ccccc1 ZINC000019913286 1023632277 /nfs/dbraw/zinc/63/22/77/1023632277.db2.gz SMGMUDAJIJKLPJ-UHFFFAOYSA-N 2 0 347.300 4.061 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cccc(Br)c1 ZINC000019914673 1023632531 /nfs/dbraw/zinc/63/25/31/1023632531.db2.gz OMHXOTNRYSDTPG-AWEZNQCLSA-N 2 0 327.310 4.049 20 0 EIADRP CC[NH+](CC)Cc1ccccc1CN[C@H](C)c1cccnc1Cl ZINC000163768265 1023702923 /nfs/dbraw/zinc/70/29/23/1023702923.db2.gz KREZQLBWTDDULD-OAHLLOKOSA-N 2 0 331.891 4.428 20 0 EIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1N[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000390625718 1023736056 /nfs/dbraw/zinc/73/60/56/1023736056.db2.gz HXFSLUXDESUTEZ-FSSWDIPSSA-N 2 0 349.522 4.022 20 0 EIADRP C[C@H]1C[N@H+](C[C@@H](C[NH+](C)Cc2ccccc2)c2ccccc2)C[C@H]1C ZINC001167483569 1023740048 /nfs/dbraw/zinc/74/00/48/1023740048.db2.gz XGHBKCQKOSKYBZ-ZRCGQRJVSA-N 2 0 336.523 4.490 20 0 EIADRP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000581847177 1023762332 /nfs/dbraw/zinc/76/23/32/1023762332.db2.gz XUMGTXUDNDRSLE-IHWMJMDHSA-N 2 0 326.406 4.040 20 0 EIADRP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000581847176 1023762740 /nfs/dbraw/zinc/76/27/40/1023762740.db2.gz XUMGTXUDNDRSLE-IDJPSDCMSA-N 2 0 326.406 4.040 20 0 EIADRP CSC1(C[NH2+][C@H](CC(C)C)c2cccs2)CC[NH+](C)CC1 ZINC000581853968 1023771451 /nfs/dbraw/zinc/77/14/51/1023771451.db2.gz DZAZRDXIOUXBEC-OAHLLOKOSA-N 2 0 326.575 4.252 20 0 EIADRP c1ccc(CN2CC[C@@H]([NH2+]CCC[C@H]3CCCCO3)CC23CC3)cc1 ZINC000647201801 1023885556 /nfs/dbraw/zinc/88/55/56/1023885556.db2.gz ANVBJSKPENWUDH-NHCUHLMSSA-N 2 0 342.527 4.123 20 0 EIADRP C[C@@H]([NH2+]CC1(C(F)(F)F)CCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000367698117 1023886391 /nfs/dbraw/zinc/88/63/91/1023886391.db2.gz NRSJTAUFTYPQCW-WBVHZDCISA-N 2 0 340.433 4.219 20 0 EIADRP c1ccc(CSCC[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000430768289 1024021812 /nfs/dbraw/zinc/02/18/12/1024021812.db2.gz YODNPWGZJBPNBL-NRFANRHFSA-N 2 0 340.536 4.032 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2cc3cnccc3o2)CC1 ZINC000651631489 1024058795 /nfs/dbraw/zinc/05/87/95/1024058795.db2.gz PORBNUADZUPDRO-UHFFFAOYSA-N 2 0 349.478 4.172 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2cc(-c3ccccc3Cl)on2)CC1 ZINC000419209146 1033186844 /nfs/dbraw/zinc/18/68/44/1033186844.db2.gz PDCFUSXRIVWNCX-UHFFFAOYSA-N 2 0 347.890 4.159 20 0 EIADRP CC(C)C[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)c1ccc(F)cc1 ZINC000652153191 1024338220 /nfs/dbraw/zinc/33/82/20/1024338220.db2.gz CRMAPEHZSMWFDS-UWJYYQICSA-N 2 0 348.506 4.003 20 0 EIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CCC1CC[NH+](C)CC1 ZINC000510755348 1024405224 /nfs/dbraw/zinc/40/52/24/1024405224.db2.gz OTPHXBRJSSCXGJ-HNNXBMFYSA-N 2 0 342.449 4.348 20 0 EIADRP O=C1CCCC12CC[NH+](Cc1ccc(C[NH+]3CCCCC3)cc1)CC2 ZINC000661960216 1024778754 /nfs/dbraw/zinc/77/87/54/1024778754.db2.gz IPDFUBMJZMIUJE-UHFFFAOYSA-N 2 0 340.511 4.008 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+]([C@@H](C)c2nc3ccccc3o2)CC1 ZINC000180981523 1025026538 /nfs/dbraw/zinc/02/65/38/1025026538.db2.gz BEOVRMWFSCDYQM-INIZCTEOSA-N 2 0 329.488 4.333 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccccc1C(F)(F)F ZINC000662281304 1025031679 /nfs/dbraw/zinc/03/16/79/1025031679.db2.gz JDZZGIZXERBXFK-CYBMUJFWSA-N 2 0 334.385 4.202 20 0 EIADRP COCC[C@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)c1ccc(Cl)c(Cl)c1 ZINC000342056376 1025079270 /nfs/dbraw/zinc/07/92/70/1025079270.db2.gz HOIVARJXZMWINM-YOEHRIQHSA-N 2 0 345.314 4.145 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CC(C)(C)Cc3occc32)cc1 ZINC000162500964 1025146717 /nfs/dbraw/zinc/14/67/17/1025146717.db2.gz QPDIOKXXGDCXGC-LJQANCHMSA-N 2 0 342.483 4.023 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)CC(F)(F)F)c1cccc(OCC[NH+](C)C)c1 ZINC000663477751 1025453699 /nfs/dbraw/zinc/45/36/99/1025453699.db2.gz HUTZRGXVEGWCQU-CQSZACIVSA-N 2 0 346.437 4.256 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)CC(F)(F)F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000663478480 1025467471 /nfs/dbraw/zinc/46/74/71/1025467471.db2.gz RENAFAOTWRLTKD-NVXWUHKLSA-N 2 0 342.449 4.465 20 0 EIADRP Cc1ccc2[nH]c(C[NH2+]Cc3ccc(F)c(C[NH+](C)C)c3)cc2c1C ZINC000472045637 1025501804 /nfs/dbraw/zinc/50/18/04/1025501804.db2.gz UUVUHBZLCXPTQK-UHFFFAOYSA-N 2 0 339.458 4.275 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@@H](Sc2ccncc2)C1 ZINC001167826940 1025628597 /nfs/dbraw/zinc/62/85/97/1025628597.db2.gz SDMRAAGPEFDRGV-IEBWSBKVSA-N 2 0 335.561 4.149 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)[C@H]1CCCN(Cc2ccccc2)C1 ZINC001167833356 1025783355 /nfs/dbraw/zinc/78/33/55/1025783355.db2.gz APSSOASVHKWFRF-UNMCSNQZSA-N 2 0 345.575 4.093 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCSC[C@H]1c1ccc(F)cc1 ZINC001167833328 1025790612 /nfs/dbraw/zinc/79/06/12/1025790612.db2.gz AFRDRCNGTCXCIM-LPHOPBHVSA-N 2 0 338.536 4.426 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000415010689 1025824920 /nfs/dbraw/zinc/82/49/20/1025824920.db2.gz GPEIWXWSJJBFFU-COXVUDFISA-N 2 0 328.422 4.449 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(n2ncc3ccccc32)CC1 ZINC001167838246 1025850421 /nfs/dbraw/zinc/85/04/21/1025850421.db2.gz SLXBHIHPQNDRQJ-SFHVURJKSA-N 2 0 342.531 4.184 20 0 EIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@H](C)CCC[NH3+])cc1 ZINC000415019331 1025852291 /nfs/dbraw/zinc/85/22/91/1025852291.db2.gz IAIMMRHNEOARJQ-GOSISDBHSA-N 2 0 348.494 4.065 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@@H](c2cccc(OC)c2)C1 ZINC001167839553 1025853907 /nfs/dbraw/zinc/85/39/07/1025853907.db2.gz ABJCKCYVLTVXBF-AZUAARDMSA-N 2 0 332.532 4.385 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCc2nccn2C1)c1ccc(SC(F)F)cc1 ZINC000278943180 1025855783 /nfs/dbraw/zinc/85/57/83/1025855783.db2.gz KJZVIACXTKNKGS-CHWSQXEVSA-N 2 0 337.439 4.111 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cc(Cl)cc(Cl)c1OC(F)F ZINC000415014820 1025856395 /nfs/dbraw/zinc/85/63/95/1025856395.db2.gz MYOAIIPTPQPDAU-VIFPVBQESA-N 2 0 341.229 4.202 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1sccc1Br)c1ccccc1 ZINC000415049873 1025857871 /nfs/dbraw/zinc/85/78/71/1025857871.db2.gz HVPKEHRJAQFQBX-CQSZACIVSA-N 2 0 339.302 4.080 20 0 EIADRP Clc1ccc2c(c1)[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3CC1CC1)CC2 ZINC001167967947 1025888468 /nfs/dbraw/zinc/88/84/68/1025888468.db2.gz MCNNUEVTRQXSQF-DLZDZTESSA-N 2 0 330.903 4.322 20 0 EIADRP C[C@H]([NH2+]CCCN1CCCO[C@@H](C)C1)c1cc(Cl)cc(Cl)c1 ZINC000432418145 1025896164 /nfs/dbraw/zinc/89/61/64/1025896164.db2.gz QJONPYUMIPQMEU-KBPBESRZSA-N 2 0 345.314 4.145 20 0 EIADRP C[C@H]1C[N@H+](CCC[NH2+][C@H](c2ccccc2F)C2CCCC2)CCCO1 ZINC000432420126 1025899185 /nfs/dbraw/zinc/89/91/85/1025899185.db2.gz IYVIVNZMTWAMQW-UWJYYQICSA-N 2 0 348.506 4.148 20 0 EIADRP Clc1cccc([C@@H]2C[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167968565 1025907590 /nfs/dbraw/zinc/90/75/90/1025907590.db2.gz RNEQODQCZMQXSI-HLKUOHOZSA-N 2 0 330.903 4.191 20 0 EIADRP C[C@H](C[NH2+][C@H]1CCN(C2CC2)[C@H](c2ccccc2)C1)c1ccncc1 ZINC000638718844 1026033401 /nfs/dbraw/zinc/03/34/01/1026033401.db2.gz MMLXTZDIKYUINP-AGHHOFFYSA-N 2 0 335.495 4.143 20 0 EIADRP C[NH+](C)CCCOc1ccc(C[NH2+]Cc2ccc3occc3c2)cc1 ZINC000512137581 1026114492 /nfs/dbraw/zinc/11/44/92/1026114492.db2.gz VNOOACIEZMBWNQ-UHFFFAOYSA-N 2 0 338.451 4.053 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000511075255 1026187227 /nfs/dbraw/zinc/18/72/27/1026187227.db2.gz RGDCFJQBNDXMSG-YLJYHZDGSA-N 2 0 336.470 4.423 20 0 EIADRP Fc1ccc(CC2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CCC2)cc1 ZINC001167975142 1026223322 /nfs/dbraw/zinc/22/33/22/1026223322.db2.gz IMOVQGMIUXRQRK-SEJPIABJSA-N 2 0 342.502 4.286 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2ccc(C3CCC3)cc2)cc1F ZINC000550175415 1026278065 /nfs/dbraw/zinc/27/80/65/1026278065.db2.gz SNLRRQVDVZYODN-UHFFFAOYSA-N 2 0 326.459 4.445 20 0 EIADRP Fc1cc(F)c2c(c1)[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3CC1CC1)CCC2 ZINC001167981776 1026369616 /nfs/dbraw/zinc/36/96/16/1026369616.db2.gz JQDDEAPOSTWEQS-IMOOIFFWSA-N 2 0 346.465 4.337 20 0 EIADRP COc1cccc(-c2csc(C[NH2+]C(C)(C)CCC[NH+](C)C)n2)c1 ZINC000894729848 1026379912 /nfs/dbraw/zinc/37/99/12/1026379912.db2.gz AAVNHSVNILMYIK-UHFFFAOYSA-N 2 0 347.528 4.029 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cccc3cc[nH]c32)C1 ZINC000512214511 1026476591 /nfs/dbraw/zinc/47/65/91/1026476591.db2.gz WOIPRMWVYADPDZ-MSOLQXFVSA-N 2 0 325.500 4.254 20 0 EIADRP C[N@@H+]1C[C@@H](C[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)[C@H](c2ccccc2)C1 ZINC000647249290 1026494833 /nfs/dbraw/zinc/49/48/33/1026494833.db2.gz PRQVQXNUXQPPBY-LGKPFJOYSA-N 2 0 349.522 4.043 20 0 EIADRP Clc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C3CC3)C1)CCCS2 ZINC000152450255 1026575454 /nfs/dbraw/zinc/57/54/54/1026575454.db2.gz ZOTYRNXZXXDPND-GUYCJALGSA-N 2 0 336.932 4.341 20 0 EIADRP Clc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@@H+](C3CC3)C1)CCCS2 ZINC000152450413 1026576507 /nfs/dbraw/zinc/57/65/07/1026576507.db2.gz ZOTYRNXZXXDPND-DYVFJYSZSA-N 2 0 336.932 4.341 20 0 EIADRP CO[C@H](CC(C)C)C[N@H+](C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC001167571828 1026584492 /nfs/dbraw/zinc/58/44/92/1026584492.db2.gz BAVWZTYANQEMTE-HMXCVIKNSA-N 2 0 332.532 4.032 20 0 EIADRP COCc1ccccc1/C=C(\C)C[N@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000507097393 1026638265 /nfs/dbraw/zinc/63/82/65/1026638265.db2.gz GKCAVCKWNHQNCI-NBVRZTHBSA-N 2 0 330.516 4.041 20 0 EIADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(C)(c2nc3ccccc3s2)CC1 ZINC000511128568 1026658041 /nfs/dbraw/zinc/65/80/41/1026658041.db2.gz XLDQWOPHMLTJSY-MRXNPFEDSA-N 2 0 343.540 4.134 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)c1cncs1 ZINC000159013428 1026730972 /nfs/dbraw/zinc/73/09/72/1026730972.db2.gz PSIDJEGWTZRNMK-ZACQAIPSSA-N 2 0 343.540 4.472 20 0 EIADRP Fc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1-c1cccs1 ZINC000391397337 1026752535 /nfs/dbraw/zinc/75/25/35/1026752535.db2.gz NGACIKXWBJKFLW-CVEARBPZSA-N 2 0 330.472 4.271 20 0 EIADRP CCc1cccnc1[C@@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000507496647 1026811178 /nfs/dbraw/zinc/81/11/78/1026811178.db2.gz OZAOXBGPMUJVSV-QGZVFWFLSA-N 2 0 325.500 4.335 20 0 EIADRP CCc1cccnc1[C@@H](C)[NH2+]Cc1cccc(C[NH+](CC)CC)c1 ZINC000507488439 1026815657 /nfs/dbraw/zinc/81/56/57/1026815657.db2.gz ULNCAJQEHFNMEY-QGZVFWFLSA-N 2 0 325.500 4.337 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)[C@H]1CCCOC1 ZINC000507491683 1026816595 /nfs/dbraw/zinc/81/65/95/1026816595.db2.gz CERWUDJOKKPDPX-WEMPKCCASA-N 2 0 344.543 4.069 20 0 EIADRP FC1(F)CCC[C@H]([NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000507507626 1026821518 /nfs/dbraw/zinc/82/15/18/1026821518.db2.gz IOOLLBJQJRQTIL-INDMIFKZSA-N 2 0 334.454 4.065 20 0 EIADRP CCc1cccnc1[C@@H](C)[NH2+]Cc1ccccc1C[NH+](CC)CC ZINC000507522030 1026826343 /nfs/dbraw/zinc/82/63/43/1026826343.db2.gz CYNNCJUTRSDEHF-QGZVFWFLSA-N 2 0 325.500 4.337 20 0 EIADRP C[C@H](Cc1ccsc1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000582586271 1026834813 /nfs/dbraw/zinc/83/48/13/1026834813.db2.gz LHWAMJVGWAAZDD-RZXSNQJFSA-N 2 0 340.536 4.464 20 0 EIADRP CC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCCc3cccnc32)CC1 ZINC000684952972 1026885217 /nfs/dbraw/zinc/88/52/17/1026885217.db2.gz BJXCZIBABSUYOJ-QFIPXVFZSA-N 2 0 349.522 4.481 20 0 EIADRP c1ccc(OCCCCC[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000188095272 1027077897 /nfs/dbraw/zinc/07/78/97/1027077897.db2.gz KKWJWDLLVGHSMA-UHFFFAOYSA-N 2 0 330.516 4.232 20 0 EIADRP CCc1cc(N2CC[NH+]([C@@H](C)c3cccnc3)CC2)c2ccccc2[nH+]1 ZINC000301813538 1027096867 /nfs/dbraw/zinc/09/68/67/1027096867.db2.gz YSMAQXYIXQWNCC-KRWDZBQOSA-N 2 0 346.478 4.075 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cc1OC ZINC000474476297 1027105468 /nfs/dbraw/zinc/10/54/68/1027105468.db2.gz WXGBPMYDZGKMPK-KURKYZTESA-N 2 0 348.531 4.050 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000474481610 1027116503 /nfs/dbraw/zinc/11/65/03/1027116503.db2.gz YJTDCRICZLBETR-IPMKNSEASA-N 2 0 332.532 4.289 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)C1CCOCC1 ZINC000474483447 1027119389 /nfs/dbraw/zinc/11/93/89/1027119389.db2.gz AAALBMQDAJBZBG-GUDVDZBRSA-N 2 0 344.543 4.069 20 0 EIADRP c1ccc([C@H]2CC[C@H]([NH2+]CC3CC[NH+](Cc4ccncc4)CC3)C2)cc1 ZINC000657613548 1027288243 /nfs/dbraw/zinc/28/82/43/1027288243.db2.gz NJJPKECTHKHIBF-GOTSBHOMSA-N 2 0 349.522 4.220 20 0 EIADRP c1ccc([C@@H]2CC[C@@H]([NH2+]CC3CC[NH+](Cc4ccncc4)CC3)C2)cc1 ZINC000657613547 1027291471 /nfs/dbraw/zinc/29/14/71/1027291471.db2.gz NJJPKECTHKHIBF-DHIUTWEWSA-N 2 0 349.522 4.220 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CCC(F)(F)[C@H](C)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168041210 1027432820 /nfs/dbraw/zinc/43/28/20/1027432820.db2.gz QZIAUKFOONSEBV-VXIBKDFQSA-N 2 0 336.470 4.405 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2ccc3c(n2)CCC3)cc1 ZINC000582830971 1027449733 /nfs/dbraw/zinc/44/97/33/1027449733.db2.gz APKKUZPSHJWDOY-GOSISDBHSA-N 2 0 349.522 4.235 20 0 EIADRP C[C@H](c1ccc(OC(F)F)cc1)[N@H+](C)CC[C@H]1CCCC[NH+]1C ZINC000441331231 1027469448 /nfs/dbraw/zinc/46/94/48/1027469448.db2.gz NMXPITKARPHRJM-GDBMZVCRSA-N 2 0 326.431 4.155 20 0 EIADRP CCCc1nc(C)c(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)o1 ZINC000428303328 1027546440 /nfs/dbraw/zinc/54/64/40/1027546440.db2.gz SJZCBQQUQKJYKB-UHFFFAOYSA-N 2 0 333.520 4.024 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]2)C1 ZINC000320915254 1027562347 /nfs/dbraw/zinc/56/23/47/1027562347.db2.gz DOOGLPPWFUVPDY-KMFMINBZSA-N 2 0 326.406 4.230 20 0 EIADRP CCC1([NH+]2CCCC2)CCN(Cc2cc3ccncc3s2)CC1 ZINC000639376043 1027593441 /nfs/dbraw/zinc/59/34/41/1027593441.db2.gz QNQAPIGSXWDQKD-UHFFFAOYSA-N 2 0 329.513 4.137 20 0 EIADRP C[C@H](CCc1ccc(Cl)s1)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475576493 1027694851 /nfs/dbraw/zinc/69/48/51/1027694851.db2.gz UNMUYRSFQJESHB-WLYUNCDWSA-N 2 0 326.937 4.329 20 0 EIADRP CCC[NH+]1CCC([NH2+]CCCCc2cccc(C(F)(F)F)c2)CC1 ZINC000474876152 1027717795 /nfs/dbraw/zinc/71/77/95/1027717795.db2.gz CUXZHGMTWHBAOI-UHFFFAOYSA-N 2 0 342.449 4.492 20 0 EIADRP COc1cccc([C@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)c1 ZINC001167995088 1027742696 /nfs/dbraw/zinc/74/26/96/1027742696.db2.gz VOKSIDVKSHPBSP-XQXKNUKBSA-N 2 0 340.511 4.238 20 0 EIADRP c1csc(C2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)c1 ZINC001167995624 1027785216 /nfs/dbraw/zinc/78/52/16/1027785216.db2.gz LQHQOLXINBWFPI-DFNIBXOVSA-N 2 0 330.541 4.333 20 0 EIADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474947441 1027820575 /nfs/dbraw/zinc/82/05/75/1027820575.db2.gz PLJHOFWWVUTREF-MELADBBJSA-N 2 0 326.937 4.215 20 0 EIADRP CCOc1ccc(C2=CCN(CCC[NH+]3CCCCC3)CC2)cc1 ZINC000444616093 1027891131 /nfs/dbraw/zinc/89/11/31/1027891131.db2.gz BVPYXGPJODFWHM-UHFFFAOYSA-N 2 0 328.500 4.050 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNCc2cnc(C3CC3)o2)cc1 ZINC000628202151 1027950329 /nfs/dbraw/zinc/95/03/29/1027950329.db2.gz JEEVRVODQSHIPF-MRXNPFEDSA-N 2 0 339.483 4.216 20 0 EIADRP Cc1nc2c(s1)[C@@H]([NH2+]Cc1cccc(C[NH+]3CCCC3)c1)CCC2 ZINC000123050718 1027985872 /nfs/dbraw/zinc/98/58/72/1027985872.db2.gz NAXWAQCUBHRVJV-SFHVURJKSA-N 2 0 341.524 4.215 20 0 EIADRP Cc1cccc2[nH]cc(CC[NH2+]C3CC[NH+](C4CCCC4)CC3)c21 ZINC000165267110 1028040064 /nfs/dbraw/zinc/04/00/64/1028040064.db2.gz CGKGAXSNLPOVNX-UHFFFAOYSA-N 2 0 325.500 4.015 20 0 EIADRP Cc1ccc2cc(C[NH2+]CCCC[N@H+]3CCCC[C@H]3C)ccc2n1 ZINC000189256245 1028110365 /nfs/dbraw/zinc/11/03/65/1028110365.db2.gz FNVCEOSNCRIFOS-GOSISDBHSA-N 2 0 325.500 4.287 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](CC[C@@H](C)OCc2ccccc2)CC1 ZINC000475046142 1028210020 /nfs/dbraw/zinc/21/00/20/1028210020.db2.gz GSGUDKVQBGCDGQ-LJQANCHMSA-N 2 0 332.532 4.036 20 0 EIADRP CCC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@@H]1CCc2ccccc21 ZINC000346136970 1028293333 /nfs/dbraw/zinc/29/33/33/1028293333.db2.gz QBDKBGWUPDVCEZ-JOCHJYFZSA-N 2 0 346.478 4.475 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@H]1c1ccccc1C ZINC000346174505 1028306314 /nfs/dbraw/zinc/30/63/14/1028306314.db2.gz MKHOEAHRPZOMIO-NRFANRHFSA-N 2 0 332.451 4.221 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C(C)(C)C)cc2)[C@H](C)C1 ZINC000523733321 1028341145 /nfs/dbraw/zinc/34/11/45/1028341145.db2.gz VVRWNXYVOJKGRP-NQIIRXRSSA-N 2 0 346.559 4.211 20 0 EIADRP FC1(F)CC[C@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000281080515 1028377744 /nfs/dbraw/zinc/37/77/44/1028377744.db2.gz JGEPWXACDHOWRX-CADBVGFASA-N 2 0 334.454 4.207 20 0 EIADRP Fc1cncc([C@@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)C2CC2)c1 ZINC000281137832 1028407770 /nfs/dbraw/zinc/40/77/70/1028407770.db2.gz FQUVCGXBXJZRGI-NRFANRHFSA-N 2 0 339.458 4.057 20 0 EIADRP Cc1ccc(-c2ccc(C[NH+]3CCC(OCCC[NH3+])CC3)s2)cc1 ZINC000346628059 1028556923 /nfs/dbraw/zinc/55/69/23/1028556923.db2.gz AHMORNSIMYFXFO-UHFFFAOYSA-N 2 0 344.524 4.053 20 0 EIADRP [NH3+]C1CC[NH+](Cc2ccc(-c3ccccc3C(F)(F)F)cc2)CC1 ZINC000629691304 1028642700 /nfs/dbraw/zinc/64/27/00/1028642700.db2.gz SWTPJMJPUZXAIL-UHFFFAOYSA-N 2 0 334.385 4.296 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000583395825 1028656514 /nfs/dbraw/zinc/65/65/14/1028656514.db2.gz NZPPOTNBWWOBQX-ZILJWTLNSA-N 2 0 327.299 4.027 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCC12CCOCC2 ZINC000548794490 1028696261 /nfs/dbraw/zinc/69/62/61/1028696261.db2.gz HYECITHUGVEMOS-WIYYLYMNSA-N 2 0 342.527 4.110 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2cnc(C(F)(F)F)s2)C1 ZINC000443991943 1028712656 /nfs/dbraw/zinc/71/26/56/1028712656.db2.gz XJEAHAHGWWJEEX-CHWSQXEVSA-N 2 0 349.466 4.010 20 0 EIADRP CC(C)C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccncc1 ZINC000647292115 1028732770 /nfs/dbraw/zinc/73/27/70/1028732770.db2.gz QBJRPNCHXWOQKB-OAQYLSRUSA-N 2 0 338.499 4.070 20 0 EIADRP C[C@H](CC[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1)[NH+]1CCCCC1 ZINC000346883710 1028800580 /nfs/dbraw/zinc/80/05/80/1028800580.db2.gz YYGODXWHFVDQIZ-SBHAEUEKSA-N 2 0 330.516 4.008 20 0 EIADRP CC(C)C[C@H](C[N@@H+]1CCC[C@H]([C@H]2C[C@@H]([NH3+])CCO2)C1)c1ccccc1 ZINC000650707699 1028833855 /nfs/dbraw/zinc/83/38/55/1028833855.db2.gz LAIKJXQJALFBMG-LNRXMEIDSA-N 2 0 344.543 4.035 20 0 EIADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000347001249 1028836836 /nfs/dbraw/zinc/83/68/36/1028836836.db2.gz GVNOGJMJNKQWEU-HIFRSBDPSA-N 2 0 334.410 4.000 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)CC1 ZINC000375740347 1028877780 /nfs/dbraw/zinc/87/77/80/1028877780.db2.gz BCCIHVQDDWMFID-AEGPPILISA-N 2 0 326.937 4.356 20 0 EIADRP COCCC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1ccc(F)cc1 ZINC000281880164 1028907332 /nfs/dbraw/zinc/90/73/32/1028907332.db2.gz GDLNGWTXJXLZPT-YLJYHZDGSA-N 2 0 336.495 4.003 20 0 EIADRP Cc1cc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)ccc1F ZINC000384105339 1028914642 /nfs/dbraw/zinc/91/46/42/1028914642.db2.gz XDIZUUDMUHNYBD-FQEVSTJZSA-N 2 0 326.459 4.136 20 0 EIADRP Cc1ccccc1C1([NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)CCC1 ZINC000650740554 1029044113 /nfs/dbraw/zinc/04/41/13/1029044113.db2.gz MRBOPODWOUBXLX-IRLDBZIGSA-N 2 0 348.490 4.220 20 0 EIADRP COc1ccc2cc(C[NH2+]C[C@@H](C)C[NH+]3CCCCC3)ccc2c1 ZINC000324441270 1029049093 /nfs/dbraw/zinc/04/90/93/1029049093.db2.gz FCMZZBGTQGTKBO-QGZVFWFLSA-N 2 0 326.484 4.060 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CCC1(C[NH3+])CC1 ZINC000650744184 1029064550 /nfs/dbraw/zinc/06/45/50/1029064550.db2.gz IEWHTBVZKBWFPS-GFCCVEGCSA-N 2 0 333.476 4.037 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC1 ZINC000650743961 1029065696 /nfs/dbraw/zinc/06/56/96/1029065696.db2.gz CGVLBTNPRQXOHH-HNNXBMFYSA-N 2 0 345.487 4.045 20 0 EIADRP Cc1nc(C(C)C)oc1CN[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000428430028 1029125844 /nfs/dbraw/zinc/12/58/44/1029125844.db2.gz GUEYEGXSAWATCT-QFBILLFUSA-N 2 0 341.499 4.107 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCCOc2c(Cl)cc(C)cc21 ZINC000650757239 1029202519 /nfs/dbraw/zinc/20/25/19/1029202519.db2.gz SCRGVYNTNAJMAF-LJQANCHMSA-N 2 0 344.886 4.371 20 0 EIADRP C[NH+]1CCC2(CCC[N@@H+]2Cc2ccc(-c3c(F)cccc3F)o2)CC1 ZINC000475110733 1029267797 /nfs/dbraw/zinc/26/77/97/1029267797.db2.gz AFLGWGLINFKBEU-UHFFFAOYSA-N 2 0 346.421 4.285 20 0 EIADRP COc1c(C)cc([C@@H](C)[NH2+]Cc2ccc3c[nH+]cn3c2)cc1Cl ZINC000840779924 1029273418 /nfs/dbraw/zinc/27/34/18/1029273418.db2.gz PMEXHAPQXYACIG-CYBMUJFWSA-N 2 0 329.831 4.156 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cc(C)c(O)c(C)c1 ZINC000324811970 1029368219 /nfs/dbraw/zinc/36/82/19/1029368219.db2.gz DDFGSLARLWEVQB-UHFFFAOYSA-N 2 0 326.484 4.141 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)CCS2 ZINC000343494396 1029369747 /nfs/dbraw/zinc/36/97/47/1029369747.db2.gz FIHMCEFVRORSJR-VQIMIIECSA-N 2 0 348.556 4.334 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H]3CCCc4occc43)CC2)c1 ZINC000192783842 1029386785 /nfs/dbraw/zinc/38/67/85/1029386785.db2.gz KIJZSSPPYCHPAX-GOSISDBHSA-N 2 0 330.497 4.220 20 0 EIADRP C[NH+](C)[C@H]1CCC[N@H+](CCCCc2cccc(C(F)(F)F)c2)CC1 ZINC000475212398 1029443168 /nfs/dbraw/zinc/44/31/68/1029443168.db2.gz UQQQGHYKWUEKTB-SFHVURJKSA-N 2 0 342.449 4.444 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@H]3CCC[C@H]3c3ccccc3)C2)cc1 ZINC000475274048 1029479444 /nfs/dbraw/zinc/47/94/44/1029479444.db2.gz HKAOSXPXPKMLRO-PUHATCMVSA-N 2 0 334.507 4.434 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@H]3CC[C@H](c4ccccc4)C3)C2)cc1 ZINC000475276620 1029481699 /nfs/dbraw/zinc/48/16/99/1029481699.db2.gz PHGFMRLCTISBTC-PUHATCMVSA-N 2 0 334.507 4.434 20 0 EIADRP COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cccc(Cn2ccnc2)c1 ZINC000151329817 1029482948 /nfs/dbraw/zinc/48/29/48/1029482948.db2.gz AWDQZKLPCINCIG-KRWDZBQOSA-N 2 0 335.451 4.099 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2cn(C(C)C)nc2C)CC1 ZINC000343564574 1029505448 /nfs/dbraw/zinc/50/54/48/1029505448.db2.gz VVKVRNCCIBQQPO-UHFFFAOYSA-N 2 0 334.552 4.106 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(C(F)F)nc1 ZINC000657824634 1029583339 /nfs/dbraw/zinc/58/33/39/1029583339.db2.gz RTDKECVTUQULHA-OAHLLOKOSA-N 2 0 345.437 4.466 20 0 EIADRP CSC1CC[NH+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001168062792 1029600383 /nfs/dbraw/zinc/60/03/83/1029600383.db2.gz MEOWZSGNEZHNRL-IAGOWNOFSA-N 2 0 332.557 4.255 20 0 EIADRP c1cc(Oc2ccccc2)oc1C[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446884055 1029630751 /nfs/dbraw/zinc/63/07/51/1029630751.db2.gz LVUJGNOOXWVOBN-UHFFFAOYSA-N 2 0 326.440 4.036 20 0 EIADRP Clc1ccccc1[C@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446885405 1029632295 /nfs/dbraw/zinc/63/22/95/1029632295.db2.gz WHEKTEKXEDMGHL-QUCCMNQESA-N 2 0 332.919 4.440 20 0 EIADRP c1ccc(CC[C@@H]2CCC[C@H]2[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446886671 1029632355 /nfs/dbraw/zinc/63/23/55/1029632355.db2.gz IMYCMTKOADSGHE-RBBKRZOGSA-N 2 0 326.528 4.252 20 0 EIADRP Cc1c([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2)cnn1-c1cc(C)ccc1C ZINC000584173263 1029657007 /nfs/dbraw/zinc/65/70/07/1029657007.db2.gz HNTPYTIPDUJEPZ-QGZVFWFLSA-N 2 0 348.494 4.107 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](C[C@H](OC(C)C)c2ccccc2)CC1 ZINC000428468338 1029684611 /nfs/dbraw/zinc/68/46/11/1029684611.db2.gz NONTXGMZZLCUFR-NRFANRHFSA-N 2 0 332.532 4.207 20 0 EIADRP C[C@H]1c2ccccc2C[NH+]1CCOCC[N@@H+]1Cc2ccccc2[C@@H]1C ZINC000343738207 1029731954 /nfs/dbraw/zinc/73/19/54/1029731954.db2.gz JKKYDOKJLAARFX-ROUUACIJSA-N 2 0 336.479 4.157 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657839225 1029740498 /nfs/dbraw/zinc/74/04/98/1029740498.db2.gz PLEIZMJYRLJVNW-OWCLPIDISA-N 2 0 339.474 4.428 20 0 EIADRP Cc1cc(C)c(C[NH2+]C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)cc1C ZINC000708511635 1029743333 /nfs/dbraw/zinc/74/33/33/1029743333.db2.gz DYLZFMPNCLCKFL-NFBKMPQASA-N 2 0 336.523 4.470 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)C1CCOCC1 ZINC000584380785 1029794446 /nfs/dbraw/zinc/79/44/46/1029794446.db2.gz SDKIMIKXQCNPAK-IFMALSPDSA-N 2 0 344.543 4.084 20 0 EIADRP COCc1ccc(C[NH2+][C@H](C)c2ccc(-n3ccnc3C)cc2)cc1 ZINC000086279076 1029838984 /nfs/dbraw/zinc/83/89/84/1029838984.db2.gz SIYNOSDVGNRFOH-MRXNPFEDSA-N 2 0 335.451 4.178 20 0 EIADRP C[C@@H]([NH2+][C@H]1CCc2ccc(F)cc21)c1cccc(OCC[NH+](C)C)c1 ZINC000089552530 1029855038 /nfs/dbraw/zinc/85/50/38/1029855038.db2.gz YXQGNGKSKOBELW-VFNWGFHPSA-N 2 0 342.458 4.104 20 0 EIADRP CC(C)(C)c1nc(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)cs1 ZINC000090948875 1029865826 /nfs/dbraw/zinc/86/58/26/1029865826.db2.gz KIVGSUDYPFSUOX-UHFFFAOYSA-N 2 0 349.588 4.370 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)c1ccc(OC)c(OC)c1 ZINC000090586274 1029867901 /nfs/dbraw/zinc/86/79/01/1029867901.db2.gz ZLTFGVIRUJHFKJ-PKOBYXMFSA-N 2 0 348.531 4.113 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)c1ccc(OC)c(OC)c1 ZINC000090586289 1029867950 /nfs/dbraw/zinc/86/79/50/1029867950.db2.gz ZLTFGVIRUJHFKJ-IEBWSBKVSA-N 2 0 348.531 4.113 20 0 EIADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1OC ZINC000183187523 1029991590 /nfs/dbraw/zinc/99/15/90/1029991590.db2.gz UNTAPTLJWLZMII-HLIPFELVSA-N 2 0 330.516 4.389 20 0 EIADRP Cc1ccc(C)c([C@@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)c1 ZINC000392266656 1030079182 /nfs/dbraw/zinc/07/91/82/1030079182.db2.gz OQQNUZCYDRYQMX-XXBNENTESA-N 2 0 334.507 4.467 20 0 EIADRP C[C@@H](C[NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc(F)cc1 ZINC000525869865 1030090094 /nfs/dbraw/zinc/09/00/94/1030090094.db2.gz MABIRSXSTXXNNZ-INIZCTEOSA-N 2 0 346.515 4.493 20 0 EIADRP COc1cccc([C@@H](C)[NH2+]CCC[NH2+][C@@H](C)c2cccc(OC)c2)c1 ZINC000211392305 1030131623 /nfs/dbraw/zinc/13/16/23/1030131623.db2.gz SDRXFDAAZFCZBP-CALCHBBNSA-N 2 0 342.483 4.095 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(Br)c(Cl)c1 ZINC000657874205 1030135013 /nfs/dbraw/zinc/13/50/13/1030135013.db2.gz YHRKKVQYFPCNQU-NSHDSACASA-N 2 0 345.712 4.095 20 0 EIADRP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447568716 1030154390 /nfs/dbraw/zinc/15/43/90/1030154390.db2.gz LVVCFGMKEJCKOI-CYBMUJFWSA-N 2 0 335.561 4.274 20 0 EIADRP CCc1cnccc1[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447579677 1030207788 /nfs/dbraw/zinc/20/77/88/1030207788.db2.gz LIYQORLFAAVAOQ-CIQXWFTPSA-N 2 0 349.522 4.490 20 0 EIADRP C[NH+]1CCC(CC[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)CC1 ZINC000392394086 1030214568 /nfs/dbraw/zinc/21/45/68/1030214568.db2.gz XMXJWBHECFEECT-OAQYLSRUSA-N 2 0 326.459 4.237 20 0 EIADRP C[C@@H](c1ccc(C[N@@H+]2CC[C@]3(C2)CCC[NH+](C)C3)cc1)C(F)(F)F ZINC000451066191 1030221139 /nfs/dbraw/zinc/22/11/39/1030221139.db2.gz BTWDZOIDUNLJKO-MAUKXSAKSA-N 2 0 340.433 4.270 20 0 EIADRP C[C@H](Cc1ccc(Cl)cc1)[NH2+]CC1CC[NH+](CC2CCC2)CC1 ZINC001168165957 1030270210 /nfs/dbraw/zinc/27/02/10/1030270210.db2.gz KXOXVHPJBMPEQA-MRXNPFEDSA-N 2 0 334.935 4.373 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCc2c(F)cccc2Cl)C[C@H]1C ZINC000447723518 1030310304 /nfs/dbraw/zinc/31/03/04/1030310304.db2.gz PQHSWZYRNMKCGF-HUUCEWRRSA-N 2 0 326.887 4.216 20 0 EIADRP CCc1ccc(-c2ccc(C[N@@H+]3CC[C@H](c4nccn4C)C3)o2)cc1 ZINC000685463268 1030344560 /nfs/dbraw/zinc/34/45/60/1030344560.db2.gz NCEAJZXDRDQHBE-SFHVURJKSA-N 2 0 335.451 4.232 20 0 EIADRP Fc1cc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)ccc1Cl ZINC000062426537 1030427666 /nfs/dbraw/zinc/42/76/66/1030427666.db2.gz NTLLKXVKSFFIDG-GOSISDBHSA-N 2 0 346.877 4.481 20 0 EIADRP C[C@@H]1C[C@H]([N@H+](C)CCCOc2cccc3ccccc32)CCN1C ZINC000530666367 1030619185 /nfs/dbraw/zinc/61/91/85/1030619185.db2.gz UVVGMLFIWSWFHE-IEBWSBKVSA-N 2 0 326.484 4.023 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+][C@H]2CCCSCC2)C[N@@H+]1Cc1ccccc1 ZINC000657934214 1030633216 /nfs/dbraw/zinc/63/32/16/1030633216.db2.gz ZZRLTWMYIHHYPQ-HOJAQTOUSA-N 2 0 332.557 4.162 20 0 EIADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(Br)c(Cl)c1 ZINC000657939434 1030644638 /nfs/dbraw/zinc/64/46/38/1030644638.db2.gz YBZFAGOCFBEEOL-NSHDSACASA-N 2 0 343.696 4.015 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1cc[n+](C[C@@H]2CCC3(CCCCC3)O2)cc1 ZINC000191699549 1030654278 /nfs/dbraw/zinc/65/42/78/1030654278.db2.gz UEPZIYZFRQBTPZ-CTNGQTDRSA-N 2 0 343.535 4.230 20 0 EIADRP CC(C)Oc1cc(Cl)c(C[NH2+][C@H](C)Cn2ccnc2)cc1Cl ZINC000527637645 1030791215 /nfs/dbraw/zinc/79/12/15/1030791215.db2.gz NHGPDDRFFLAEKZ-GFCCVEGCSA-N 2 0 342.270 4.155 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2occc2c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000658119595 1030838263 /nfs/dbraw/zinc/83/82/63/1030838263.db2.gz MUEJQYHSNQRYSY-INIZCTEOSA-N 2 0 338.451 4.224 20 0 EIADRP Brc1ccc(/C=C\CC[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000527741681 1030839190 /nfs/dbraw/zinc/83/91/90/1030839190.db2.gz AEKFDMYGDLWECB-CYXJYWMISA-N 2 0 349.316 4.069 20 0 EIADRP CCc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)s1 ZINC000658168885 1030863980 /nfs/dbraw/zinc/86/39/80/1030863980.db2.gz ZXUOAABZDFKARH-INIZCTEOSA-N 2 0 343.540 4.268 20 0 EIADRP Cc1ccc(C2CC([NH2+]CC3CC[NH+](Cc4ccncc4)CC3)C2)cc1 ZINC000658166351 1030864067 /nfs/dbraw/zinc/86/40/67/1030864067.db2.gz NWUSHVDGMNCMMN-UHFFFAOYSA-N 2 0 349.522 4.138 20 0 EIADRP CC[C@H]1C[C@H]([NH2+]CC2(CC)CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC000648488626 1030880436 /nfs/dbraw/zinc/88/04/36/1030880436.db2.gz CMDPIAILMDHQSK-RTWAWAEBSA-N 2 0 344.543 4.226 20 0 EIADRP C[C@H]1CN(Cc2ccccn2)CC[C@@H]1[NH2+]CC(C1CCC1)C1CCC1 ZINC000527925276 1030922640 /nfs/dbraw/zinc/92/26/40/1030922640.db2.gz MDNBYPWATRRAJK-JTSKRJEESA-N 2 0 341.543 4.098 20 0 EIADRP CCCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)cc1OCCC ZINC000392722144 1030944305 /nfs/dbraw/zinc/94/43/05/1030944305.db2.gz PTWYZTCJCPXEGI-MSOLQXFVSA-N 2 0 348.531 4.257 20 0 EIADRP Cc1ccncc1[C@@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658320000 1030980158 /nfs/dbraw/zinc/98/01/58/1030980158.db2.gz LPPXBLLDTCDEFJ-CTNGQTDRSA-N 2 0 349.522 4.343 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2ccccc2C(F)(F)F)CC1 ZINC000532483070 1031215894 /nfs/dbraw/zinc/21/58/94/1031215894.db2.gz YCEYOWZHEPSZDL-AWEZNQCLSA-N 2 0 328.422 4.478 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@H](Cc1cccc(F)c1)c1cccc(F)c1 ZINC000532491493 1031233358 /nfs/dbraw/zinc/23/33/58/1031233358.db2.gz AMMQMQTVXXQBJO-HXUWFJFHSA-N 2 0 332.438 4.180 20 0 EIADRP CC1CCC([NH+]2CCC3(CC([N@H+](C)Cc4ccncc4)C3)CC2)CC1 ZINC001168214718 1031299756 /nfs/dbraw/zinc/29/97/56/1031299756.db2.gz DJZFBQHXYYRALH-UHFFFAOYSA-N 2 0 341.543 4.337 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cc3cccnc3o2)CC1)CC1CC1 ZINC000449057449 1031410265 /nfs/dbraw/zinc/41/02/65/1031410265.db2.gz CDQNGSNQHNJQCA-UHFFFAOYSA-N 2 0 341.499 4.162 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@H]3CCOC4(CCC4)C3)cc2)C1 ZINC000449074135 1031427163 /nfs/dbraw/zinc/42/71/63/1031427163.db2.gz BLRAZDRQHRYDEV-NQIIRXRSSA-N 2 0 342.527 4.110 20 0 EIADRP Cc1nccn1C[C@H](C)C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449076530 1031431459 /nfs/dbraw/zinc/43/14/59/1031431459.db2.gz TZDLROHNRJKMKR-QGZVFWFLSA-N 2 0 348.579 4.096 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccc(C)cc2OC)c1 ZINC000449089919 1031449774 /nfs/dbraw/zinc/44/97/74/1031449774.db2.gz LVSYMXVJRYRANT-UHFFFAOYSA-N 2 0 326.484 4.135 20 0 EIADRP Clc1ccc(C2=CC[C@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000449089120 1031450062 /nfs/dbraw/zinc/45/00/62/1031450062.db2.gz JICCKKQQTOBXDY-SLFFLAALSA-N 2 0 330.903 4.492 20 0 EIADRP C[NH+](C)CCCOc1ccc(C[NH2+]Cc2cccc3ccoc32)cc1 ZINC000449121957 1031461236 /nfs/dbraw/zinc/46/12/36/1031461236.db2.gz JWNRAVZTPDNEFG-UHFFFAOYSA-N 2 0 338.451 4.053 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]C2CCC(OC3CCCC3)CC2)c1 ZINC000449131746 1031465751 /nfs/dbraw/zinc/46/57/51/1031465751.db2.gz PGWLMCGAWRXOJH-UHFFFAOYSA-N 2 0 344.543 4.498 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CCc2c1cccc2Cl ZINC000531694845 1031476376 /nfs/dbraw/zinc/47/63/76/1031476376.db2.gz UOKSVUGFHKQTJJ-IBGZPJMESA-N 2 0 344.886 4.058 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2Cl ZINC000531694846 1031476902 /nfs/dbraw/zinc/47/69/02/1031476902.db2.gz UOKSVUGFHKQTJJ-LJQANCHMSA-N 2 0 344.886 4.058 20 0 EIADRP CS[C@@H]1CCC[C@H]([NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)C1 ZINC000449143944 1031478563 /nfs/dbraw/zinc/47/85/63/1031478563.db2.gz RNBYESBIVXZLAG-JRGCBEDISA-N 2 0 346.584 4.346 20 0 EIADRP Cc1nc(-c2ccc(CNC3CC[NH+](CC4CC4)CC3)cc2)cs1 ZINC000531698782 1031483030 /nfs/dbraw/zinc/48/30/30/1031483030.db2.gz VAKGOGDNNXNFCG-UHFFFAOYSA-N 2 0 341.524 4.083 20 0 EIADRP Cc1cccc([C@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c1C ZINC000531704776 1031491652 /nfs/dbraw/zinc/49/16/52/1031491652.db2.gz MCUKPCOIZQBBCH-IBGZPJMESA-N 2 0 340.511 4.485 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCCOc3ccc(C)cc32)c1 ZINC000123946222 1031494722 /nfs/dbraw/zinc/49/47/22/1031494722.db2.gz CXZWFBYNEISKJW-NRFANRHFSA-N 2 0 338.495 4.450 20 0 EIADRP C[C@H](O)CC(C)(C)C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449161893 1031499677 /nfs/dbraw/zinc/49/96/77/1031499677.db2.gz PSSPUGHXOOBPRG-INIZCTEOSA-N 2 0 326.569 4.052 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)C1 ZINC000584479619 1031501634 /nfs/dbraw/zinc/50/16/34/1031501634.db2.gz AVAGVMNGRUWTBC-CXUGXGMPSA-N 2 0 326.406 4.201 20 0 EIADRP CC[C@@H]([NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)c1ccncc1 ZINC000449165040 1031504027 /nfs/dbraw/zinc/50/40/27/1031504027.db2.gz SPNOMXKDMWCKSH-PGRDOPGGSA-N 2 0 337.511 4.218 20 0 EIADRP COc1cc2ccccc2cc1C[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000449201602 1031542609 /nfs/dbraw/zinc/54/26/09/1031542609.db2.gz ITQAVSNVYPPOQI-UHFFFAOYSA-N 2 0 326.484 4.058 20 0 EIADRP CC1CC[NH+](Cc2ccccc2C[NH2+][C@H]2CCOC3(CCC3)C2)CC1 ZINC000449218067 1031551517 /nfs/dbraw/zinc/55/15/17/1031551517.db2.gz FEJSWHQLHZZMOV-NRFANRHFSA-N 2 0 342.527 4.110 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+]C2CCC(OC3CCCC3)CC2)c1 ZINC000449224147 1031554272 /nfs/dbraw/zinc/55/42/72/1031554272.db2.gz ZYWIJPUTOOXIRJ-UHFFFAOYSA-N 2 0 330.516 4.108 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2cc3cccnc3o2)CC1 ZINC000449232273 1031561540 /nfs/dbraw/zinc/56/15/40/1031561540.db2.gz HNFKQFRNKWVASW-UHFFFAOYSA-N 2 0 329.488 4.162 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CCO1 ZINC000449240903 1031577741 /nfs/dbraw/zinc/57/77/41/1031577741.db2.gz PSONSVGXWUTHOI-QZTJIDSGSA-N 2 0 338.580 4.460 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCc1c(Cl)cccc1Cl ZINC000422730139 1031582909 /nfs/dbraw/zinc/58/29/09/1031582909.db2.gz DKMKBCAKYWDSNC-LLVKDONJSA-N 2 0 338.282 4.049 20 0 EIADRP Cc1nc2c(n1[C@@H]1CC[N@H+](Cc3cccc4ccoc43)C1)CCCC2 ZINC000449265597 1031600706 /nfs/dbraw/zinc/60/07/06/1031600706.db2.gz SEWNUAFVENJNMY-GOSISDBHSA-N 2 0 335.451 4.264 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC000449298097 1031605759 /nfs/dbraw/zinc/60/57/59/1031605759.db2.gz FSRJSPRAZOAGOQ-FUHWJXTLSA-N 2 0 336.470 4.107 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CCCN(C)[C@@H]1c1cccs1)c1ccncc1 ZINC000453116540 1031607281 /nfs/dbraw/zinc/60/72/81/1031607281.db2.gz HRQXXIQHTXNLLN-LNLFQRSKSA-N 2 0 329.513 4.267 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2[C@@H]3Cc4ccccc4[C@@H]32)CC1 ZINC000449325402 1031623679 /nfs/dbraw/zinc/62/36/79/1031623679.db2.gz MLPUSLOGCMFIPC-YLJCJYEASA-N 2 0 346.518 4.010 20 0 EIADRP CCOC1(C[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)CCCC1 ZINC000449342928 1031640347 /nfs/dbraw/zinc/64/03/47/1031640347.db2.gz GKCYBRJENQVFLF-LJQANCHMSA-N 2 0 344.543 4.021 20 0 EIADRP C[C@H](CCCc1cccnc1)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000453167078 1031673071 /nfs/dbraw/zinc/67/30/71/1031673071.db2.gz ITWDXWZQWZOVDF-JSRJAPPDSA-N 2 0 343.559 4.426 20 0 EIADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccc(-c2ccncc2)cc1F ZINC000449527455 1031822166 /nfs/dbraw/zinc/82/21/66/1031822166.db2.gz INIOHZRZRHJEMP-UHFFFAOYSA-N 2 0 329.463 4.098 20 0 EIADRP Cc1cc(C[NH2+]C(C)(C)CCC[NH+](C)C)sc1Br ZINC000449526161 1031822842 /nfs/dbraw/zinc/82/28/42/1031822842.db2.gz CWQDYECIXRNTDK-UHFFFAOYSA-N 2 0 333.339 4.029 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)C1CCOCC1 ZINC000531949845 1031862592 /nfs/dbraw/zinc/86/25/92/1031862592.db2.gz HPIPWXJFLFELRS-QFIPXVFZSA-N 2 0 344.543 4.357 20 0 EIADRP C[C@H]([C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC[C@@]2(CCSC2)C1 ZINC000453356544 1031886119 /nfs/dbraw/zinc/88/61/19/1031886119.db2.gz KWGXOJFLWIXNKH-HMXCVIKNSA-N 2 0 344.568 4.116 20 0 EIADRP C[C@H]([C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC[C@]2(CCSC2)C1 ZINC000453356540 1031886173 /nfs/dbraw/zinc/88/61/73/1031886173.db2.gz KWGXOJFLWIXNKH-GIVPXCGWSA-N 2 0 344.568 4.116 20 0 EIADRP Cc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000453387499 1031897185 /nfs/dbraw/zinc/89/71/85/1031897185.db2.gz FGGQTRAFOPNNIL-MSOLQXFVSA-N 2 0 326.484 4.347 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453389398 1031898097 /nfs/dbraw/zinc/89/80/97/1031898097.db2.gz CGRHHUOIUCUYQA-CQSZACIVSA-N 2 0 328.422 4.100 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000531970873 1031903206 /nfs/dbraw/zinc/90/32/06/1031903206.db2.gz ZDINZSKSVGJXEE-IHRRRGAJSA-N 2 0 345.314 4.081 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(Br)c(F)c1 ZINC000453401358 1031936875 /nfs/dbraw/zinc/93/68/75/1031936875.db2.gz MSIRZNWMLDXLNR-GFCCVEGCSA-N 2 0 343.284 4.113 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1csc(-c2ccccc2F)n1 ZINC000453416386 1031950976 /nfs/dbraw/zinc/95/09/76/1031950976.db2.gz XMMUMLIGZXHUEB-CQSZACIVSA-N 2 0 347.503 4.474 20 0 EIADRP Cc1nc(CN2CCC(C[NH2+]C[C@H]3C(C)=CCC[C@H]3C)CC2)oc1C ZINC000134186121 1031994502 /nfs/dbraw/zinc/99/45/02/1031994502.db2.gz RDOAYLQZCNPGCZ-UZLBHIALSA-N 2 0 345.531 4.085 20 0 EIADRP C[N@H+](CCCC[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)C1CC1 ZINC000453597546 1032019151 /nfs/dbraw/zinc/01/91/51/1032019151.db2.gz OBWUOJSRXVPOFH-UHFFFAOYSA-N 2 0 349.931 4.428 20 0 EIADRP C[N@H+](CCCC[NH2+]Cc1ccc(Br)c(Cl)c1)C1CC1 ZINC000453599327 1032020296 /nfs/dbraw/zinc/02/02/96/1032020296.db2.gz QPWYAEDJXVSDRJ-UHFFFAOYSA-N 2 0 345.712 4.067 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccnc3ccccc23)CC1 ZINC000536629854 1032056644 /nfs/dbraw/zinc/05/66/44/1032056644.db2.gz MBEWNXRPSYVJPJ-UHFFFAOYSA-N 2 0 325.500 4.179 20 0 EIADRP C[N@@H+]1CCC[C@@]2(CC[NH+](CCCOc3ccc4ccccc4c3)C2)C1 ZINC000549840767 1033295572 /nfs/dbraw/zinc/29/55/72/1033295572.db2.gz OBDIBUULPMCUHS-JOCHJYFZSA-N 2 0 338.495 4.026 20 0 EIADRP CSCCCC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000512633897 1033572672 /nfs/dbraw/zinc/57/26/72/1033572672.db2.gz AWGPDSDOTGQSFS-VAMGGRTRSA-N 2 0 332.557 4.020 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ncc(-c3ccccc3)o2)CC1 ZINC000052209447 1034477757 /nfs/dbraw/zinc/47/77/57/1034477757.db2.gz FVJPOPZYIJTLMI-UHFFFAOYSA-N 2 0 341.499 4.286 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCC[C@@H](C)C2)cc1OC ZINC000513103973 1034583696 /nfs/dbraw/zinc/58/36/96/1034583696.db2.gz AVASVQSSPMNCFN-IEBWSBKVSA-N 2 0 348.531 4.084 20 0 EIADRP C[C@@H](C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C)c1ccc(C(F)(F)F)cc1 ZINC000513147696 1034654997 /nfs/dbraw/zinc/65/49/97/1034654997.db2.gz CKKYCLOISOLWRY-BXEVVDMOSA-N 2 0 340.433 4.366 20 0 EIADRP C[C@H](C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C)c1ccc(C(F)(F)F)cc1 ZINC000513147699 1034656206 /nfs/dbraw/zinc/65/62/06/1034656206.db2.gz CKKYCLOISOLWRY-DTWYCDNDSA-N 2 0 340.433 4.366 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC1 ZINC000333321545 1034674828 /nfs/dbraw/zinc/67/48/28/1034674828.db2.gz UNHXPQOGVDXSJT-UYSNPLJNSA-N 2 0 345.487 4.186 20 0 EIADRP FC(F)(F)c1cccc(CCC[N@@H+]2CCCC3(CC[NH2+]CC3)C2)c1 ZINC001204727481 1034704599 /nfs/dbraw/zinc/70/45/99/1034704599.db2.gz ARTOXNIHTUDFOI-UHFFFAOYSA-N 2 0 340.433 4.104 20 0 EIADRP FC(F)(F)[C@@H]1CCCC[C@@H]1C[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000513326244 1034878925 /nfs/dbraw/zinc/87/89/25/1034878925.db2.gz OIZAZQMCJHIYJJ-RHSMWYFYSA-N 2 0 332.454 4.352 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000509929203 1035012368 /nfs/dbraw/zinc/01/23/68/1035012368.db2.gz MIYVMCRMGOODTO-SILNSSARSA-N 2 0 344.543 4.338 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)CC1 ZINC000513679010 1035106560 /nfs/dbraw/zinc/10/65/60/1035106560.db2.gz TWHBMZFYBXBHOU-CBNMVNINSA-N 2 0 326.459 4.378 20 0 EIADRP c1cncc([C@@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)C2CCC2)c1 ZINC000280150369 1035187527 /nfs/dbraw/zinc/18/75/27/1035187527.db2.gz AETLWXSQFISIQF-QFIPXVFZSA-N 2 0 335.495 4.308 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]C2CCC([NH+](C)C)CC2)cc1OC ZINC000513702607 1035322995 /nfs/dbraw/zinc/32/29/95/1035322995.db2.gz KSGVRLMASLHCBC-IPJUCJBFSA-N 2 0 348.531 4.398 20 0 EIADRP C[N@@H+](Cc1c(F)cccc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501023248 1035352997 /nfs/dbraw/zinc/35/29/97/1035352997.db2.gz TWNYMCBMEIVZQQ-UHFFFAOYSA-N 2 0 347.865 4.223 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000501380185 1035429884 /nfs/dbraw/zinc/42/98/84/1035429884.db2.gz CUIZLRKKNOWIDT-LTBFUDJGSA-N 2 0 338.417 4.183 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+]C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000501419515 1035441546 /nfs/dbraw/zinc/44/15/46/1035441546.db2.gz GZYHKHYRHXXEET-BAAYTWLHSA-N 2 0 326.406 4.040 20 0 EIADRP c1cncc([C@@H]2CCC[C@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)c1 ZINC000501454083 1035447968 /nfs/dbraw/zinc/44/79/68/1035447968.db2.gz UDFJQBGPAJORMW-NQIIRXRSSA-N 2 0 341.543 4.495 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)CC[N@@H+]1C ZINC000501465712 1035449625 /nfs/dbraw/zinc/44/96/25/1035449625.db2.gz GLQWXKQJLVHTFW-QRWLVFNGSA-N 2 0 344.449 4.169 20 0 EIADRP [NH3+]CC[C@H]1CCCCN1Cc1nc(-c2ccccc2Cl)cs1 ZINC000420314940 1035508417 /nfs/dbraw/zinc/50/84/17/1035508417.db2.gz LTHZWWDKGVFRBK-CYBMUJFWSA-N 2 0 335.904 4.167 20 0 EIADRP CSCC1(CC[NH2+]C2CC[NH+]([C@H](C)Cc3ccccc3)CC2)CC1 ZINC000595066767 1035548968 /nfs/dbraw/zinc/54/89/68/1035548968.db2.gz DZVPCTRWFJHDTB-GOSISDBHSA-N 2 0 346.584 4.205 20 0 EIADRP C[C@H](c1ccc2ccccc2c1)[NH+]1CCC([C@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000420374243 1035572243 /nfs/dbraw/zinc/57/22/43/1035572243.db2.gz HFQMHERVDBIPSN-URZJWIJPSA-N 2 0 338.495 4.119 20 0 EIADRP CC[N@H+](C)C[C@H]1CCN(c2cc(C)[nH+]c3c(C)cc(Cl)cc23)C1 ZINC000485134117 1035714929 /nfs/dbraw/zinc/71/49/29/1035714929.db2.gz UZQJPPSIYSQFPC-OAHLLOKOSA-N 2 0 331.891 4.283 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2nc(-c3ccccc3)cs2)CC1 ZINC000571138023 1035969430 /nfs/dbraw/zinc/96/94/30/1035969430.db2.gz UBAWAPFWNRZONH-HNNXBMFYSA-N 2 0 329.513 4.193 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000502420479 1036202439 /nfs/dbraw/zinc/20/24/39/1036202439.db2.gz YNLNPXISQLMMLZ-FKVLARQCSA-N 2 0 344.543 4.082 20 0 EIADRP C[N@@H+](Cc1cccc(OCc2ccccc2)c1)CC1CC[NH+](C)CC1 ZINC000513750326 1036450354 /nfs/dbraw/zinc/45/03/54/1036450354.db2.gz GNELMPDOOQVYDE-UHFFFAOYSA-N 2 0 338.495 4.039 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502688540 1036482221 /nfs/dbraw/zinc/48/22/21/1036482221.db2.gz WYVSZTGKEQXXIC-CEXWTWQISA-N 2 0 346.563 4.407 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502729035 1036591638 /nfs/dbraw/zinc/59/16/38/1036591638.db2.gz VICITSWNRADEPX-ZWKOTPCHSA-N 2 0 332.536 4.161 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3cc4ccc(F)cc4[nH]3)CC2)CC1 ZINC000486672282 1036810990 /nfs/dbraw/zinc/81/09/90/1036810990.db2.gz CDIPNMHETMWBHD-UHFFFAOYSA-N 2 0 343.490 4.440 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cc2ccc(F)cc2[nH]1 ZINC000486708669 1036821415 /nfs/dbraw/zinc/82/14/15/1036821415.db2.gz OWRZWOSTXCHSGJ-UHFFFAOYSA-N 2 0 339.458 4.439 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)CC1 ZINC000421891959 1036836796 /nfs/dbraw/zinc/83/67/96/1036836796.db2.gz ZACJBYLHUFHZSJ-KVULBXGLSA-N 2 0 342.405 4.035 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]C/C=C/c2ccncc2)C1 ZINC000486935528 1036905328 /nfs/dbraw/zinc/90/53/28/1036905328.db2.gz JKOJRLHJEKUGPQ-ZLHKHBAESA-N 2 0 335.495 4.117 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C/C=C/c2ccncc2)cc1 ZINC000486965470 1036908544 /nfs/dbraw/zinc/90/85/44/1036908544.db2.gz JGTXQNGCAIFUJG-FHHGHWCOSA-N 2 0 335.495 4.259 20 0 EIADRP Cc1ccccc1CN1CCC([NH2+]Cc2cc(Cl)cs2)CC1 ZINC000486969704 1036913574 /nfs/dbraw/zinc/91/35/74/1036913574.db2.gz OKPKCKPKMZLJBZ-UHFFFAOYSA-N 2 0 334.916 4.464 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCc2cccc3[nH]ccc32)CCN1Cc1ccccc1 ZINC000503123230 1036922131 /nfs/dbraw/zinc/92/21/31/1036922131.db2.gz RMWSXKGBFUCZLY-NQIIRXRSSA-N 2 0 347.506 4.353 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]C[C@@H]3CCSC3)cc2)C1 ZINC000486985699 1036934204 /nfs/dbraw/zinc/93/42/04/1036934204.db2.gz HXLYYRMMWIDVKE-HLIPFELVSA-N 2 0 332.557 4.007 20 0 EIADRP CCC(CC)[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cc(F)ccc2C1 ZINC001168415894 1037089440 /nfs/dbraw/zinc/08/94/40/1037089440.db2.gz FXQSHNKCXMHWAT-HMXCVIKNSA-N 2 0 332.507 4.444 20 0 EIADRP CC1CC[NH+](Cc2cccc(C[NH2+]C/C=C\c3ccncc3)c2)CC1 ZINC000487278499 1037092348 /nfs/dbraw/zinc/09/23/48/1037092348.db2.gz OCVGEHJFLNDWEJ-UTCJRWHESA-N 2 0 335.495 4.117 20 0 EIADRP Cc1ccc(-c2cc(C[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)on2)cc1 ZINC000590786389 1037166418 /nfs/dbraw/zinc/16/64/18/1037166418.db2.gz VEDQNLXFFBBEHI-UHFFFAOYSA-N 2 0 341.499 4.202 20 0 EIADRP OC1CC[NH+](Cc2ccc(C[NH2+]CCC3CCCCCC3)cc2)CC1 ZINC000573018547 1037229018 /nfs/dbraw/zinc/22/90/18/1037229018.db2.gz UUYUQDOITYNNHB-UHFFFAOYSA-N 2 0 344.543 4.093 20 0 EIADRP C[C@@H]([NH2+]CCCCCC[NH2+][C@@H](C)c1cccnc1)c1cccnc1 ZINC000272828744 1037304643 /nfs/dbraw/zinc/30/46/43/1037304643.db2.gz KNFFZRHBEOOFBJ-HDICACEKSA-N 2 0 326.488 4.038 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC(c2cc3ccccc3[nH]2)CC1 ZINC000760831236 1037449322 /nfs/dbraw/zinc/44/93/22/1037449322.db2.gz XJUJRWLDEMORDH-IBGZPJMESA-N 2 0 325.500 4.222 20 0 EIADRP CC[N@@H+]1CCC[C@@H](C[NH2+]C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000573596133 1037595753 /nfs/dbraw/zinc/59/57/53/1037595753.db2.gz CXUZOHUXCCXLCQ-MJSCBBHESA-N 2 0 340.433 4.430 20 0 EIADRP C[NH+](C)CC1CC[NH+]([C@H]2CCc3c2cc(Cl)cc3Cl)CC1 ZINC000488449765 1037602742 /nfs/dbraw/zinc/60/27/42/1037602742.db2.gz OVLVUTVSKPCROP-KRWDZBQOSA-N 2 0 327.299 4.254 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CS1 ZINC000488547748 1037659380 /nfs/dbraw/zinc/65/93/80/1037659380.db2.gz SWQCUERTPJFSGT-GTAWCEEGSA-N 2 0 332.557 4.017 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CS1 ZINC000488547754 1037659564 /nfs/dbraw/zinc/65/95/64/1037659564.db2.gz SWQCUERTPJFSGT-RNQOJCNYSA-N 2 0 332.557 4.017 20 0 EIADRP C[C@H]([NH2+][C@@H]1CS[C@H](C(C)(C)C)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000488551033 1037661794 /nfs/dbraw/zinc/66/17/94/1037661794.db2.gz ZOHQJIUJKFPPCB-RNQOJCNYSA-N 2 0 346.584 4.407 20 0 EIADRP Cc1cc(C)c(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)c(C)c1 ZINC000488571541 1037668632 /nfs/dbraw/zinc/66/86/32/1037668632.db2.gz STTYPOQFVNSGBI-QFIPXVFZSA-N 2 0 336.523 4.266 20 0 EIADRP C[C@H]([NH3+])[C@@H]1CC[N@H+](Cc2cccc(OCc3ccccc3Cl)c2)C1 ZINC000414663836 1037722643 /nfs/dbraw/zinc/72/26/43/1037722643.db2.gz RWETVPMXQOHTNH-DOTOQJQBSA-N 2 0 344.886 4.088 20 0 EIADRP CC[C@@H](C(=O)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)[NH+](CC)CC ZINC000605425137 1037778907 /nfs/dbraw/zinc/77/89/07/1037778907.db2.gz WFQOCXCEMFBPLS-PXNSSMCTSA-N 2 0 345.531 4.120 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)CC1 ZINC000513790163 1037789769 /nfs/dbraw/zinc/78/97/69/1037789769.db2.gz SVMFRYNDEOVROO-LJQANCHMSA-N 2 0 328.500 4.145 20 0 EIADRP C[C@@H]1C[C@@H](C[N@@H+]2CCc3sccc3[C@H]2c2cccs2)CC[NH2+]1 ZINC000414680352 1037793408 /nfs/dbraw/zinc/79/34/08/1037793408.db2.gz MYGTWSVJFFXDLF-GLJUWKHASA-N 2 0 332.538 4.145 20 0 EIADRP c1ccc2cc(C[NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)ccc2c1 ZINC000422700359 1037801511 /nfs/dbraw/zinc/80/15/11/1037801511.db2.gz GRGCRDWYRJSXEZ-GGAORHGYSA-N 2 0 344.458 4.185 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1ccc(OCc2ccc(F)cc2)cc1 ZINC000422700797 1037801881 /nfs/dbraw/zinc/80/18/81/1037801881.db2.gz ASIXHMYZQOYDRY-JKSUJKDBSA-N 2 0 330.447 4.183 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H](C)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000422700795 1037802598 /nfs/dbraw/zinc/80/25/98/1037802598.db2.gz ASIXHMYZQOYDRY-HZPDHXFCSA-N 2 0 330.447 4.183 20 0 EIADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000422710325 1037804521 /nfs/dbraw/zinc/80/45/21/1037804521.db2.gz LPRXBNVYFOUVQL-RDJZCZTQSA-N 2 0 346.446 4.023 20 0 EIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)NC1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000422740252 1037822385 /nfs/dbraw/zinc/82/23/85/1037822385.db2.gz BJZHZMNFODVQQN-KNKQGSTJSA-N 2 0 343.559 4.112 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C1CC1 ZINC000422769110 1037829168 /nfs/dbraw/zinc/82/91/68/1037829168.db2.gz STIMPJWXUJYTFZ-DJJJIMSYSA-N 2 0 329.875 4.304 20 0 EIADRP C[C@H](OCCC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)c1ccccc1 ZINC000422788268 1037833844 /nfs/dbraw/zinc/83/38/44/1037833844.db2.gz QXSPUWZPVAEKIW-OYNPSCLESA-N 2 0 330.516 4.055 20 0 EIADRP CCC(CC)(C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)c1ccccc1 ZINC000422797466 1037836796 /nfs/dbraw/zinc/83/67/96/1037836796.db2.gz MQAHSVQSAWJGIZ-INIZCTEOSA-N 2 0 325.500 4.257 20 0 EIADRP C[C@H]1C[C@H](C[NH+]2CCC(c3nc4cc(Cl)ccc4o3)CC2)CC[NH2+]1 ZINC000414694041 1037837374 /nfs/dbraw/zinc/83/73/74/1037837374.db2.gz CRBSWYNSKVXEEU-UONOGXRCSA-N 2 0 347.890 4.049 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1ccc(-c2cccnc2)cc1 ZINC000422824154 1037841777 /nfs/dbraw/zinc/84/17/77/1037841777.db2.gz NEHBIGDDJWABGV-CVEARBPZSA-N 2 0 346.478 4.323 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)[C@@H](C)c1ccccc1 ZINC000422828163 1037841996 /nfs/dbraw/zinc/84/19/96/1037841996.db2.gz TVAVFOBSVIOKFU-IMLKGASGSA-N 2 0 336.479 4.024 20 0 EIADRP FC(F)(F)c1ccc([C@H]2CCCC[C@@H]2[NH2+]C2CC[NH2+]CC2)cc1 ZINC000422831612 1037843735 /nfs/dbraw/zinc/84/37/35/1037843735.db2.gz WVLAQMDYYBJLML-SJORKVTESA-N 2 0 326.406 4.073 20 0 EIADRP FC(F)(F)[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000422820208 1037844651 /nfs/dbraw/zinc/84/46/51/1037844651.db2.gz PLLDBVLUUZSIPD-WRQOLXDDSA-N 2 0 332.454 4.256 20 0 EIADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(COCc2ccccc2)cc1 ZINC000422867692 1037848831 /nfs/dbraw/zinc/84/88/31/1037848831.db2.gz SYZUZLYNZRKONA-YADHBBJMSA-N 2 0 338.495 4.011 20 0 EIADRP c1ccc(-c2nc3c(s2)[C@@H]([NH2+]C2C[C@H]4CC[C@@H](C2)[NH2+]4)CCC3)cc1 ZINC000422862276 1037849456 /nfs/dbraw/zinc/84/94/56/1037849456.db2.gz POZLBWHDVKXKKG-WFVVYAPDSA-N 2 0 339.508 4.060 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CN[C@@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000422874197 1037857820 /nfs/dbraw/zinc/85/78/20/1037857820.db2.gz CGFMFZGQGORYSN-NLSFWIRASA-N 2 0 349.522 4.153 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000311123374 1037858967 /nfs/dbraw/zinc/85/89/67/1037858967.db2.gz HPZJHEKDDHEXNG-PGRDOPGGSA-N 2 0 338.495 4.258 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](c1ccc(F)cc1F)C(C)C ZINC000422872395 1037859316 /nfs/dbraw/zinc/85/93/16/1037859316.db2.gz GYVYJMJYYRHFNN-YJYMSZOUSA-N 2 0 333.426 4.175 20 0 EIADRP c1ccc([C@@H]2OCCC[C@@H]2C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000422908794 1037862702 /nfs/dbraw/zinc/86/27/02/1037862702.db2.gz ZIADPJLVGMZWPH-BDHVOXNPSA-N 2 0 342.527 4.055 20 0 EIADRP c1sc(CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)nc1C1CCCCC1 ZINC000422914469 1037868977 /nfs/dbraw/zinc/86/89/77/1037868977.db2.gz UHXUVEMTMONYPW-RCCFBDPRSA-N 2 0 347.572 4.244 20 0 EIADRP COc1ccc([C@H]([NH2+][C@@H](C)CCC[NH3+])c2ccccc2Cl)cc1 ZINC000422927733 1037870835 /nfs/dbraw/zinc/87/08/35/1037870835.db2.gz ZYRCUBPYYWVYDP-LIRRHRJNSA-N 2 0 332.875 4.155 20 0 EIADRP COc1ccc([C@H]([NH2+][C@H](C)CCC[NH3+])c2ccccc2Cl)cc1 ZINC000422927732 1037871742 /nfs/dbraw/zinc/87/17/42/1037871742.db2.gz ZYRCUBPYYWVYDP-KUHUBIRLSA-N 2 0 332.875 4.155 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1CCSc2ccc(Br)cc21 ZINC000422949539 1037884845 /nfs/dbraw/zinc/88/48/45/1037884845.db2.gz VODREJSFYBYJEC-FZMZJTMJSA-N 2 0 343.334 4.093 20 0 EIADRP COc1ccccc1SC[C@H](C)C[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422947684 1037885303 /nfs/dbraw/zinc/88/53/03/1037885303.db2.gz QWTFEVIMJFDJTD-OLMNPRSZSA-N 2 0 342.508 4.158 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CCSc2ccc(Br)cc21 ZINC000422949541 1037885510 /nfs/dbraw/zinc/88/55/10/1037885510.db2.gz VODREJSFYBYJEC-SMDDNHRTSA-N 2 0 343.334 4.093 20 0 EIADRP CC[C@H](Cc1ccc(Cl)cc1)[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422982770 1037895253 /nfs/dbraw/zinc/89/52/53/1037895253.db2.gz RGPSCLCPZWDWHV-CXAGYDPISA-N 2 0 331.891 4.174 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)C[N@@H+]1Cc1ccccc1 ZINC000423007217 1037898885 /nfs/dbraw/zinc/89/88/85/1037898885.db2.gz XCIZUZMXZAGSDI-IQWFGDOHSA-N 3 0 349.522 4.022 20 0 EIADRP Fc1ccc(C2=CC[C@H]([NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)CC2)cc1 ZINC000423049436 1037905284 /nfs/dbraw/zinc/90/52/84/1037905284.db2.gz XNVQRKFGLPWYTQ-XSDIEEQYSA-N 2 0 328.475 4.272 20 0 EIADRP C([NH2+][C@@H]1CCOC[C@@H]1[C@H]1CCC[NH2+]1)C1(C2CCCCC2)CCCCC1 ZINC000423022255 1037906447 /nfs/dbraw/zinc/90/64/47/1037906447.db2.gz HHALDIFTVBSXMA-NJDAHSKKSA-N 2 0 348.575 4.264 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)Cc1ccc(C(C)C)cc1 ZINC000423023353 1037907393 /nfs/dbraw/zinc/90/73/93/1037907393.db2.gz JQFXIDNPUIWJBM-CVEARBPZSA-N 2 0 325.500 4.254 20 0 EIADRP C[C@@H]([NH2+]C1CCC(C[NH3+])CC1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000423026215 1037911988 /nfs/dbraw/zinc/91/19/88/1037911988.db2.gz PRZQNZUFMMSOHR-LMRVLLHPSA-N 2 0 328.422 4.305 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000423028960 1037912839 /nfs/dbraw/zinc/91/28/39/1037912839.db2.gz UFYNWXJRZQBIJU-UNEWFSDZSA-N 2 0 328.422 4.449 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000423028958 1037913124 /nfs/dbraw/zinc/91/31/24/1037913124.db2.gz UFYNWXJRZQBIJU-KMFMINBZSA-N 2 0 328.422 4.449 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2ccc(CC(C)C)cc2)CC[NH+](C)CC1 ZINC000574085913 1037923930 /nfs/dbraw/zinc/92/39/30/1037923930.db2.gz IWQCVEFTUPSWNF-KRWDZBQOSA-N 2 0 334.573 4.363 20 0 EIADRP [NH3+][C@@H]1C[C@@H]([NH+]2CCC(Cc3ccc(F)c(F)c3)CC2)c2ccccc21 ZINC000423046143 1037926650 /nfs/dbraw/zinc/92/66/50/1037926650.db2.gz DVOSYYNFBAAURW-NHCUHLMSSA-N 2 0 342.433 4.364 20 0 EIADRP c1ccc2c(c1)O[C@@]1(CC[NH2+]C1)C[C@H]2[NH2+]Cc1ccc(C2CCC2)cc1 ZINC000423067840 1037932562 /nfs/dbraw/zinc/93/25/62/1037932562.db2.gz AGHPXJNQYUNESD-GGAORHGYSA-N 2 0 348.490 4.300 20 0 EIADRP Fc1c(Cl)cccc1C1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)CCCC1 ZINC000423070910 1037934076 /nfs/dbraw/zinc/93/40/76/1037934076.db2.gz GXSLKPNSPWBORK-YIONKMFJSA-N 2 0 336.882 4.164 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]CCc1c[nH]c2cc(Cl)cc(Cl)c12 ZINC000423072000 1037934310 /nfs/dbraw/zinc/93/43/10/1037934310.db2.gz INTRGDSJRZGGAO-NSHDSACASA-N 2 0 328.287 4.124 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000423052581 1037938044 /nfs/dbraw/zinc/93/80/44/1037938044.db2.gz QURWDBVKJCCWAS-WFASDCNBSA-N 2 0 333.476 4.044 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1CCC(F)(F)CC1 ZINC000503864801 1037950267 /nfs/dbraw/zinc/95/02/67/1037950267.db2.gz WHCQLJBKTOXWRK-APWZRJJASA-N 2 0 336.470 4.312 20 0 EIADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000423096954 1037955339 /nfs/dbraw/zinc/95/53/39/1037955339.db2.gz QDQQPIQVEYPUSB-NXNVCVFFSA-N 2 0 326.406 4.059 20 0 EIADRP COCCC[C@H](C[NH2+][C@@H]1CCCCC[C@@H]1[NH3+])c1ccc(Cl)cc1 ZINC000423100149 1037958068 /nfs/dbraw/zinc/95/80/68/1037958068.db2.gz GJSCORDWAFUPEZ-NZSAHSFTSA-N 2 0 338.923 4.100 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1 ZINC000423097864 1037958570 /nfs/dbraw/zinc/95/85/70/1037958570.db2.gz BOOQVNWPYWWHFK-XOKHGSTOSA-N 2 0 328.422 4.449 20 0 EIADRP C[C@@H]([NH3+])[C@H](Cc1ccccc1)[NH2+]C1CC(F)(c2cccc(Cl)c2)C1 ZINC000423099385 1037959536 /nfs/dbraw/zinc/95/95/36/1037959536.db2.gz TZUQDFUIORGXTB-ZIQQEGCCSA-N 2 0 346.877 4.215 20 0 EIADRP Cc1cc([C@@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)ccc1F ZINC000423146634 1037999511 /nfs/dbraw/zinc/99/95/11/1037999511.db2.gz PUVDPGSUIITNAQ-VMRPVKRXSA-N 2 0 340.442 4.041 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423132906 1038009387 /nfs/dbraw/zinc/00/93/87/1038009387.db2.gz PSHKXABLJGFXBU-MQSCRBSSSA-N 2 0 348.490 4.218 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423203930 1038054093 /nfs/dbraw/zinc/05/40/93/1038054093.db2.gz CXTUSQOTRUBZMR-FUHWJXTLSA-N 2 0 342.458 4.055 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+][C@H](C)[C@H]3CCC[NH2+]C3)cs2)cs1 ZINC000423216832 1038060904 /nfs/dbraw/zinc/06/09/04/1038060904.db2.gz PCOITSMBJVATIE-DYEKYZERSA-N 2 0 335.542 4.219 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc2ccccc2c1OC(F)F ZINC000423218176 1038061706 /nfs/dbraw/zinc/06/17/06/1038061706.db2.gz VHGJKGMAGBFVBQ-KBPBESRZSA-N 2 0 334.410 4.091 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423216234 1038063047 /nfs/dbraw/zinc/06/30/47/1038063047.db2.gz OENIEOHDTGCXSM-KCQAQPDRSA-N 2 0 346.462 4.380 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000423233109 1038070348 /nfs/dbraw/zinc/07/03/48/1038070348.db2.gz NYNMIJJKHGXTDK-LYAPFXNSSA-N 2 0 326.406 4.201 20 0 EIADRP C[N@@H+](Cc1ccc(OCc2ccccc2)cc1)C[C@H]1CCC[NH+](C)C1 ZINC000607358216 1038077171 /nfs/dbraw/zinc/07/71/71/1038077171.db2.gz RMRAEZMZAVFTPA-NRFANRHFSA-N 2 0 338.495 4.039 20 0 EIADRP c1ccc([C@@H]([NH2+]CC[C@H]2CCC[NH2+]C2)c2ccc3ccccc3n2)cc1 ZINC000423256077 1038083393 /nfs/dbraw/zinc/08/33/93/1038083393.db2.gz DJHRUZRDIMJYQK-WZONZLPQSA-N 2 0 345.490 4.304 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423257117 1038084302 /nfs/dbraw/zinc/08/43/02/1038084302.db2.gz HNQFKYWJORQMMD-DZGCQCFKSA-N 2 0 347.503 4.298 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423256656 1038085265 /nfs/dbraw/zinc/08/52/65/1038085265.db2.gz FPCPBHUITWYKGN-KBPBESRZSA-N 2 0 346.462 4.381 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423283595 1038086882 /nfs/dbraw/zinc/08/68/82/1038086882.db2.gz XNUHACNUVYSSNT-IAGOWNOFSA-N 2 0 327.516 4.203 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)cc1 ZINC000423259637 1038087591 /nfs/dbraw/zinc/08/75/91/1038087591.db2.gz OQBMLFQVXIELIM-ROUUACIJSA-N 2 0 338.495 4.403 20 0 EIADRP [NH3+]C1(C[NH2+][C@@H]2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)CCC1 ZINC000423322353 1038121083 /nfs/dbraw/zinc/12/10/83/1038121083.db2.gz IHMYGHNJFFLNRU-HZPDHXFCSA-N 2 0 326.406 4.203 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)CCCS2 ZINC000423295684 1038122527 /nfs/dbraw/zinc/12/25/27/1038122527.db2.gz XEICSOYVSQAHKA-KUHUBIRLSA-N 2 0 342.508 4.432 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2nc3ccc(Cl)cc3n2C)cc1 ZINC000423296006 1038123650 /nfs/dbraw/zinc/12/36/50/1038123650.db2.gz YEWKATMSCCHFQB-OLZOCXBDSA-N 2 0 342.874 4.097 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCCOc3c(Cl)cc(C)cc32)C1 ZINC000489585737 1038132167 /nfs/dbraw/zinc/13/21/67/1038132167.db2.gz AXIXHKAHGGQJLD-MAUKXSAKSA-N 2 0 336.907 4.184 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]CC2=CC[NH2+]CC2)CCC3)cc1 ZINC000423346442 1038136904 /nfs/dbraw/zinc/13/69/04/1038136904.db2.gz PGNPVPBCDFGWIX-QGZVFWFLSA-N 2 0 339.508 4.005 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423327560 1038140797 /nfs/dbraw/zinc/14/07/97/1038140797.db2.gz LKHAEOBCMTYFJT-YJYMSZOUSA-N 2 0 347.503 4.298 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]C[C@]2(C)CCC[NH2+]C2)cc1 ZINC000423336458 1038148812 /nfs/dbraw/zinc/14/88/12/1038148812.db2.gz STVRZSRQUZCXEM-VGOFRKELSA-N 2 0 338.495 4.403 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]C[C@@]2(C)CCC[NH2+]C2)cc1 ZINC000423336457 1038150216 /nfs/dbraw/zinc/15/02/16/1038150216.db2.gz STVRZSRQUZCXEM-JTSKRJEESA-N 2 0 338.495 4.403 20 0 EIADRP Clc1ccccc1C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccsc1 ZINC000423356610 1038167703 /nfs/dbraw/zinc/16/77/03/1038167703.db2.gz QVDWIGWHCXXNOF-SFHVURJKSA-N 2 0 332.900 4.195 20 0 EIADRP C[C@H](CCc1ccc(OC(F)F)cc1)[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423361825 1038176610 /nfs/dbraw/zinc/17/66/10/1038176610.db2.gz SCIYNTOBHZWPKL-CQSZACIVSA-N 2 0 346.421 4.002 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[NH2+][C@H](C)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423368688 1038182748 /nfs/dbraw/zinc/18/27/48/1038182748.db2.gz FERGPVLGUXAWBC-GUXCAODWSA-N 2 0 342.458 4.196 20 0 EIADRP C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423366606 1038184396 /nfs/dbraw/zinc/18/43/96/1038184396.db2.gz BUXJYIZZUXDHJP-ZDUSSCGKSA-N 2 0 334.385 4.029 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C2CCC(c3cccc(C(F)(F)F)c3)CC2)CC[NH2+]1 ZINC000423377841 1038189824 /nfs/dbraw/zinc/18/98/24/1038189824.db2.gz KNWHUARWQYUTEW-YHDCKOJYSA-N 2 0 340.433 4.462 20 0 EIADRP Cc1cc(Cl)c2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CCCO2 ZINC000423393159 1038200064 /nfs/dbraw/zinc/20/00/64/1038200064.db2.gz QOJHISFQUUWBCS-LJQANCHMSA-N 2 0 342.870 4.255 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC[NH2+]1 ZINC000423375480 1038207160 /nfs/dbraw/zinc/20/71/60/1038207160.db2.gz KPEZLNGROAWWSL-UHOFOFEASA-N 2 0 345.487 4.057 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccccc1OC(F)F ZINC000423425564 1038213719 /nfs/dbraw/zinc/21/37/19/1038213719.db2.gz OGYUMJSFCLXUOA-IIAWOOMASA-N 2 0 326.431 4.094 20 0 EIADRP COCC1(C[NH2+][C@H](C)c2cccc(-c3ccccc3)c2)CC[NH2+]CC1 ZINC000423405485 1038215985 /nfs/dbraw/zinc/21/59/85/1038215985.db2.gz JJTFRPPKZGOHJS-GOSISDBHSA-N 2 0 338.495 4.020 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CCCS2 ZINC000423406077 1038218820 /nfs/dbraw/zinc/21/88/20/1038218820.db2.gz YJWZBSFAGRTPFX-LJQANCHMSA-N 2 0 340.492 4.015 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+][C@H](C)CCCC[NH3+] ZINC000423432581 1038233194 /nfs/dbraw/zinc/23/31/94/1038233194.db2.gz MLZIULCKWYWRIX-HUUCEWRRSA-N 2 0 331.529 4.210 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000423459878 1038239991 /nfs/dbraw/zinc/23/99/91/1038239991.db2.gz RNQWVHAMBHDERN-IUODEOHRSA-N 2 0 333.476 4.044 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1ccccc1Br ZINC000423461582 1038240765 /nfs/dbraw/zinc/24/07/65/1038240765.db2.gz SYDZGXLSRIDLPS-KDOFPFPSSA-N 2 0 347.300 4.256 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000423459879 1038240899 /nfs/dbraw/zinc/24/08/99/1038240899.db2.gz RNQWVHAMBHDERN-SWLSCSKDSA-N 2 0 333.476 4.044 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000423463913 1038242200 /nfs/dbraw/zinc/24/22/00/1038242200.db2.gz GAGATCUMBBFVHE-KMFMINBZSA-N 2 0 328.422 4.134 20 0 EIADRP COc1ccc([C@H]([NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)c2ccc(F)cc2)cc1 ZINC000423465913 1038242631 /nfs/dbraw/zinc/24/26/31/1038242631.db2.gz ICDBOCSRTQANMA-MFMILTCTSA-N 2 0 342.458 4.031 20 0 EIADRP CCC[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cccnc1 ZINC000423462318 1038242722 /nfs/dbraw/zinc/24/27/22/1038242722.db2.gz DNOPPJFXOHBZJU-CEWLAPEOSA-N 2 0 341.474 4.045 20 0 EIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000423464703 1038243308 /nfs/dbraw/zinc/24/33/08/1038243308.db2.gz GYLSNCRNVYGWAP-DWLFOUALSA-N 2 0 338.495 4.086 20 0 EIADRP FCCC[C@H]1CCC[C@H]1[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000423467456 1038245167 /nfs/dbraw/zinc/24/51/67/1038245167.db2.gz IYTMEFHQWWHVNF-PIKOESSRSA-N 2 0 336.470 4.027 20 0 EIADRP Clc1cccc([C@@H](Cc2cccnc2)[NH2+]CCC[C@H]2CCC[NH2+]2)c1 ZINC000423469094 1038245444 /nfs/dbraw/zinc/24/54/44/1038245444.db2.gz CHLJRHVTOPDTFC-WOJBJXKFSA-N 2 0 343.902 4.141 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cccc(F)c1 ZINC000423480404 1038251060 /nfs/dbraw/zinc/25/10/60/1038251060.db2.gz WBIPAIAELOWMDS-GZRFBZBPSA-N 2 0 330.422 4.009 20 0 EIADRP CC[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccccc1Br ZINC000423487799 1038261393 /nfs/dbraw/zinc/26/13/93/1038261393.db2.gz URGOQUVSLKEHSA-CZUORRHYSA-N 2 0 325.294 4.022 20 0 EIADRP CC[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cccc(Br)c1 ZINC000423488768 1038261574 /nfs/dbraw/zinc/26/15/74/1038261574.db2.gz VRIQQEVUVFQXJS-JKSUJKDBSA-N 2 0 325.294 4.022 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423495637 1038265114 /nfs/dbraw/zinc/26/51/14/1038265114.db2.gz CFVLINSCAOBYAL-LZJOCLMNSA-N 2 0 326.484 4.257 20 0 EIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cnc2ccsc2c1 ZINC000423497694 1038268671 /nfs/dbraw/zinc/26/86/71/1038268671.db2.gz HHPFODQPAWOQHJ-PBHICJAKSA-N 2 0 325.481 4.427 20 0 EIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cccc(OC(F)F)c1 ZINC000423511498 1038272021 /nfs/dbraw/zinc/27/20/21/1038272021.db2.gz TWQDSKLPKUEVKW-RDTXWAMCSA-N 2 0 334.410 4.419 20 0 EIADRP FC(F)(F)c1cccc([C@@H]2CCC[C@@H]2[NH2+]CCC2=CC[NH2+]CC2)c1 ZINC000423541624 1038290218 /nfs/dbraw/zinc/29/02/18/1038290218.db2.gz SLLZMWAEGCGANV-ROUUACIJSA-N 2 0 338.417 4.241 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@H]2CCCc3ccc(C)cc32)[C@H](C)C1 ZINC000490269972 1038419157 /nfs/dbraw/zinc/41/91/57/1038419157.db2.gz FJHMJMMQTCHPLV-QIJUGHKUSA-N 2 0 344.543 4.099 20 0 EIADRP C[C@H]1C[C@H]([NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)CC[N@@H+]1C ZINC000608061535 1038448176 /nfs/dbraw/zinc/44/81/76/1038448176.db2.gz JLQCDGZVCNUQEF-GHTZIAJQSA-N 2 0 347.506 4.262 20 0 EIADRP Cc1ccc(NC(=O)CC[C@H]([NH3+])CC2CCCCC2)c(C[NH+](C)C)c1 ZINC000424146064 1038639951 /nfs/dbraw/zinc/63/99/51/1038639951.db2.gz OWSYOHWNEIGEGT-IBGZPJMESA-N 2 0 345.531 4.073 20 0 EIADRP CC(C)n1cncc1C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000424142798 1038641569 /nfs/dbraw/zinc/64/15/69/1038641569.db2.gz FHQYMMSICUVMDY-UHFFFAOYSA-N 2 0 340.515 4.130 20 0 EIADRP CCC1(C[NH2+][C@H](C)c2cscn2)CC[NH+](Cc2ccccc2)CC1 ZINC000539042800 1038779231 /nfs/dbraw/zinc/77/92/31/1038779231.db2.gz MYPCPMNTIOGWCW-QGZVFWFLSA-N 2 0 343.540 4.486 20 0 EIADRP Cc1ccc(C[C@@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C2CC2)cc1 ZINC000539038008 1038793696 /nfs/dbraw/zinc/79/36/96/1038793696.db2.gz WBHJCBHHUUUKGR-HSZRJFAPSA-N 2 0 349.522 4.217 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](Cc2ccncc2)c2cccs2)C1 ZINC000424311949 1038800177 /nfs/dbraw/zinc/80/01/77/1038800177.db2.gz LNZKKMFZBSLTNU-RTBURBONSA-N 2 0 343.540 4.137 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC000539062196 1038807928 /nfs/dbraw/zinc/80/79/28/1038807928.db2.gz UAVTUBRMVJENGW-PBBBXTDZSA-N 2 0 346.518 4.073 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H]3CCO[C@@H](C(C)(C)C)C3)CC2)C1 ZINC000539064330 1038809332 /nfs/dbraw/zinc/80/93/32/1038809332.db2.gz AJXYNXNAEJYTCX-BTHPGYMESA-N 2 0 336.564 4.213 20 0 EIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+][C@@H]1CCCC[C@H]1[NH3+] ZINC000424369188 1038838432 /nfs/dbraw/zinc/83/84/32/1038838432.db2.gz BIGLCJRJVLRBOY-RBDSIQFVSA-N 2 0 331.287 4.009 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@H](C)c3c2cccc3C)[C@@H](C)C1 ZINC000504921120 1038845009 /nfs/dbraw/zinc/84/50/09/1038845009.db2.gz QXKPVXUODWIJDB-JYAXBFRTSA-N 2 0 344.543 4.270 20 0 EIADRP COc1cc([C@@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCCC2)ccc1SC ZINC000480909939 1038866061 /nfs/dbraw/zinc/86/60/61/1038866061.db2.gz LFLOYWVLXWQJFF-HZPDHXFCSA-N 2 0 336.545 4.190 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@H](c2ccc(F)cc2)C2CC2)ccc1F ZINC000539200945 1038876619 /nfs/dbraw/zinc/87/66/19/1038876619.db2.gz HUWUQNGNJVAHDI-FQEVSTJZSA-N 2 0 330.422 4.267 20 0 EIADRP C[NH+](C)C1CCC([N@@H+]2CCC[C@H](Oc3ccc(Cl)cc3)C2)CC1 ZINC001168327415 1038916834 /nfs/dbraw/zinc/91/68/34/1038916834.db2.gz NFAUTDHWRGNZDU-TVPLGVNVSA-N 2 0 336.907 4.056 20 0 EIADRP C[NH+](C)C1CCC([NH+]2CCC3(CC2)OCc2ccc(Cl)cc23)CC1 ZINC001168327543 1038918048 /nfs/dbraw/zinc/91/80/48/1038918048.db2.gz OHCZYVUBNLJKOV-UHFFFAOYSA-N 2 0 348.918 4.034 20 0 EIADRP C[NH+](C)C1CCC([NH+]2CCC(Cc3ccc(F)cc3F)CC2)CC1 ZINC001168328193 1038939212 /nfs/dbraw/zinc/93/92/12/1038939212.db2.gz ZBJKKDNQTZQDPF-UHFFFAOYSA-N 2 0 336.470 4.092 20 0 EIADRP C[NH+](C)C1CCC(n2cc(C3CC[NH2+]CC3)c3cccc(F)c32)CC1 ZINC001168328812 1038947355 /nfs/dbraw/zinc/94/73/55/1038947355.db2.gz KRRVHLUDPWDMKA-UHFFFAOYSA-N 2 0 343.490 4.293 20 0 EIADRP CC[NH+]1CCC([NH2+]C[C@@H]2CC3c4ccccc4C2c2ccccc23)CC1 ZINC000539308076 1038977849 /nfs/dbraw/zinc/97/78/49/1038977849.db2.gz FLLJYTBEUGGUJI-XWFFHEKESA-N 2 0 346.518 4.358 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)C1 ZINC000481037765 1038988213 /nfs/dbraw/zinc/98/82/13/1038988213.db2.gz MXZOEKCCSCVWBB-LRDDRELGSA-N 2 0 327.299 4.302 20 0 EIADRP CC[C@@H]1CCC[C@H]1[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000539394940 1039028937 /nfs/dbraw/zinc/02/89/37/1039028937.db2.gz AISZRCPHIFQRIW-QRQLOZEOSA-N 2 0 328.500 4.143 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1cccs1 ZINC000643522496 1039038051 /nfs/dbraw/zinc/03/80/51/1039038051.db2.gz NZQCTIKUPYTTMZ-NVXWUHKLSA-N 2 0 334.916 4.417 20 0 EIADRP CCCOc1c(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cccc1OCC ZINC000414808588 1039039657 /nfs/dbraw/zinc/03/96/57/1039039657.db2.gz LCYOWZXUXINLTR-MRXNPFEDSA-N 2 0 342.483 4.184 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)CCc2ccc(OC(F)F)cc2)cc1 ZINC000414808713 1039040759 /nfs/dbraw/zinc/04/07/59/1039040759.db2.gz FSPKSFNGAAMMPY-HUUCEWRRSA-N 2 0 348.437 4.419 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)CC3 ZINC000414810801 1039056718 /nfs/dbraw/zinc/05/67/18/1039056718.db2.gz OKEFGHUZXDMJAS-YJBOKZPZSA-N 2 0 333.479 4.143 20 0 EIADRP CC[C@@H]1CCCC[C@@H]1[NH2+]CC1(C[NH2+][C@H]2CCCC[C@H]2CC)COC1 ZINC000481189168 1039097061 /nfs/dbraw/zinc/09/70/61/1039097061.db2.gz JCOVERUEOQPRJY-ZRNYENFQSA-N 2 0 336.564 4.120 20 0 EIADRP CCCOc1ccc(CN(C)[C@H]2CC[N@H+](CC)[C@H](C)C2)cc1OCC ZINC000552071108 1039098750 /nfs/dbraw/zinc/09/87/50/1039098750.db2.gz PTRQOOFOOMKJQX-MJGOQNOKSA-N 2 0 348.531 4.179 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2cc(Cl)ccc2OCC2CC2)cc1 ZINC000414817522 1039107404 /nfs/dbraw/zinc/10/74/04/1039107404.db2.gz SJBBSZFYXBCZNR-AWEZNQCLSA-N 2 0 344.886 4.438 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CCc2c[nH]c3cc(Cl)cc(Cl)c23)CC[N@@H+]1C ZINC000477855752 1039136651 /nfs/dbraw/zinc/13/66/51/1039136651.db2.gz IIFFFLGGDGYIIG-SMDDNHRTSA-N 2 0 340.298 4.090 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3cccs3)CC2)cc1 ZINC000120668231 1039171044 /nfs/dbraw/zinc/17/10/44/1039171044.db2.gz JDNAQQLJRRMUDL-MRXNPFEDSA-N 2 0 344.524 4.320 20 0 EIADRP CC[NH+]1CCC([NH2+]CCc2c[nH]c3cc(Cl)cc(Cl)c23)CC1 ZINC000477870083 1039176252 /nfs/dbraw/zinc/17/62/52/1039176252.db2.gz ZJPMHSPUYQMJOP-UHFFFAOYSA-N 2 0 340.298 4.091 20 0 EIADRP CCN(c1ccccc1)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000414824422 1039178820 /nfs/dbraw/zinc/17/88/20/1039178820.db2.gz FRUUIQSQYKBPQK-YOFSQIOKSA-N 2 0 335.495 4.217 20 0 EIADRP Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cc1C ZINC000481293896 1039225776 /nfs/dbraw/zinc/22/57/76/1039225776.db2.gz INRSPQKCWKOKSC-LJQANCHMSA-N 2 0 340.511 4.403 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc2c(c1)CCC2 ZINC000120870684 1039233852 /nfs/dbraw/zinc/23/38/52/1039233852.db2.gz PWSKMGIODQOPKU-HNNXBMFYSA-N 2 0 326.459 4.227 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CCCCc3ccccc32)c1 ZINC000481316566 1039290500 /nfs/dbraw/zinc/29/05/00/1039290500.db2.gz ATIWLVULRFIZRB-QFIPXVFZSA-N 2 0 338.495 4.184 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2cnc(C3CCCCC3)s2)CC1 ZINC000534343353 1039331871 /nfs/dbraw/zinc/33/18/71/1039331871.db2.gz WSZRWYBJXPLTEX-UHFFFAOYSA-N 2 0 335.561 4.355 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cccc(OC3CCCC3)c2)C[C@H]1C ZINC000537634896 1039340891 /nfs/dbraw/zinc/34/08/91/1039340891.db2.gz YIJWXQGPPRYHIS-MJGOQNOKSA-N 2 0 330.516 4.313 20 0 EIADRP Cc1nc(C(C)(C)C)sc1[C@@H](C)NC1CC[NH+](C2CCC2)CC1 ZINC000481437266 1039411235 /nfs/dbraw/zinc/41/12/35/1039411235.db2.gz PSCSWKLSIACWAN-CYBMUJFWSA-N 2 0 335.561 4.417 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc2c(s1)CCC2 ZINC000122346501 1039656640 /nfs/dbraw/zinc/65/66/40/1039656640.db2.gz BYQBRTYPFZJKQA-OAHLLOKOSA-N 2 0 344.524 4.028 20 0 EIADRP COc1ccc2oc(C[NH2+]CCCC[N@@H+]3CCC[C@H](C)C3)cc2c1 ZINC000478349065 1039687269 /nfs/dbraw/zinc/68/72/69/1039687269.db2.gz ZJGWGKJZWZZMMZ-INIZCTEOSA-N 2 0 330.472 4.043 20 0 EIADRP c1cc(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)cc(-c2ccncc2)c1 ZINC000093563942 1039715946 /nfs/dbraw/zinc/71/59/46/1039715946.db2.gz ALWGTUVAHBOEPX-JOCHJYFZSA-N 2 0 335.495 4.199 20 0 EIADRP Fc1ccc([C@H]([NH2+][C@H]2CC23CC[NH2+]CC3)c2ccccc2Cl)cc1 ZINC000643536268 1039741637 /nfs/dbraw/zinc/74/16/37/1039741637.db2.gz SIHDWNGWBVJCSV-OALUTQOASA-N 2 0 344.861 4.300 20 0 EIADRP Cc1cc([C@@H]([NH2+]Cc2cccc(C[NH+](C)C)c2)C2CC2)ccc1F ZINC000552746132 1039792423 /nfs/dbraw/zinc/79/24/23/1039792423.db2.gz KLYQKGWDCOQCED-NRFANRHFSA-N 2 0 326.459 4.437 20 0 EIADRP CCc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)o1 ZINC000481733363 1039796918 /nfs/dbraw/zinc/79/69/18/1039796918.db2.gz FDHPXQPXIJAZLV-HNNXBMFYSA-N 2 0 332.513 4.466 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CC=C(C)CC2)cc1OC ZINC000550891636 1039813223 /nfs/dbraw/zinc/81/32/23/1039813223.db2.gz OPPBNLGRSXNMLU-IBGZPJMESA-N 2 0 346.515 4.004 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@H](c2cccnc2)C2CCC2)C1 ZINC000481922283 1039895953 /nfs/dbraw/zinc/89/59/53/1039895953.db2.gz XUYVXBVHIKKIPK-OPYAIIAOSA-N 2 0 329.532 4.271 20 0 EIADRP Cc1ccccc1C1(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)CC1 ZINC000481925294 1039900497 /nfs/dbraw/zinc/90/04/97/1039900497.db2.gz MQZGVHYAXMLPLC-UHFFFAOYSA-N 2 0 326.528 4.413 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H](C)CC[NH+](C)C)CCC3)cc1 ZINC000481960130 1039913009 /nfs/dbraw/zinc/91/30/09/1039913009.db2.gz LQTKPVAXOWDTCH-NVXWUHKLSA-N 2 0 343.540 4.426 20 0 EIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]CCCC[NH+](C)C ZINC000481975022 1039924579 /nfs/dbraw/zinc/92/45/79/1039924579.db2.gz QGWIVHRRTXPUQS-QWHCGFSZSA-N 2 0 333.303 4.081 20 0 EIADRP CC(C)[N@H+](C)CC1CCN(Cc2ccc(F)c(C(F)(F)F)c2)CC1 ZINC000535081888 1039954627 /nfs/dbraw/zinc/95/46/27/1039954627.db2.gz KMEHYOACYNGBOV-UHFFFAOYSA-N 2 0 346.412 4.397 20 0 EIADRP C[C@@H](c1ncc(-c2ccccc2)o1)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123216643 1039959445 /nfs/dbraw/zinc/95/94/45/1039959445.db2.gz TYJSXDHCGYHDDS-KRWDZBQOSA-N 2 0 341.499 4.456 20 0 EIADRP CC(C)=CCC[C@@H](C)CC[NH+]1CCN(C2CC[NH+](C(C)C)CC2)CC1 ZINC000482174801 1040059146 /nfs/dbraw/zinc/05/91/46/1040059146.db2.gz ZGTKZWBBUBVRQU-OAQYLSRUSA-N 2 0 349.607 4.249 20 0 EIADRP CC(C)=CCC[C@H](C)CC[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1 ZINC000482212060 1040080062 /nfs/dbraw/zinc/08/00/62/1040080062.db2.gz PIJOPUDUOKVABO-CEWLAPEOSA-N 2 0 336.564 4.117 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000510031682 1040125688 /nfs/dbraw/zinc/12/56/88/1040125688.db2.gz YLHRFYLIEZMGHS-VKAVYKQESA-N 2 0 330.516 4.089 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H](CO)CCC(C)(C)C)CC1 ZINC000551276301 1040135331 /nfs/dbraw/zinc/13/53/31/1040135331.db2.gz BCCSGFFCIAKWLJ-NYLDSWQDSA-N 2 0 346.559 4.206 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)c1 ZINC000479117828 1040149492 /nfs/dbraw/zinc/14/94/92/1040149492.db2.gz IGCXAKKVHXNFIE-FQEVSTJZSA-N 2 0 344.886 4.058 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(OC(F)(F)F)cc2)C1 ZINC000482360658 1040200699 /nfs/dbraw/zinc/20/06/99/1040200699.db2.gz PWNPKNDLFDULPH-CABCVRRESA-N 2 0 344.421 4.356 20 0 EIADRP C[C@@H](NC[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000482441686 1040248822 /nfs/dbraw/zinc/24/88/22/1040248822.db2.gz VPIMHNQDQPTRNK-SJLPKXTDSA-N 2 0 344.449 4.180 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCc3ccc(F)cc32)c1 ZINC000479420303 1040322942 /nfs/dbraw/zinc/32/29/42/1040322942.db2.gz HVSRFICGYDFIFS-OAQYLSRUSA-N 2 0 326.459 4.445 20 0 EIADRP CCC[C@H]([NH2+]CC1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000482554410 1040354699 /nfs/dbraw/zinc/35/46/99/1040354699.db2.gz WEJHFYDQJGRRIR-KRWDZBQOSA-N 2 0 328.422 4.478 20 0 EIADRP c1ccc(C[C@@H]([NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C2CC2)cc1 ZINC000479462205 1040369224 /nfs/dbraw/zinc/36/92/24/1040369224.db2.gz FPIKYDSQQWXYQU-JTHBVZDNSA-N 2 0 334.507 4.119 20 0 EIADRP c1c2ccncc2sc1C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000667501711 1040411476 /nfs/dbraw/zinc/41/14/76/1040411476.db2.gz HUCIMKPPWHKVLK-UHFFFAOYSA-N 2 0 343.540 4.384 20 0 EIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H]3CCC[C@@H](C4CC4)C3)cc2)CC1 ZINC000551573447 1040423548 /nfs/dbraw/zinc/42/35/48/1040423548.db2.gz RNQMNTMCBUGNSN-UXHICEINSA-N 2 0 342.527 4.218 20 0 EIADRP Fc1cccc(-c2ccc(C[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)s2)c1 ZINC000666998150 1040437962 /nfs/dbraw/zinc/43/79/62/1040437962.db2.gz FHRZXLVRACXCSW-MRXNPFEDSA-N 2 0 330.472 4.319 20 0 EIADRP CC1(C)CC([NH2+]Cc2ccc(Cl)c3cccnc23)CC(C)(C)[NH2+]1 ZINC000154708184 1040511343 /nfs/dbraw/zinc/51/13/43/1040511343.db2.gz ITCACYIXEMGPPF-UHFFFAOYSA-N 2 0 331.891 4.287 20 0 EIADRP c1csc([C@@H]2c3ccsc3CC[N@H+]2CCC2CC[NH2+]CC2)c1 ZINC000479683160 1040568569 /nfs/dbraw/zinc/56/85/69/1040568569.db2.gz DTEZGISEFAUEHD-SFHVURJKSA-N 2 0 332.538 4.147 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH+]2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)cc1 ZINC000668172368 1040605585 /nfs/dbraw/zinc/60/55/85/1040605585.db2.gz MCQRXBFJLKWDCD-MOPGFXCFSA-N 2 0 341.524 4.035 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH+]2CC[C@@]3(C2)CCC[N@@H+](C)C3)cc1 ZINC000668194368 1040643274 /nfs/dbraw/zinc/64/32/74/1040643274.db2.gz GMMAYUGHHPIXDZ-FQEVSTJZSA-N 2 0 341.524 4.036 20 0 EIADRP C[N@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCc2ccc(F)cc21 ZINC000483088703 1040698135 /nfs/dbraw/zinc/69/81/35/1040698135.db2.gz LILZWBICRUBQOU-PGRDOPGGSA-N 2 0 338.470 4.267 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cnc(C3CC3)s2)CC1)CC1CC1 ZINC000537756480 1040809183 /nfs/dbraw/zinc/80/91/83/1040809183.db2.gz YUXOAERRSUADJQ-UHFFFAOYSA-N 2 0 347.572 4.355 20 0 EIADRP Cc1ccc(C[C@@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)s1 ZINC000483309710 1040815383 /nfs/dbraw/zinc/81/53/83/1040815383.db2.gz UONVPHHMTDPIKQ-NVXWUHKLSA-N 2 0 346.540 4.279 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](CCCOc3ccc4ccccc4c3)CC[C@H]21 ZINC000483479434 1040871683 /nfs/dbraw/zinc/87/16/83/1040871683.db2.gz DWSGJCBCXCTQIF-IFMALSPDSA-N 2 0 338.495 4.025 20 0 EIADRP Cc1ccc2c(c1)CC[C@H]2[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000537938479 1040902816 /nfs/dbraw/zinc/90/28/16/1040902816.db2.gz BAICTLKMIXXNBH-HTAPYJJXSA-N 2 0 338.495 4.274 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1cncs1 ZINC000537941597 1040905710 /nfs/dbraw/zinc/90/57/10/1040905710.db2.gz XLEMBIUWVDPEBJ-BQFCYCMXSA-N 2 0 329.513 4.094 20 0 EIADRP COc1cc(C)cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000537952084 1040920087 /nfs/dbraw/zinc/92/00/87/1040920087.db2.gz PJKBCEQAMVFONV-AVRDEDQJSA-N 2 0 338.495 4.004 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000462787620 1040933000 /nfs/dbraw/zinc/93/30/00/1040933000.db2.gz BUVFNIPWUDFUJE-BVYCBKJFSA-N 2 0 344.543 4.213 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000462787623 1040933795 /nfs/dbraw/zinc/93/37/95/1040933795.db2.gz BUVFNIPWUDFUJE-YUXAGFNASA-N 2 0 344.543 4.213 20 0 EIADRP Cc1ccc(CC[C@@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)o1 ZINC000483654652 1040948746 /nfs/dbraw/zinc/94/87/46/1040948746.db2.gz OJXVVOZISDNUCT-SJLPKXTDSA-N 2 0 344.499 4.200 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1ccc(COc2ccccc2)cc1 ZINC000537988284 1040965347 /nfs/dbraw/zinc/96/53/47/1040965347.db2.gz WHISYYCMHTXXKA-KGVIQGDOSA-N 2 0 338.495 4.084 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000379740223 1040990088 /nfs/dbraw/zinc/99/00/88/1040990088.db2.gz HWPIKSPXGYGELJ-WIYYLYMNSA-N 2 0 326.459 4.389 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)C1 ZINC000538060501 1041032114 /nfs/dbraw/zinc/03/21/14/1041032114.db2.gz ZOMVNJIHEARLML-YVEFUNNKSA-N 2 0 327.299 4.376 20 0 EIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+][C@H]2CC[C@@H]2C2CC2)CC1 ZINC000554360895 1041036503 /nfs/dbraw/zinc/03/65/03/1041036503.db2.gz NOJUEJRABOUHFF-QUCCMNQESA-N 2 0 332.919 4.330 20 0 EIADRP CCO[C@@H]1C[C@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C12CCCC2 ZINC000483841134 1041038957 /nfs/dbraw/zinc/03/89/57/1041038957.db2.gz VWMCBVHQELTRHW-VQTJNVASSA-N 2 0 334.548 4.111 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1cc2c(cccc2F)[nH]1 ZINC000436270845 1041041874 /nfs/dbraw/zinc/04/18/74/1041041874.db2.gz BZLAJGWPPLYWJC-UHFFFAOYSA-N 2 0 339.458 4.437 20 0 EIADRP FC(F)(F)Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000629555054 1041045880 /nfs/dbraw/zinc/04/58/80/1041045880.db2.gz QLKASORGKGSIQK-RCCFBDPRSA-N 2 0 340.433 4.192 20 0 EIADRP Fc1cccc2[nH]c(C[NH2+]C3CC[NH+](CC4CCCC4)CC3)cc21 ZINC000436276070 1041049107 /nfs/dbraw/zinc/04/91/07/1041049107.db2.gz RJAIWBMNJGWRTB-UHFFFAOYSA-N 2 0 329.463 4.051 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)[C@H](C)C1 ZINC000436293356 1041059355 /nfs/dbraw/zinc/05/93/55/1041059355.db2.gz CWRYXMKBPIFSNM-UWIFEVILSA-N 2 0 340.433 4.271 20 0 EIADRP FC(F)(F)C1CCC([NH2+]C[C@H]2CCC[N@@H+]2C2CCCCC2)CC1 ZINC000436294414 1041061141 /nfs/dbraw/zinc/06/11/41/1041061141.db2.gz ORBPGJCXCTWBLN-VMBOVVBDSA-N 2 0 332.454 4.494 20 0 EIADRP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000480244553 1041102994 /nfs/dbraw/zinc/10/29/94/1041102994.db2.gz VMXBQDHDJWRSKK-ZHRRBRCNSA-N 2 0 338.470 4.445 20 0 EIADRP C[C@@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1ccc(OCC(F)(F)F)cc1 ZINC000538163080 1041106866 /nfs/dbraw/zinc/10/68/66/1041106866.db2.gz PVHRFOXCJHKESP-ZBFHGGJFSA-N 2 0 344.421 4.153 20 0 EIADRP C[C@@H]([NH2+][C@H](c1cccs1)C1CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000480230095 1041107246 /nfs/dbraw/zinc/10/72/46/1041107246.db2.gz QXYJGIAMXHNENU-QRWLVFNGSA-N 2 0 344.524 4.490 20 0 EIADRP CC[C@H]([NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1)c1ccc(Cl)s1 ZINC000540172345 1041217766 /nfs/dbraw/zinc/21/77/66/1041217766.db2.gz AHHVLYODOODIHU-KKUMJFAQSA-N 2 0 344.952 4.332 20 0 EIADRP C[C@H](CCCC(F)(F)F)[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000480332757 1041218679 /nfs/dbraw/zinc/21/86/79/1041218679.db2.gz VLTFOKWHZLJWNP-OAHLLOKOSA-N 2 0 328.422 4.493 20 0 EIADRP CC[NH+](CC)[C@@H]1CCN(c2cc(C)[nH+]c3ccc(OC(F)F)cc32)C1 ZINC000463011708 1041218939 /nfs/dbraw/zinc/21/89/39/1041218939.db2.gz OHPDQWORGNFBBG-CQSZACIVSA-N 2 0 349.425 4.065 20 0 EIADRP C[C@@H](CCCC(F)(F)F)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000480327964 1041226177 /nfs/dbraw/zinc/22/61/77/1041226177.db2.gz MXDPOYCKVXSNLF-HNNXBMFYSA-N 2 0 328.422 4.493 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1cccc(O)c1 ZINC000194851792 1041232474 /nfs/dbraw/zinc/23/24/74/1041232474.db2.gz LVOKZCABJBJRTG-GOSISDBHSA-N 2 0 338.495 4.475 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(-c3scnc3C)cc2)[C@H](C)C1 ZINC000667666259 1041240013 /nfs/dbraw/zinc/24/00/13/1041240013.db2.gz HJKDVEFSROVGCN-DNVCBOLYSA-N 2 0 343.540 4.281 20 0 EIADRP C[C@@H](NC1(C[NH2+][C@@H]2CCC23CCOCC3)CCCC1)c1ccccc1 ZINC000554559549 1041245569 /nfs/dbraw/zinc/24/55/69/1041245569.db2.gz DFEYIPKKNDJOLT-UYAOXDASSA-N 2 0 342.527 4.199 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000484470335 1041247754 /nfs/dbraw/zinc/24/77/54/1041247754.db2.gz RZTYJGSHOKXDLL-CWRNSKLLSA-N 2 0 344.421 4.151 20 0 EIADRP C[C@H]1C[C@H]([NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)C[C@@H](C)C1 ZINC000538297608 1041247813 /nfs/dbraw/zinc/24/78/13/1041247813.db2.gz WWTGKOCALYLKSG-DOADOZAASA-N 2 0 342.527 4.389 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)CC1 ZINC000538408323 1041324352 /nfs/dbraw/zinc/32/43/52/1041324352.db2.gz XUZLALRVQFYHCL-LJQANCHMSA-N 2 0 326.484 4.065 20 0 EIADRP C[NH+](C)CCCOc1ccc(C[NH2+]Cc2ccc(C3CC3)cc2)cc1 ZINC000480473066 1041327488 /nfs/dbraw/zinc/32/74/88/1041327488.db2.gz RIWQPKUGWZGUNJ-UHFFFAOYSA-N 2 0 338.495 4.184 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C(C)C)C1 ZINC000540261239 1041329730 /nfs/dbraw/zinc/32/97/30/1041329730.db2.gz XIANTHRQDXOUMZ-YOEHRIQHSA-N 2 0 328.422 4.334 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CCCOC2CCCCC2)CCN1Cc1ccccc1 ZINC000463140789 1041359136 /nfs/dbraw/zinc/35/91/36/1041359136.db2.gz IILQDPBXVWTRJA-TZIWHRDSSA-N 2 0 344.543 4.369 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000554738723 1041371206 /nfs/dbraw/zinc/37/12/06/1041371206.db2.gz YZJWUCFVBKEBSW-IBGZPJMESA-N 2 0 325.500 4.175 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CCc2cccc(F)c2)CCN1Cc1ccccc1 ZINC000463138086 1041372960 /nfs/dbraw/zinc/37/29/60/1041372960.db2.gz UNOZMODIRBJRIK-UWJYYQICSA-N 2 0 326.459 4.011 20 0 EIADRP COc1cc([C@H](C)[NH2+]CC[C@H]2CCC[N@@H+]2C)ccc1OC1CCCC1 ZINC000540352018 1041391606 /nfs/dbraw/zinc/39/16/06/1041391606.db2.gz KZDFSQHVDZVDHQ-FUHWJXTLSA-N 2 0 346.515 4.152 20 0 EIADRP CCc1nc(C)c([C@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC000480601801 1041412376 /nfs/dbraw/zinc/41/23/76/1041412376.db2.gz BOBDJYXHAHISHN-XHSDSOJGSA-N 2 0 337.577 4.423 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)c(OC)c1 ZINC000480608403 1041420637 /nfs/dbraw/zinc/42/06/37/1041420637.db2.gz KUTNPWBQVZABKY-DLBZAZTESA-N 2 0 334.504 4.009 20 0 EIADRP COc1cc(C)c([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1OC ZINC000480615274 1041425880 /nfs/dbraw/zinc/42/58/80/1041425880.db2.gz RJIVUKVWIWPNBP-ZWKOTPCHSA-N 2 0 348.531 4.317 20 0 EIADRP COc1ccc(OC)c([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)c1 ZINC000480617997 1041427507 /nfs/dbraw/zinc/42/75/07/1041427507.db2.gz VRBMIILHSPLWRZ-SJORKVTESA-N 2 0 334.504 4.009 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@@H+]2C)cc1OC ZINC000540377592 1041428510 /nfs/dbraw/zinc/42/85/10/1041428510.db2.gz QHYHLNPFPKZLNH-AEFFLSMTSA-N 2 0 334.504 4.009 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1cc(F)c(F)c(F)c1 ZINC000480630606 1041434277 /nfs/dbraw/zinc/43/42/77/1041434277.db2.gz KOSYQUUAICONBP-ZIAGYGMSSA-N 2 0 328.422 4.409 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccccc1OC(F)F ZINC000480618610 1041435748 /nfs/dbraw/zinc/43/57/48/1041435748.db2.gz TZBGZKUIYRRMAZ-CVEARBPZSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(F)cc1N(C)C ZINC000480634111 1041447025 /nfs/dbraw/zinc/44/70/25/1041447025.db2.gz ZMQNUJHQHXWMSA-DLBZAZTESA-N 2 0 335.511 4.054 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1Nc1ccc2c(c1)nc(C(C)(C)C)n2C ZINC000538627242 1041459231 /nfs/dbraw/zinc/45/92/31/1041459231.db2.gz CQXJSYYYIJEEAP-YCPHGPKFSA-N 2 0 328.504 4.011 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(OCC3CC3)cc2)C1 ZINC000480658367 1041459299 /nfs/dbraw/zinc/45/92/99/1041459299.db2.gz CLAIATDHOARKIM-SFHVURJKSA-N 2 0 330.516 4.077 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCCC[N@@H+]1C)c1ccc(OC(F)(F)F)cc1 ZINC000484879270 1041477947 /nfs/dbraw/zinc/47/79/47/1041477947.db2.gz DTGDTFRKOHCGLF-ZFWWWQNUSA-N 2 0 330.394 4.110 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)c(F)c1 ZINC000195135352 1041486272 /nfs/dbraw/zinc/48/62/72/1041486272.db2.gz VLLZXWUJLQVAST-DOTOQJQBSA-N 2 0 330.422 4.138 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc3cc(OC)ccc3c2)C[C@@H]1C ZINC000538718694 1041487910 /nfs/dbraw/zinc/48/79/10/1041487910.db2.gz IGLRUKDKEUFGHL-JXFKEZNVSA-N 2 0 326.484 4.153 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2c[nH]nc2C(C)(C)C)CC1 ZINC000538721709 1041493255 /nfs/dbraw/zinc/49/32/55/1041493255.db2.gz YWYFATFWPYQESG-KRWDZBQOSA-N 2 0 346.563 4.184 20 0 EIADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1 ZINC000480732577 1041496685 /nfs/dbraw/zinc/49/66/85/1041496685.db2.gz SOZSITHMHXIRFA-WJMWBRGCSA-N 2 0 336.564 4.213 20 0 EIADRP C[C@H]([NH2+]Cc1cc2c(s1)CC[NH2+]C2)c1csc2ccccc12 ZINC000904482307 1041502778 /nfs/dbraw/zinc/50/27/78/1041502778.db2.gz AESIBNCDVXROCD-LBPRGKRZSA-N 2 0 328.506 4.459 20 0 EIADRP CC[C@H](C[NH+]1CCC(OCC[NH+](CC)CC)CC1)c1ccccc1 ZINC000538763442 1041537232 /nfs/dbraw/zinc/53/72/32/1041537232.db2.gz DWNPXFQWJGAUHT-LJQANCHMSA-N 2 0 332.532 4.003 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000540607297 1041559395 /nfs/dbraw/zinc/55/93/95/1041559395.db2.gz MCPBMULMMGNOMV-YJBOKZPZSA-N 2 0 339.310 4.481 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](c1cc2ccccc2o1)C(C)C ZINC000540657008 1041589347 /nfs/dbraw/zinc/58/93/47/1041589347.db2.gz UNBGNBZZDLCVDO-FXAWDEMLSA-N 2 0 332.488 4.076 20 0 EIADRP Cc1cc([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc(C)c1F ZINC000539039146 1041616586 /nfs/dbraw/zinc/61/65/86/1041616586.db2.gz SMQKTWVVNAVUPY-KRWDZBQOSA-N 2 0 341.474 4.405 20 0 EIADRP Cc1ccncc1[C@H](C)[NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000539040716 1041616692 /nfs/dbraw/zinc/61/66/92/1041616692.db2.gz PLDSAIMJORKVFZ-SVFBPWRDSA-N 2 0 337.511 4.341 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]C1CCC([NH+]3CCC(C)CC3)CC1)CC2 ZINC000539040842 1041616865 /nfs/dbraw/zinc/61/68/65/1041616865.db2.gz SXOGWDXVDAAOBL-OBFZPWGMSA-N 2 0 342.527 4.315 20 0 EIADRP Cc1ccncc1[C@H](C)[NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000539040715 1041616925 /nfs/dbraw/zinc/61/69/25/1041616925.db2.gz PLDSAIMJORKVFZ-IRFCIJBXSA-N 2 0 337.511 4.341 20 0 EIADRP CCC[NH+]1CCC([NH2+]CC2(c3ccc(C(F)(F)F)cc3)CC2)CC1 ZINC000437082048 1041630552 /nfs/dbraw/zinc/63/05/52/1041630552.db2.gz ZCAQBCRIWXXUTQ-UHFFFAOYSA-N 2 0 340.433 4.201 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000491305592 1041789474 /nfs/dbraw/zinc/78/94/74/1041789474.db2.gz MNUKMGYFWFBNRI-ZWKOTPCHSA-N 2 0 341.543 4.434 20 0 EIADRP CC(C)(C)[C@@H]1CCC[NH+]1CC1(C[N@H+]2CCC[C@H]2C(C)(C)C)COC1 ZINC000541071931 1041797563 /nfs/dbraw/zinc/79/75/63/1041797563.db2.gz RDLDVISRDQIQPI-ROUUACIJSA-N 2 0 336.564 4.024 20 0 EIADRP C[C@H](C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cccc(Cl)c1 ZINC000470357613 1041821988 /nfs/dbraw/zinc/82/19/88/1041821988.db2.gz QJACVQWWCOTKKQ-MRXNPFEDSA-N 2 0 343.902 4.345 20 0 EIADRP Cc1ccc2c(c1)c(CC[NH3+])cn2C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167962161 1041846838 /nfs/dbraw/zinc/84/68/38/1041846838.db2.gz UIKOWRLXHUIMEU-YOFSQIOKSA-N 2 0 337.511 4.029 20 0 EIADRP CC[C@H](CCc1ccc(Br)cc1)[NH2+]C1CCC([NH3+])CC1 ZINC000437784057 1041899057 /nfs/dbraw/zinc/89/90/57/1041899057.db2.gz YBPYCBQVMMWOJD-AQFXKWCLSA-N 2 0 339.321 4.020 20 0 EIADRP C[C@@H]([NH2+]CCCCCOc1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000437784861 1041909104 /nfs/dbraw/zinc/90/91/04/1041909104.db2.gz KZZOXKLAYQHDDO-UXHICEINSA-N 2 0 344.543 4.478 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@H](C)C[NH+](C)C ZINC000425940904 1042017599 /nfs/dbraw/zinc/01/75/99/1042017599.db2.gz IMTSLCUOQVCUBP-STQMWFEESA-N 2 0 335.492 4.106 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000438087602 1042040676 /nfs/dbraw/zinc/04/06/76/1042040676.db2.gz LXNMXOLEXHIJNW-YYIAUSFCSA-N 2 0 334.470 4.455 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1)C[NH+](C)C ZINC000425945562 1042045275 /nfs/dbraw/zinc/04/52/75/1042045275.db2.gz RHVBOGOIZNXPCT-UKPHBRMFSA-N 2 0 328.422 4.129 20 0 EIADRP c1ccc(OCCCCC[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000438121445 1042061772 /nfs/dbraw/zinc/06/17/72/1042061772.db2.gz PKEDYNLRPXFFJI-UGKGYDQZSA-N 2 0 342.527 4.184 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1 ZINC000438178541 1042072259 /nfs/dbraw/zinc/07/22/59/1042072259.db2.gz OSJDILNUWKQMNW-IAGOWNOFSA-N 2 0 334.470 4.455 20 0 EIADRP C[C@H](C[NH2+][C@H]1CCCc2nc(-c3ccccc3F)sc21)C[NH+](C)C ZINC000425955488 1042079281 /nfs/dbraw/zinc/07/92/81/1042079281.db2.gz ZYPGDKRCFKQRHJ-CJNGLKHVSA-N 2 0 347.503 4.114 20 0 EIADRP C[C@@H](c1cccc(F)c1)[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464836215 1042181308 /nfs/dbraw/zinc/18/13/08/1042181308.db2.gz JNMBOWHEOLUMBR-PKOBYXMFSA-N 2 0 326.459 4.341 20 0 EIADRP C[C@H](c1cccc(F)c1)[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464836214 1042181703 /nfs/dbraw/zinc/18/17/03/1042181703.db2.gz JNMBOWHEOLUMBR-MJGOQNOKSA-N 2 0 326.459 4.341 20 0 EIADRP CC(C)[NH+]1CCC([NH2+]CC2(c3cccc(F)c3F)CCCC2)CC1 ZINC000426060818 1042241734 /nfs/dbraw/zinc/24/17/34/1042241734.db2.gz SCCLSJWCVVPONW-UHFFFAOYSA-N 2 0 336.470 4.239 20 0 EIADRP CC[NH+]1CCC(C[NH2+]Cc2c(Cl)ccc(Cl)c2Cl)CC1 ZINC000044517807 1042251586 /nfs/dbraw/zinc/25/15/86/1042251586.db2.gz YXOYNUMQOLCFDF-UHFFFAOYSA-N 2 0 335.706 4.468 20 0 EIADRP Clc1ccc2c(c1)[C@H]([N@@H+]1CC[C@@H]3[C@@H](CCCN3C3CC3)C1)CC2 ZINC000542212122 1042339206 /nfs/dbraw/zinc/33/92/06/1042339206.db2.gz FQGRZSJWVBXBRT-CWFSZBLJSA-N 2 0 330.903 4.276 20 0 EIADRP Cc1cc(Br)ccc1C[N@@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000506380286 1042367974 /nfs/dbraw/zinc/36/79/74/1042367974.db2.gz IWMBESOESXLUDS-UHFFFAOYSA-N 2 0 339.321 4.062 20 0 EIADRP CCN1CC[NH+](CCCC[NH2+][C@H](C)c2ccc(C(C)(C)C)cc2)CC1 ZINC000173319605 1042564097 /nfs/dbraw/zinc/56/40/97/1042564097.db2.gz OVVIVKUNAYHPEQ-LJQANCHMSA-N 2 0 345.575 4.052 20 0 EIADRP Fc1cccc(C[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)c1 ZINC000518791980 1042695961 /nfs/dbraw/zinc/69/59/61/1042695961.db2.gz OFLXWKWRHJODET-UHFFFAOYSA-N 2 0 346.877 4.481 20 0 EIADRP Fc1cc(Cl)cc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000309682201 1042818964 /nfs/dbraw/zinc/81/89/64/1042818964.db2.gz BESKXQBWUIXEOG-INIZCTEOSA-N 2 0 332.850 4.091 20 0 EIADRP CCc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000309707875 1042818976 /nfs/dbraw/zinc/81/89/76/1042818976.db2.gz IMPNKUCFLQEITC-AEFFLSMTSA-N 2 0 328.525 4.311 20 0 EIADRP Cc1ccccc1C1CC([NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000310925271 1042847931 /nfs/dbraw/zinc/84/79/31/1042847931.db2.gz RXZTWUCSTIKZMT-ITAUSPCMSA-N 2 0 334.507 4.353 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1OC ZINC000310985595 1042849485 /nfs/dbraw/zinc/84/94/85/1042849485.db2.gz GTHDBFODEHWHDM-FPOVZHCZSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]Cc1ccc(OCc2ccccc2)cc1 ZINC000311016330 1042850732 /nfs/dbraw/zinc/85/07/32/1042850732.db2.gz NADWJIPWPYTHFU-KGVIQGDOSA-N 2 0 338.495 4.084 20 0 EIADRP C[N@H+](C1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCc2cc(F)ccc2C1 ZINC001168448843 1042859943 /nfs/dbraw/zinc/85/99/43/1042859943.db2.gz QGSQIIBYUBMARV-JOCHJYFZSA-N 2 0 344.518 4.412 20 0 EIADRP CSc1ccc(C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000178590728 1042869712 /nfs/dbraw/zinc/86/97/12/1042869712.db2.gz UEJBLAIYYZMZQT-MRXNPFEDSA-N 2 0 344.524 4.200 20 0 EIADRP CC[C@H]1C[C@@H](C[NH+]2CCC(CC[N@H+](CC)CC3CC3)CC2)CCO1 ZINC000507774390 1042876099 /nfs/dbraw/zinc/87/60/99/1042876099.db2.gz KAIQIBJWPBKJSN-SFTDATJTSA-N 2 0 336.564 4.026 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc2c(c1)CCCO2 ZINC000152727238 1042954888 /nfs/dbraw/zinc/95/48/88/1042954888.db2.gz YDUZRFWOAHWUCM-OAQYLSRUSA-N 2 0 338.495 4.314 20 0 EIADRP CCOc1cccc2cc([C@@H](C)[NH2+][C@@H](C)C3CC[NH+](C)CC3)oc21 ZINC000161858248 1043050480 /nfs/dbraw/zinc/05/04/80/1043050480.db2.gz JXGFLDPLDOCLTP-LSDHHAIUSA-N 2 0 330.472 4.212 20 0 EIADRP CCOc1cccc2cc([C@H](C)[NH2+][C@H](C)C3CC[NH+](C)CC3)oc21 ZINC000161858670 1043051414 /nfs/dbraw/zinc/05/14/14/1043051414.db2.gz JXGFLDPLDOCLTP-CABCVRRESA-N 2 0 330.472 4.212 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H](C)Cc2ccccc2C(F)(F)F)CC1 ZINC000162297399 1043067804 /nfs/dbraw/zinc/06/78/04/1043067804.db2.gz TWNZERNJXGCDQE-CQSZACIVSA-N 2 0 328.422 4.100 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]C2CCN(c3ccc(N(C)C)cc3)CC2)[C@H](C)C1 ZINC000765955663 1043084505 /nfs/dbraw/zinc/08/45/05/1043084505.db2.gz AURCJEFOSLJJBE-LZJOCLMNSA-N 2 0 329.532 4.136 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]C2CCN(c3ccc(N(C)C)cc3)CC2)[C@H](C)C1 ZINC000765955659 1043086378 /nfs/dbraw/zinc/08/63/78/1043086378.db2.gz AURCJEFOSLJJBE-CBGDNZLLSA-N 2 0 329.532 4.136 20 0 EIADRP Cc1cncc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)c1 ZINC000184280801 1043087025 /nfs/dbraw/zinc/08/70/25/1043087025.db2.gz JZALDHCWWVLQOK-HKUYNNGSSA-N 2 0 337.511 4.473 20 0 EIADRP COc1cccc(C[NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168009154 1043091513 /nfs/dbraw/zinc/09/15/13/1043091513.db2.gz YWFYCMQZUMKAHG-RMFSNUHRSA-N 2 0 338.495 4.226 20 0 EIADRP CCO[C@@H]1C[C@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C12CCCCC2 ZINC000766187435 1043156663 /nfs/dbraw/zinc/15/66/63/1043156663.db2.gz MMJBVNQTENXNJV-VQTJNVASSA-N 2 0 334.548 4.111 20 0 EIADRP Cc1cnc([C@@H](C)NCc2ccccc2C[N@@H+]2CCCC[C@@H]2C)cn1 ZINC000427821007 1043214287 /nfs/dbraw/zinc/21/42/87/1043214287.db2.gz AVIGCRHPHMTYTR-ZWKOTPCHSA-N 2 0 338.499 4.010 20 0 EIADRP [NH3+]C1(C[NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CCCC1 ZINC000665247086 1043230998 /nfs/dbraw/zinc/23/09/98/1043230998.db2.gz VMUXGPNZTJSSIV-GOEBONIOSA-N 2 0 326.406 4.203 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(C(F)F)nc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000657969677 1043232910 /nfs/dbraw/zinc/23/29/10/1043232910.db2.gz SXQAHJCPXGNHDC-SQWLQELKSA-N 2 0 337.458 4.323 20 0 EIADRP Brc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+]3CCC[C@H]3C1)CCC2 ZINC000356682447 1043253036 /nfs/dbraw/zinc/25/30/36/1043253036.db2.gz SDWNQWRLVNSSAD-XYJFISCASA-N 2 0 349.316 4.043 20 0 EIADRP Cc1nccn1CCCC[N@@H+]1CCC[C@@H](c2ccc(F)c(F)c2)C1 ZINC000625658428 1043320662 /nfs/dbraw/zinc/32/06/62/1043320662.db2.gz YYTYHBFDNTXYLD-QGZVFWFLSA-N 2 0 333.426 4.130 20 0 EIADRP C[C@H]([NH2+][C@@H](c1ccccc1)c1cccc(F)c1)C1CC[NH+](C)CC1 ZINC000168565132 1043373355 /nfs/dbraw/zinc/37/33/55/1043373355.db2.gz KWTJSFICBRNXGZ-KKSFZXQISA-N 2 0 326.459 4.235 20 0 EIADRP C[C@H]([NH2+][C@H](c1ccccc1)c1cccc(F)c1)C1CC[NH+](C)CC1 ZINC000168565328 1043373621 /nfs/dbraw/zinc/37/36/21/1043373621.db2.gz KWTJSFICBRNXGZ-HRAATJIYSA-N 2 0 326.459 4.235 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2cccnc2c1 ZINC000674067645 1043386773 /nfs/dbraw/zinc/38/67/73/1043386773.db2.gz MRFXEFYUGRPDEB-GCJKJVERSA-N 2 0 345.490 4.235 20 0 EIADRP C[C@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccc(Oc2cccnc2)cc1 ZINC000672806878 1043406851 /nfs/dbraw/zinc/40/68/51/1043406851.db2.gz YYTCGYYMFVTPKK-IRXDYDNUSA-N 2 0 339.483 4.255 20 0 EIADRP CC[NH+](CC)CCCC[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168012056 1043422212 /nfs/dbraw/zinc/42/22/12/1043422212.db2.gz VIRBCXOXTHATHH-PMACEKPBSA-N 3 0 345.575 4.140 20 0 EIADRP C[C@H]1CC(n2ccc3cc(C[NH3+])cnc32)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168012450 1043423503 /nfs/dbraw/zinc/42/35/03/1043423503.db2.gz AKJUIMFAVGGERF-IRXDYDNUSA-N 2 0 348.494 4.109 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccnn1-c1ccccc1 ZINC000467364160 1043582587 /nfs/dbraw/zinc/58/25/87/1043582587.db2.gz JIHAYROLHMUBSG-RTBURBONSA-N 2 0 340.515 4.178 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CCc3cc(Cl)ccc32)cc1 ZINC000067501720 1043692466 /nfs/dbraw/zinc/69/24/66/1043692466.db2.gz SDMIVZLZKXRFET-FQEVSTJZSA-N 2 0 344.886 4.058 20 0 EIADRP CCC[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccsc1 ZINC000658069208 1043738777 /nfs/dbraw/zinc/73/87/77/1043738777.db2.gz CWAPFLLVVUFUCV-IBGZPJMESA-N 2 0 336.545 4.070 20 0 EIADRP COCCCCC[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000521477539 1043785670 /nfs/dbraw/zinc/78/56/70/1043785670.db2.gz RLFSCTLNDBHCCU-BHIFYINESA-N 2 0 344.543 4.084 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000442762942 1043825905 /nfs/dbraw/zinc/82/59/05/1043825905.db2.gz ALTCDVXYEGCYNG-KMFMINBZSA-N 2 0 328.422 4.271 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+]CCc2ccc(F)cc2Cl)cc1F ZINC000428263251 1043866002 /nfs/dbraw/zinc/86/60/02/1043866002.db2.gz BNXHZKLWLGLTGF-UHFFFAOYSA-N 2 0 338.829 4.012 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cs1 ZINC000658164607 1043935013 /nfs/dbraw/zinc/93/50/13/1043935013.db2.gz NYFZWSNHAJTQDX-MRXNPFEDSA-N 2 0 329.513 4.014 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000474040618 1044058551 /nfs/dbraw/zinc/05/85/51/1044058551.db2.gz UVQUMOCXRLITPC-OAQYLSRUSA-N 2 0 338.495 4.269 20 0 EIADRP Fc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](Cc3cccs3)CC1)CC2 ZINC000479391962 1044234274 /nfs/dbraw/zinc/23/42/74/1044234274.db2.gz NUDCGXOTVKJZBX-FQEVSTJZSA-N 2 0 344.499 4.376 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](COC)c2ccc(Cl)cc2)c1 ZINC000194027280 1044245212 /nfs/dbraw/zinc/24/52/12/1044245212.db2.gz FLSOMWIQRYKOFG-FQEVSTJZSA-N 2 0 346.902 4.269 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccncc1 ZINC000658319484 1044305639 /nfs/dbraw/zinc/30/56/39/1044305639.db2.gz CHDFHURGPJGCHJ-NQIIRXRSSA-N 2 0 335.495 4.035 20 0 EIADRP COCC[C@H]([NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1 ZINC000347930244 1044330010 /nfs/dbraw/zinc/33/00/10/1044330010.db2.gz KOMGPTOIUAIAAY-LMNJBCLMSA-N 2 0 330.516 4.007 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000675489078 1044358132 /nfs/dbraw/zinc/35/81/32/1044358132.db2.gz FTWITTOWMBUAKI-OALUTQOASA-N 2 0 325.500 4.222 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)C1CCC(F)(F)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000474079416 1044358357 /nfs/dbraw/zinc/35/83/57/1044358357.db2.gz IXISZHDEECMEMO-ZMSDIMECSA-N 2 0 328.491 4.443 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000348008057 1044361049 /nfs/dbraw/zinc/36/10/49/1044361049.db2.gz OESZMOOTNXPZQK-UZLBHIALSA-N 2 0 342.531 4.198 20 0 EIADRP CCC[C@@H](C[NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccccc1 ZINC000657535305 1044363705 /nfs/dbraw/zinc/36/37/05/1044363705.db2.gz JBWRSXFRTIYZSE-NRFANRHFSA-N 2 0 344.543 4.051 20 0 EIADRP C[C@@H]1C[C@@H](n2cnc3ccc(C[NH3+])cc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168020130 1044367789 /nfs/dbraw/zinc/36/77/89/1044367789.db2.gz KQOIHXPYFPWLHH-XEMDLRDOSA-N 2 0 348.494 4.109 20 0 EIADRP CC(C)CC[C@@H]1CC[C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C1 ZINC000657538348 1044381713 /nfs/dbraw/zinc/38/17/13/1044381713.db2.gz ZORLYHKDAKLIRF-QUCCMNQESA-N 2 0 336.564 4.072 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCCC[C@@H]2[C@H]2CCOC2)c1 ZINC000474085257 1044417059 /nfs/dbraw/zinc/41/70/59/1044417059.db2.gz WSHNGWGHGGVVFO-BHDDXSALSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@H]1CC([NH2+]CCCc2cccnc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168021953 1044462168 /nfs/dbraw/zinc/46/21/68/1044462168.db2.gz RNPFEWYOJVVLOG-OALUTQOASA-N 2 0 337.511 4.045 20 0 EIADRP CCC[C@H]([NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccccn1 ZINC000675817978 1044514906 /nfs/dbraw/zinc/51/49/06/1044514906.db2.gz ZHIYONBCPOHGQS-UWJYYQICSA-N 2 0 341.499 4.214 20 0 EIADRP C[C@H]([NH2+]CC1(Sc2ccccc2)CCCC1)C1CC[NH+](C)CC1 ZINC000675840108 1044525275 /nfs/dbraw/zinc/52/52/75/1044525275.db2.gz QTKYJTIMMFXHCL-KRWDZBQOSA-N 2 0 332.557 4.411 20 0 EIADRP CCC(CC)(C[NH2+][C@@H](C)C1CC[NH+](C)CC1)N[C@H](C)c1ccccc1 ZINC000675894940 1044543128 /nfs/dbraw/zinc/54/31/28/1044543128.db2.gz WFGUGAQOFCUOOK-RBUKOAKNSA-N 2 0 345.575 4.216 20 0 EIADRP CS[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C(C)(C)C ZINC000543411859 1044553621 /nfs/dbraw/zinc/55/36/21/1044553621.db2.gz BZWRZFFEHJLASS-NZSAHSFTSA-N 2 0 334.573 4.407 20 0 EIADRP C[C@H](CC[NH2+][C@H](C[C@H]1CCOC1)c1ccc(F)cc1)[NH+]1CCCCC1 ZINC000494976015 1044556908 /nfs/dbraw/zinc/55/69/08/1044556908.db2.gz OGVBHQSADHXCLF-DBXWQHBBSA-N 2 0 348.506 4.148 20 0 EIADRP C(=C/c1ccncc1)\C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000494995294 1044583910 /nfs/dbraw/zinc/58/39/10/1044583910.db2.gz MCYNXSLYNLJONX-QPJJXVBHSA-N 2 0 347.506 4.083 20 0 EIADRP C[C@@H]1CC([NH2+]CCOC2CCCCC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168024252 1044607285 /nfs/dbraw/zinc/60/72/85/1044607285.db2.gz CVCIEVNMCLJBMT-RTBURBONSA-N 2 0 344.543 4.367 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C[C@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000495072535 1044640267 /nfs/dbraw/zinc/64/02/67/1044640267.db2.gz SDANDMHRXUZNQI-WIYYLYMNSA-N 2 0 348.506 4.005 20 0 EIADRP Cc1ccccc1OCCC[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000543461465 1044651886 /nfs/dbraw/zinc/65/18/86/1044651886.db2.gz GYLWTVOGIWUTRG-RTBURBONSA-N 2 0 330.516 4.007 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@@H]2CCSc3c(F)cccc32)C1 ZINC000359943103 1044652216 /nfs/dbraw/zinc/65/22/16/1044652216.db2.gz PSPRUQWKDFYUCS-MAUKXSAKSA-N 2 0 336.520 4.464 20 0 EIADRP CC1([NH+]2CCCC2)CCC([NH2+]Cc2ncc(C(F)(F)F)s2)CC1 ZINC000922506435 1044790189 /nfs/dbraw/zinc/79/01/89/1044790189.db2.gz ZVFFXTCSMPGGNY-UHFFFAOYSA-N 2 0 347.450 4.049 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2ccc(C(F)(F)F)s2)CC1 ZINC000428891998 1044827197 /nfs/dbraw/zinc/82/71/97/1044827197.db2.gz ZZTWFBGIQZDYEN-UHFFFAOYSA-N 2 0 334.451 4.369 20 0 EIADRP FC(F)(F)c1ccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000676712968 1044827584 /nfs/dbraw/zinc/82/75/84/1044827584.db2.gz VLCNDTOISKYXAR-YJBOKZPZSA-N 2 0 338.417 4.154 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCCN(Cc2cccs2)C1)C(C)(C)C(F)F ZINC000657861472 1044833213 /nfs/dbraw/zinc/83/32/13/1044833213.db2.gz TVGCUDSIDLIMQX-KBPBESRZSA-N 2 0 330.488 4.230 20 0 EIADRP C[C@@H]1CC([NH2+]CC2CCSCC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168031863 1044841571 /nfs/dbraw/zinc/84/15/71/1044841571.db2.gz CUFIIVQLSNCDLW-IAGOWNOFSA-N 2 0 332.557 4.161 20 0 EIADRP CCC1(C[NH2+]C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CCOCC1 ZINC001168033991 1044907931 /nfs/dbraw/zinc/90/79/31/1044907931.db2.gz NWDXGNVTQIETQG-OALUTQOASA-N 2 0 344.543 4.224 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2cnc(-c3cccs3)s2)CC1 ZINC000922847178 1044994450 /nfs/dbraw/zinc/99/44/50/1044994450.db2.gz LDQKRFDPBABSGI-UHFFFAOYSA-N 2 0 347.553 4.368 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)CC1 ZINC000922844823 1044996721 /nfs/dbraw/zinc/99/67/21/1044996721.db2.gz HOOVMZDSJCTKMO-PPXMBRMGSA-N 2 0 327.516 4.104 20 0 EIADRP Fc1ccc(C2=CC[C@@H]([NH2+]C3CC[NH+](CC4CC4)CC3)CC2)cc1 ZINC000495395582 1045048302 /nfs/dbraw/zinc/04/83/02/1045048302.db2.gz GCTINNCFUQZNHB-HXUWFJFHSA-N 2 0 328.475 4.226 20 0 EIADRP COC1(C[C@@H](C)[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)CCC1 ZINC000429402539 1045084746 /nfs/dbraw/zinc/08/47/46/1045084746.db2.gz IZBZQAHCIDPFQL-HDAAZOAOSA-N 2 0 344.543 4.080 20 0 EIADRP c1ccc(CC[NH+]2CCC([NH2+]CCSc3ccccc3)CC2)cc1 ZINC000236739614 1045365329 /nfs/dbraw/zinc/36/53/29/1045365329.db2.gz DOZSRPXRGNDKEE-UHFFFAOYSA-N 2 0 340.536 4.075 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)CCc2ccc(OC(F)F)cc2)CC1 ZINC000236820686 1045367555 /nfs/dbraw/zinc/36/75/55/1045367555.db2.gz JHQXECXZIGDGLS-HNNXBMFYSA-N 2 0 340.458 4.072 20 0 EIADRP C[N@H+](CCC[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1)Cc1ccccc1 ZINC000237095012 1045374667 /nfs/dbraw/zinc/37/46/67/1045374667.db2.gz BUXAZRPSNGJMET-IAGOWNOFSA-N 2 0 328.422 4.219 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccsc1Br ZINC000388884138 1045477765 /nfs/dbraw/zinc/47/77/65/1045477765.db2.gz JTJIJVJEGNZKCV-GFCCVEGCSA-N 2 0 333.339 4.111 20 0 EIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]Cc2ccc(O)cc2)cc1 ZINC000237070196 1045552759 /nfs/dbraw/zinc/55/27/59/1045552759.db2.gz UOKVOIZGQGOEBP-UHFFFAOYSA-N 2 0 346.474 4.411 20 0 EIADRP Clc1csc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000397513866 1045598613 /nfs/dbraw/zinc/59/86/13/1045598613.db2.gz QFZNGGLCAAWCLY-UHFFFAOYSA-N 2 0 334.916 4.403 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767874482 1045667350 /nfs/dbraw/zinc/66/73/50/1045667350.db2.gz FUWBUTWZHJRUHT-FUHWJXTLSA-N 2 0 340.433 4.369 20 0 EIADRP CCc1nc(CN2CCC(C[NH2+]C[C@H](C)C(C)(C)C)CC2)cs1 ZINC000670267609 1045760214 /nfs/dbraw/zinc/76/02/14/1045760214.db2.gz LYRISBUEXCMNMW-HNNXBMFYSA-N 2 0 337.577 4.189 20 0 EIADRP CC(C)c1ncc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)s1 ZINC000768304476 1045783167 /nfs/dbraw/zinc/78/31/67/1045783167.db2.gz XIIRTIDJWDHOSL-UHFFFAOYSA-N 2 0 335.561 4.355 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3C[C@H](C)O[C@@H](C)C3)cc2)o1 ZINC000247004300 1045836489 /nfs/dbraw/zinc/83/64/89/1045836489.db2.gz KWLNYRNDEJJFQJ-BZSNNMDCSA-N 2 0 342.483 4.048 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1cncc(F)c1 ZINC000247057831 1045839852 /nfs/dbraw/zinc/83/98/52/1045839852.db2.gz NQYXKBRCQLZBMB-IAGOWNOFSA-N 2 0 341.474 4.303 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCC[C@@H]2CCCCO2)C3)cc1 ZINC000248887153 1045887215 /nfs/dbraw/zinc/88/72/15/1045887215.db2.gz MKPOAEWZMZTNDP-KJJMTIBFSA-N 2 0 342.527 4.121 20 0 EIADRP C[C@H](Cc1ccccc1Cl)[NH+]1CCC([NH3+])(c2ccccc2)CC1 ZINC001170264123 1045962343 /nfs/dbraw/zinc/96/23/43/1045962343.db2.gz UNMMERMNVOEYDX-MRXNPFEDSA-N 2 0 328.887 4.221 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc3c(c2)COC3)CC1 ZINC000769544473 1046016123 /nfs/dbraw/zinc/01/61/23/1046016123.db2.gz XGZDMEIYABLGKF-GOSISDBHSA-N 2 0 342.527 4.193 20 0 EIADRP C[C@@H]([NH3+])C1CC[NH+](CC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000261920545 1046164685 /nfs/dbraw/zinc/16/46/85/1046164685.db2.gz KKTYSGIQLDCLSC-OAHLLOKOSA-N 2 0 344.449 4.156 20 0 EIADRP C[NH2+]CC1CC[NH+](CC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000261959807 1046170557 /nfs/dbraw/zinc/17/05/57/1046170557.db2.gz PCVRRDSODLRBSG-UHFFFAOYSA-N 2 0 344.449 4.028 20 0 EIADRP Cc1cc(C)cc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c1 ZINC000162530082 1046326187 /nfs/dbraw/zinc/32/61/87/1046326187.db2.gz HKOWGRUKMLJKGU-SFHVURJKSA-N 2 0 326.484 4.095 20 0 EIADRP COCCC1(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CCCC1 ZINC000508699637 1046329183 /nfs/dbraw/zinc/32/91/83/1046329183.db2.gz OYYMIPPBIMEFEE-CTNGQTDRSA-N 2 0 344.543 4.084 20 0 EIADRP COc1cc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1C ZINC000508698033 1046329393 /nfs/dbraw/zinc/32/93/93/1046329393.db2.gz KSTQEXQRXZCKPL-RXVVDRJESA-N 2 0 338.495 4.004 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CCc3cc(Cl)ccc32)c1 ZINC000162588722 1046367653 /nfs/dbraw/zinc/36/76/53/1046367653.db2.gz RHCPNDSSZKGVDI-FQEVSTJZSA-N 2 0 344.886 4.058 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000126178839 1046451257 /nfs/dbraw/zinc/45/12/57/1046451257.db2.gz SDYHYUSIBZIAMY-ZDUSSCGKSA-N 2 0 346.462 4.333 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]CC2CC[NH+](C)CC2)cc1 ZINC000126229586 1046465301 /nfs/dbraw/zinc/46/53/01/1046465301.db2.gz JTZIJUSKPKPODS-KRWDZBQOSA-N 2 0 338.495 4.355 20 0 EIADRP c1ccc([C@@H]2CCCC[C@@H]2[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459402296 1046600888 /nfs/dbraw/zinc/60/08/88/1046600888.db2.gz YZENEIHCYXUUOT-VXKWHMMOSA-N 2 0 335.495 4.366 20 0 EIADRP Fc1ccc([C@@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)C2CCC2)cc1 ZINC000459396532 1046615165 /nfs/dbraw/zinc/61/51/65/1046615165.db2.gz FNZMTYHCNCBWIH-NRFANRHFSA-N 2 0 339.458 4.321 20 0 EIADRP CC(C)[C@@H](Cc1ccc(F)cc1)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459417493 1046644370 /nfs/dbraw/zinc/64/43/70/1046644370.db2.gz HPAYKBJELRXCIL-OAQYLSRUSA-N 2 0 341.474 4.046 20 0 EIADRP C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459434971 1046647379 /nfs/dbraw/zinc/64/73/79/1046647379.db2.gz VXFDHGLSCOKENP-BTYIYWSLSA-N 2 0 339.458 4.103 20 0 EIADRP CCC(CC)(CNC1CC[NH+](C2CC2)CC1)[NH2+][C@H](C)c1ccccc1 ZINC000459451212 1046681279 /nfs/dbraw/zinc/68/12/79/1046681279.db2.gz WYFFYGRJKUJCMV-GOSISDBHSA-N 2 0 343.559 4.112 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+][C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000379625309 1046713710 /nfs/dbraw/zinc/71/37/10/1046713710.db2.gz KPWJNFOUVJPFLV-OPYAIIAOSA-N 2 0 340.486 4.399 20 0 EIADRP c1ccc([C@H]2CCC[C@@H]2C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459558657 1046777774 /nfs/dbraw/zinc/77/77/74/1046777774.db2.gz AOLSMXBAXHNCLO-DENIHFKCSA-N 2 0 335.495 4.224 20 0 EIADRP Cc1c2ccccc2oc1[C@H](C)[NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000536860657 1046828623 /nfs/dbraw/zinc/82/86/23/1046828623.db2.gz ZWJDLMMTJZEWTK-JZXOWHBKSA-N 2 0 344.499 4.281 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3nc(Cl)ccc32)c1 ZINC000806134322 1047133043 /nfs/dbraw/zinc/13/30/43/1047133043.db2.gz JMDSWACYQSNAKM-GOSISDBHSA-N 2 0 343.902 4.352 20 0 EIADRP CC(C)[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(F)cn1 ZINC000497868101 1047140913 /nfs/dbraw/zinc/14/09/13/1047140913.db2.gz NCHZGTDXJKDSPA-QKLQHJQFSA-N 2 0 335.511 4.266 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCc3nc(Cl)ccc32)CC1 ZINC000806142687 1047168486 /nfs/dbraw/zinc/16/84/86/1047168486.db2.gz FUGMRMRKKGZJSG-QGZVFWFLSA-N 2 0 335.923 4.070 20 0 EIADRP C[NH+]1CCC2(CCC[N@@H+]2Cc2ccc(SC(F)F)cc2)CC1 ZINC000789559653 1047442669 /nfs/dbraw/zinc/44/26/69/1047442669.db2.gz SXPBLLLGJARCJL-UHFFFAOYSA-N 2 0 326.456 4.062 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1ccncc1F ZINC000556119578 1047472573 /nfs/dbraw/zinc/47/25/73/1047472573.db2.gz AMKZVECWNUIPEJ-ZIFCJYIRSA-N 2 0 341.474 4.172 20 0 EIADRP C[C@H]1CC[C@H]([NH+]2CCC([NH3+])(Cc3ccc(C(F)(F)F)cc3)CC2)C1 ZINC001170119752 1047473695 /nfs/dbraw/zinc/47/36/95/1047473695.db2.gz BYJRNGOHSCWNRB-YOEHRIQHSA-N 2 0 340.433 4.230 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)C[C@H](C)O1 ZINC000556155045 1047498390 /nfs/dbraw/zinc/49/83/90/1047498390.db2.gz QLBQZJBMKKFWHH-UGNRZPKXSA-N 2 0 330.516 4.107 20 0 EIADRP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000129803743 1047510365 /nfs/dbraw/zinc/51/03/65/1047510365.db2.gz OOAHYCYVKPMSAQ-HZSPNIEDSA-N 2 0 327.299 4.141 20 0 EIADRP C[C@H]1C[C@H]([NH2+]Cc2ccccc2C[NH+](C)C2CCCCC2)CC[N@@H+]1C ZINC000129862000 1047517164 /nfs/dbraw/zinc/51/71/64/1047517164.db2.gz RWYWXPRYSIXQFK-GHTZIAJQSA-N 3 0 343.559 4.023 20 0 EIADRP Cn1nccc1[C@@H]1CCC[C@H]([NH2+]CCCCCCC[NH+]2CCCC2)C1 ZINC000790486954 1047596085 /nfs/dbraw/zinc/59/60/85/1047596085.db2.gz RCVYVMVWZNNMAF-UXHICEINSA-N 2 0 346.563 4.082 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@H]2CCSC2)cc1C[NH+]1CCCCC1 ZINC000790494930 1047599601 /nfs/dbraw/zinc/59/96/01/1047599601.db2.gz HHQPFBAWSPKIGF-DLBZAZTESA-N 2 0 348.556 4.085 20 0 EIADRP Fc1ccc([C@@H]([NH2+]CCCCC[NH+]2CCCC2)c2ccccn2)cc1 ZINC000556234297 1047599982 /nfs/dbraw/zinc/59/99/82/1047599982.db2.gz WFSAURIJCRAMFX-OAQYLSRUSA-N 2 0 341.474 4.166 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)[C@@]1(C)CCCO1 ZINC000556235958 1047600231 /nfs/dbraw/zinc/60/02/31/1047600231.db2.gz KQPARIKCOFEPCD-LVCYWYKZSA-N 2 0 330.516 4.108 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1ccncc1F ZINC000556235736 1047601279 /nfs/dbraw/zinc/60/12/79/1047601279.db2.gz GTDFTCVXINKQGG-DLBZAZTESA-N 2 0 341.474 4.446 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]C[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000556238289 1047603608 /nfs/dbraw/zinc/60/36/08/1047603608.db2.gz IJXZORJHTHZLMA-OAVNBELGSA-N 2 0 341.326 4.415 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H](c2ccncc2)C2CC2)CC1 ZINC000898322388 1047615119 /nfs/dbraw/zinc/61/51/19/1047615119.db2.gz KJRQLUABEYKPRQ-HBGVWJBISA-N 2 0 327.516 4.165 20 0 EIADRP C[NH+](C)C1CCC([NH2+]CCOc2ccc(-c3ccccc3)cc2)CC1 ZINC001168298255 1047672848 /nfs/dbraw/zinc/67/28/48/1047672848.db2.gz ILCBJAMTJNVYKB-UHFFFAOYSA-N 2 0 338.495 4.195 20 0 EIADRP C[NH+](C)C1CCC([NH2+]C(C)(C)c2ccc(C(F)(F)F)cc2)CC1 ZINC001168297706 1047675680 /nfs/dbraw/zinc/67/56/80/1047675680.db2.gz GEAPLEXIVXQCHO-UHFFFAOYSA-N 2 0 328.422 4.403 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2cccc(C(F)(F)F)c2Cl)CC1 ZINC001168298212 1047678401 /nfs/dbraw/zinc/67/84/01/1047678401.db2.gz FQKQASXXBDMJRX-UHFFFAOYSA-N 2 0 334.813 4.321 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@]2(c3ccccc3Cl)CCCCC2=O)CC1 ZINC001168300323 1047712331 /nfs/dbraw/zinc/71/23/31/1047712331.db2.gz UJXSFQJNAZCFDL-ALLBUHFWSA-N 2 0 348.918 4.141 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1ccnc(Cl)c1 ZINC000154865925 1047719099 /nfs/dbraw/zinc/71/90/99/1047719099.db2.gz KQSBAGITBSRBSH-HNNXBMFYSA-N 2 0 331.891 4.426 20 0 EIADRP C[NH+](C)C1CCC([NH2+]CC2c3ccccc3CCc3ccccc32)CC1 ZINC001168303976 1047734405 /nfs/dbraw/zinc/73/44/05/1047734405.db2.gz IDOWRDCIURAXOS-UHFFFAOYSA-N 2 0 348.534 4.380 20 0 EIADRP C[NH+](C)C1CCC([NH2+]C(C)(C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC001168304983 1047756049 /nfs/dbraw/zinc/75/60/49/1047756049.db2.gz FDFSDXWLBDWNDO-UHFFFAOYSA-N 2 0 342.449 4.489 20 0 EIADRP Cc1cc(F)ccc1CC[NH2+][C@H]1CCN(C)[C@H](c2ccccc2)C1 ZINC000550680214 1047814067 /nfs/dbraw/zinc/81/40/67/1047814067.db2.gz JFRGNXJXGSXPGI-SFTDATJTSA-N 2 0 326.459 4.102 20 0 EIADRP Cc1ccccc1C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)C1CC1 ZINC000556584442 1047831869 /nfs/dbraw/zinc/83/18/69/1047831869.db2.gz UNMYLXFIKAEQJS-HSZRJFAPSA-N 2 0 349.522 4.217 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000131295204 1047860783 /nfs/dbraw/zinc/86/07/83/1047860783.db2.gz YUTBIOTUFKSOFJ-ZWKOTPCHSA-N 2 0 342.531 4.342 20 0 EIADRP CC1(C)[C@@H]2C[C@H]([NH+]3CCC([NH3+])(Cc4ccc(Cl)cc4)CC3)C[C@@H]21 ZINC001170736817 1047906249 /nfs/dbraw/zinc/90/62/49/1047906249.db2.gz CMUBIZWHXWZZDW-BCDXTJNWSA-N 2 0 332.919 4.110 20 0 EIADRP Cc1ccc2c(C[NH+]3C[C@H]4C[NH+](Cc5ccccc5)C[C@@H]4C3)c[nH]c2c1 ZINC001136974645 1048006383 /nfs/dbraw/zinc/00/63/83/1048006383.db2.gz HGKGXOOEZPEDRP-NHCUHLMSSA-N 2 0 345.490 4.040 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000556857800 1048067435 /nfs/dbraw/zinc/06/74/35/1048067435.db2.gz HMYRKBIAFRQBKG-DYVFJYSZSA-N 2 0 342.405 4.110 20 0 EIADRP Cc1cncc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000556884242 1048100925 /nfs/dbraw/zinc/10/09/25/1048100925.db2.gz HNESLWXSUKDJBL-XPWALMASSA-N 2 0 349.522 4.170 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)Cc2ccc(F)c(Cl)c2F)CC1 ZINC001143626390 1048134526 /nfs/dbraw/zinc/13/45/26/1048134526.db2.gz SZBXPIAYEZCBMO-UHFFFAOYSA-N 2 0 330.850 4.170 20 0 EIADRP C[N@H+](CC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170759203 1048135149 /nfs/dbraw/zinc/13/51/49/1048135149.db2.gz AFOLIYWRKALMJP-MZADTFQBSA-N 2 0 326.528 4.265 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCC2)[C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171109745 1048217812 /nfs/dbraw/zinc/21/78/12/1048217812.db2.gz MCSROUJQFMEFDG-MISYRCLQSA-N 2 0 332.919 4.322 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCC2)[C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171109744 1048219030 /nfs/dbraw/zinc/21/90/30/1048219030.db2.gz MCSROUJQFMEFDG-IHPCNDPISA-N 2 0 332.919 4.322 20 0 EIADRP Clc1ccc2c(c1)CC[C@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)C2 ZINC001171109596 1048219087 /nfs/dbraw/zinc/21/90/87/1048219087.db2.gz KODATQUUEZLYDJ-NRFANRHFSA-N 2 0 346.946 4.442 20 0 EIADRP CC(C)(C)C[NH+]1CCC([NH2+][C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171112248 1048235037 /nfs/dbraw/zinc/23/50/37/1048235037.db2.gz UMRUMTUWCPCEQZ-IBGZPJMESA-N 2 0 334.935 4.297 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171112482 1048236161 /nfs/dbraw/zinc/23/61/61/1048236161.db2.gz LMEZNVGDTGRZGV-VAMGGRTRSA-N 2 0 334.935 4.440 20 0 EIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cc(C)nc(Cl)c1 ZINC000809739184 1048511130 /nfs/dbraw/zinc/51/11/30/1048511130.db2.gz AHXNJBGCUNDDOQ-UHFFFAOYSA-N 2 0 331.891 4.127 20 0 EIADRP Cc1cc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc2cccnc12 ZINC000809738834 1048512191 /nfs/dbraw/zinc/51/21/91/1048512191.db2.gz MCDAUUYZJXRDKD-UHFFFAOYSA-N 2 0 333.479 4.237 20 0 EIADRP CC(C)Oc1ccccc1C[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000809738764 1048512792 /nfs/dbraw/zinc/51/27/92/1048512792.db2.gz IRMLGNXEMCXKGC-UHFFFAOYSA-N 2 0 326.484 4.167 20 0 EIADRP Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3cc[nH+]c(N4CCCCC4)c3)c2c1 ZINC001171166150 1048610335 /nfs/dbraw/zinc/61/03/35/1048610335.db2.gz BXXYTCSWNZRRJY-KRWDZBQOSA-N 2 0 348.494 4.214 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1c[nH]c2nc(Cl)ccc12 ZINC001144415866 1048651215 /nfs/dbraw/zinc/65/12/15/1048651215.db2.gz OQBDGSFXXMHGPJ-JKSUJKDBSA-N 2 0 346.906 4.055 20 0 EIADRP Cc1cc2cc(C[NH2+]CCCC[N@@H+]3C[C@@H](C)O[C@@H](C)C3)oc2cc1C ZINC000237609297 1048968917 /nfs/dbraw/zinc/96/89/17/1048968917.db2.gz ZBQHAZJUHAPWKJ-HDICACEKSA-N 2 0 344.499 4.029 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Cl)c(N)c(Cl)c1 ZINC000817585490 1049013132 /nfs/dbraw/zinc/01/31/32/1049013132.db2.gz FHCBMNXDXJPBOW-PKSQDBQZSA-N 2 0 330.303 4.099 20 0 EIADRP c1ccc([C@@H]2CC[C@H]([NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)C2)cc1 ZINC000817913943 1049058873 /nfs/dbraw/zinc/05/88/73/1049058873.db2.gz TWJKWCBTVKPCLY-SQVLJLFZSA-N 2 0 348.490 4.168 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)ccc1SC(F)F ZINC000817948347 1049064410 /nfs/dbraw/zinc/06/44/10/1049064410.db2.gz YISQGMPNGJVTSY-SGMGOOAPSA-N 2 0 344.471 4.049 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(CC[NH3+])cc2)c2ccccc12 ZINC000817948736 1049065139 /nfs/dbraw/zinc/06/51/39/1049065139.db2.gz KUGVNZLTIGIBAK-MRXNPFEDSA-N 2 0 334.463 4.200 20 0 EIADRP CC(C)COc1ccc([C@@H](C)[NH2+]Cc2ccc(CC[NH3+])cc2)cc1 ZINC000817946647 1049065301 /nfs/dbraw/zinc/06/53/01/1049065301.db2.gz CERNKIAHJRHIBE-QGZVFWFLSA-N 2 0 326.484 4.073 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000817981662 1049077891 /nfs/dbraw/zinc/07/78/91/1049077891.db2.gz MHHRQTKWSKLLQJ-KFNAQCHYSA-N 2 0 326.456 4.096 20 0 EIADRP Clc1cccc2c1C[C@@H]([NH2+]C1CC[NH+](C3CCCC3)CC1)CC2 ZINC001170907761 1049172195 /nfs/dbraw/zinc/17/21/95/1049172195.db2.gz LJNNHKRRSJNSNK-KRWDZBQOSA-N 2 0 332.919 4.194 20 0 EIADRP Clc1cccc2c1C[C@H]([NH2+]C1CC[NH+](C3CCCC3)CC1)CC2 ZINC001170907762 1049174756 /nfs/dbraw/zinc/17/47/56/1049174756.db2.gz LJNNHKRRSJNSNK-QGZVFWFLSA-N 2 0 332.919 4.194 20 0 EIADRP CC(C)C[NH+]1CCC(C[NH2+][C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170910655 1049182664 /nfs/dbraw/zinc/18/26/64/1049182664.db2.gz MDKXGKXIKJERLO-SFHVURJKSA-N 2 0 334.935 4.155 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]C[C@@H](O)c1cccc(Cl)c1 ZINC000818962350 1049215983 /nfs/dbraw/zinc/21/59/83/1049215983.db2.gz PENBANIVHAUBQA-HXUWFJFHSA-N 2 0 346.902 4.003 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+]([C@@H]1CCc3cccc(Cl)c3C1)CC2 ZINC001170944463 1049457132 /nfs/dbraw/zinc/45/71/32/1049457132.db2.gz PONVGJFXWQSJJI-QGZVFWFLSA-N 2 0 332.919 4.005 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@H]2CCc3cc(F)cc(F)c3C2)CC1 ZINC001170685411 1049566429 /nfs/dbraw/zinc/56/64/29/1049566429.db2.gz MHHDJKQCWLNUMR-OKZBNKHCSA-N 2 0 336.470 4.065 20 0 EIADRP C[C@@]12CC3([NH3+])CC([NH2+][C@@H]4CCc5c(F)cccc5C4)(C1)C[C@](C)(C3)C2 ZINC001171408165 1049637823 /nfs/dbraw/zinc/63/78/23/1049637823.db2.gz KQXUSCGIHSTTJC-JUXAHZPYSA-N 2 0 342.502 4.103 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@@H]2CCc3c(F)cccc3C2)CC1 ZINC001171413608 1049644114 /nfs/dbraw/zinc/64/41/14/1049644114.db2.gz HWOLOUXLANFNET-BHIYHBOVSA-N 2 0 330.491 4.198 20 0 EIADRP C[C@@]12CC3([NH3+])CC([NH2+][C@H]4CCc5cccc(F)c5C4)(C1)C[C@](C)(C3)C2 ZINC001170969444 1049671289 /nfs/dbraw/zinc/67/12/89/1049671289.db2.gz IHCKMZYVQTVJRR-DIFKXBQNSA-N 2 0 342.502 4.103 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1CCc2c(F)cccc2C1 ZINC001171439394 1049691695 /nfs/dbraw/zinc/69/16/95/1049691695.db2.gz YKEDZPQBCRVPBI-FHWLQOOXSA-N 2 0 330.491 4.022 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1OC ZINC000245419587 1049715373 /nfs/dbraw/zinc/71/53/73/1049715373.db2.gz BQCANOFDKOKIMO-DLBZAZTESA-N 2 0 334.504 4.009 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171472723 1049728338 /nfs/dbraw/zinc/72/83/38/1049728338.db2.gz QHJWBIUZTVOHLM-WDSOQIARSA-N 2 0 348.481 4.337 20 0 EIADRP Fc1cccc2c1C[C@@H]([NH2+]C1CC[NH+](C[C@H]3CC=CCC3)CC1)CC2 ZINC001170978748 1049736480 /nfs/dbraw/zinc/73/64/80/1049736480.db2.gz ZSNGQTJUJGMKNR-PXNSSMCTSA-N 2 0 342.502 4.093 20 0 EIADRP Fc1cccc2c1C[C@@H]([NH2+]C1CC[NH+](C[C@@H]3CC=CCC3)CC1)CC2 ZINC001170978749 1049737155 /nfs/dbraw/zinc/73/71/55/1049737155.db2.gz ZSNGQTJUJGMKNR-XLIONFOSSA-N 2 0 342.502 4.093 20 0 EIADRP Cc1cccc2c1CC[C@H]([NH+]1CCC3(CCC[N@@H+]3CC3CC3)CC1)C2 ZINC001171567392 1049758836 /nfs/dbraw/zinc/75/88/36/1049758836.db2.gz PRBKHBYUEUAVKZ-NRFANRHFSA-N 2 0 338.539 4.193 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CCc2cccc(C(F)(F)F)c2)CC1(C)C ZINC001171623095 1049768057 /nfs/dbraw/zinc/76/80/57/1049768057.db2.gz KFAFCMPYMFNSHM-UHFFFAOYSA-N 2 0 342.449 4.489 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CCc2ccc(F)cc2Cl)CC1(C)C ZINC001171625088 1049768296 /nfs/dbraw/zinc/76/82/96/1049768296.db2.gz BIPRTEKXABYLCR-UHFFFAOYSA-N 2 0 326.887 4.263 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CCc2cccc(Cl)c2F)CC1(C)C ZINC001171626791 1049769093 /nfs/dbraw/zinc/76/90/93/1049769093.db2.gz BHOGCFITAUYUAH-UHFFFAOYSA-N 2 0 326.887 4.263 20 0 EIADRP Cc1ccc(CC[C@H](C)[N@H+](C2CCOCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001171666488 1049772360 /nfs/dbraw/zinc/77/23/60/1049772360.db2.gz YBVCCKNMIKVGNG-JBACZVJFSA-N 2 0 344.543 4.067 20 0 EIADRP C[N@H+](CC[C@H]1CC1(Cl)Cl)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000822654605 1049781704 /nfs/dbraw/zinc/78/17/04/1049781704.db2.gz NTGAGONNOWMHJP-SJORKVTESA-N 2 0 341.326 4.024 20 0 EIADRP Cc1ccc2c(c1)c(CC[NH3+])cn2[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171727766 1049785260 /nfs/dbraw/zinc/78/52/60/1049785260.db2.gz XPSVBZMJBISYAB-RXVVDRJESA-N 2 0 347.506 4.286 20 0 EIADRP C[C@H]([NH3+])c1ccc2c(ccn2[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC001171726746 1049785683 /nfs/dbraw/zinc/78/56/83/1049785683.db2.gz HYUKEBSYGJXHJT-WWMYMODYSA-N 2 0 333.479 4.497 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCCC2)[C@@H]2Cc3cccc(F)c3C2)CC1 ZINC001171785435 1049803650 /nfs/dbraw/zinc/80/36/50/1049803650.db2.gz NIHHWFMPKBQFKI-VAMGGRTRSA-N 2 0 344.518 4.445 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC001171962434 1049825089 /nfs/dbraw/zinc/82/50/89/1049825089.db2.gz FBCBWOWXSOAKRI-MXWWQKGMSA-N 2 0 342.449 4.346 20 0 EIADRP CCC[NH+](CCC)CCN[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171964712 1049826286 /nfs/dbraw/zinc/82/62/86/1049826286.db2.gz HGELNKDAIZLUNH-NRFANRHFSA-N 2 0 345.575 4.141 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCC1CC[NH+](C)CC1 ZINC001171964988 1049826657 /nfs/dbraw/zinc/82/66/57/1049826657.db2.gz PJLDODMBABGDOK-OAHLLOKOSA-N 2 0 342.449 4.348 20 0 EIADRP CC1(C)C[C@@H](Nc2cccc(F)c2C[NH3+])CC[N@@H+]1Cc1ccccc1 ZINC001171967704 1049827937 /nfs/dbraw/zinc/82/79/37/1049827937.db2.gz MWUVPQVTWSFRPQ-KRWDZBQOSA-N 2 0 341.474 4.140 20 0 EIADRP C[C@@H](NC1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cncs1 ZINC000813881354 1049830898 /nfs/dbraw/zinc/83/08/98/1049830898.db2.gz OXOAUVKFXLQOGL-BPIHKTFHSA-N 2 0 341.524 4.379 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CCC2(O)CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001171969747 1049833819 /nfs/dbraw/zinc/83/38/19/1049833819.db2.gz WHPGEHBALYKVJW-FQEVSTJZSA-N 2 0 344.543 4.105 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CCCC(F)(F)F)CC[N@@H+]1Cc1ccccc1 ZINC001171974157 1049835539 /nfs/dbraw/zinc/83/55/39/1049835539.db2.gz CLRKUUYUIZJXLX-INIZCTEOSA-N 2 0 328.422 4.362 20 0 EIADRP CC1(C)C[C@@H](n2c(C[NH3+])cc3ccncc32)CC[N@@H+]1Cc1ccccc1 ZINC001171974576 1049836342 /nfs/dbraw/zinc/83/63/42/1049836342.db2.gz HSSYHOBXOXGMRZ-IBGZPJMESA-N 2 0 348.494 4.111 20 0 EIADRP CC1(C)C[C@H](C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CCO1 ZINC001171978673 1049838454 /nfs/dbraw/zinc/83/84/54/1049838454.db2.gz IJPMVEBTECYQFG-UXHICEINSA-N 2 0 344.543 4.224 20 0 EIADRP CC1(C)C[C@@H]([NH2+][C@@H]2CCCc3cnccc32)CC[N@@H+]1Cc1ccccc1 ZINC001171980485 1049838649 /nfs/dbraw/zinc/83/86/49/1049838649.db2.gz VNXRCFCSOBXWHF-RBBKRZOGSA-N 2 0 349.522 4.492 20 0 EIADRP CC(C)OC1CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171980398 1049838978 /nfs/dbraw/zinc/83/89/78/1049838978.db2.gz DZYYRLCIRDPVHH-HXUWFJFHSA-N 2 0 344.543 4.319 20 0 EIADRP Cc1cc2c(cn1)[C@@H]([NH2+][C@H]1CC[N@H+](Cc3ccccc3)C(C)(C)C1)CC2 ZINC001171980594 1049839059 /nfs/dbraw/zinc/83/90/59/1049839059.db2.gz RTFVZJFWPPLRQZ-UNMCSNQZSA-N 2 0 349.522 4.410 20 0 EIADRP CC1(C)C[C@H](N2CC[C@H]([NH3+])c3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC001171984473 1049839929 /nfs/dbraw/zinc/83/99/29/1049839929.db2.gz WBDLPIVSTRLZID-CTNGQTDRSA-N 2 0 349.522 4.340 20 0 EIADRP CCCO[C@H]1CC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172076486 1049845028 /nfs/dbraw/zinc/84/50/28/1049845028.db2.gz ZOQFPJVFVLRDEC-CBPXPLCBSA-N 2 0 342.527 4.073 20 0 EIADRP Oc1cccc(CN[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172063326 1049849755 /nfs/dbraw/zinc/84/97/55/1049849755.db2.gz YAQXKGLSUKHFPH-WKCHPHFGSA-N 2 0 336.479 4.068 20 0 EIADRP C[C@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccn1 ZINC001172062338 1049849902 /nfs/dbraw/zinc/84/99/02/1049849902.db2.gz NELUWNOIFSTXJW-WJMWBRGCSA-N 2 0 335.495 4.318 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]CCCc2cccnc2)C3)cc1 ZINC001172063741 1049850915 /nfs/dbraw/zinc/85/09/15/1049850915.db2.gz CWSBTIQIPJKTLN-WBDAEOGXSA-N 2 0 349.522 4.190 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](n1c3ccccc3nc1[C@H]1CCCC[NH2+]1)C2 ZINC001172127733 1049852500 /nfs/dbraw/zinc/85/25/00/1049852500.db2.gz LFFHMQPUOPSZTD-VUHPKUFZSA-N 2 0 338.499 4.039 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](n1c3ccccc3nc1[C@@H]1CCCC[NH2+]1)C2 ZINC001172127729 1049852943 /nfs/dbraw/zinc/85/29/43/1049852943.db2.gz LFFHMQPUOPSZTD-FAJBIJEISA-N 2 0 338.499 4.039 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCCOC2CCCC2)C3)cc1 ZINC000245778289 1049854544 /nfs/dbraw/zinc/85/45/44/1049854544.db2.gz YLGQGXSELFQXNX-MZADTFQBSA-N 2 0 342.527 4.121 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)C2 ZINC001172102628 1049855558 /nfs/dbraw/zinc/85/55/58/1049855558.db2.gz NRERYFLMFYSSFN-BTTYYORXSA-N 2 0 346.824 4.464 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)C2 ZINC001172102629 1049856058 /nfs/dbraw/zinc/85/60/58/1049856058.db2.gz NRERYFLMFYSSFN-ZSOGYDGISA-N 2 0 346.824 4.464 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2C)c1ccccc1C(F)(F)F ZINC001172109209 1049856845 /nfs/dbraw/zinc/85/68/45/1049856845.db2.gz IFDAJTRZXYREGR-XQLPTFJDSA-N 2 0 326.406 4.371 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)N2C)c1ccc(OC(F)(F)F)cc1 ZINC001172109703 1049857233 /nfs/dbraw/zinc/85/72/33/1049857233.db2.gz KCNMBNHREVBOBU-DMRZNYOFSA-N 2 0 342.405 4.251 20 0 EIADRP Cc1ccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1C(F)(F)F ZINC001172106007 1049857506 /nfs/dbraw/zinc/85/75/06/1049857506.db2.gz MDTDWHUTXURRPI-MUJYYYPQSA-N 2 0 326.406 4.119 20 0 EIADRP Cc1c(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cccc1C(F)(F)F ZINC001172106225 1049857697 /nfs/dbraw/zinc/85/76/97/1049857697.db2.gz NREYQCFCLXXIJD-MUJYYYPQSA-N 2 0 326.406 4.119 20 0 EIADRP CC(C)(C)[PH+](CCC[NH2+][C@H]1CCN2C(=O)CC[C@H]2C1)C(C)(C)C ZINC001172176190 1049863712 /nfs/dbraw/zinc/86/37/12/1049863712.db2.gz UHPDFYPUZUDUPX-HOTGVXAUSA-N 2 0 340.492 4.198 20 0 EIADRP CC(C)(C)C[NH+]1CCC(C[NH2+][C@H]2CSc3ccccc3C2)CC1 ZINC001172198708 1049869626 /nfs/dbraw/zinc/86/96/26/1049869626.db2.gz SALTWKQXNCZUHJ-GOSISDBHSA-N 2 0 332.557 4.051 20 0 EIADRP CC(C)(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CSc2ccccc2C1 ZINC001172199243 1049869836 /nfs/dbraw/zinc/86/98/36/1049869836.db2.gz UEWMTECKUXQVBA-BZSNNMDCSA-N 2 0 332.557 4.321 20 0 EIADRP C[C@H](CCc1ccc(Br)cc1)[NH2+]CC1([NH3+])CCCCC1 ZINC001246278504 1049875416 /nfs/dbraw/zinc/87/54/16/1049875416.db2.gz IGBHAQCDZLWVIX-CQSZACIVSA-N 2 0 339.321 4.021 20 0 EIADRP C[C@@H]1CC[C@H]([NH+]2CCC3(CC[N@H+](Cc4cccnc4)C3)CC2)C[C@@H]1C ZINC001172381011 1049886217 /nfs/dbraw/zinc/88/62/17/1049886217.db2.gz ZSPZFTBVVNIWFL-DYXWJJEUSA-N 2 0 341.543 4.194 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[NH+]1CCC(CC2CC[NH+](CC)CC2)CC1 ZINC001172347298 1049890051 /nfs/dbraw/zinc/89/00/51/1049890051.db2.gz LZDUTGQYFFCSLE-OALUTQOASA-N 2 0 338.580 4.414 20 0 EIADRP CC[C@H](C)OCC[C@@H](C)[NH+]1CCC(CC2CC[NH+](CC)CC2)CC1 ZINC001172347297 1049890500 /nfs/dbraw/zinc/89/05/00/1049890500.db2.gz LZDUTGQYFFCSLE-MOPGFXCFSA-N 2 0 338.580 4.414 20 0 EIADRP CC[C@@H](C)OCC[C@@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1C ZINC001172353462 1049893375 /nfs/dbraw/zinc/89/33/75/1049893375.db2.gz XAHPKWRBVBHRPK-VMBXEPDQSA-N 2 0 346.559 4.328 20 0 EIADRP CC[NH+]1CCC(CC2CC[NH+]([C@@H](C)CCOCC(C)C)CC2)CC1 ZINC001172485272 1049911445 /nfs/dbraw/zinc/91/14/45/1049911445.db2.gz VOHWMXGSDRRQIQ-IBGZPJMESA-N 2 0 338.580 4.272 20 0 EIADRP [NH3+][C@H]1CC[N@H+](Cc2ccc3ccc(-c4ccccc4)nc3c2)CC[C@H]1F ZINC001206164551 1049918248 /nfs/dbraw/zinc/91/82/48/1049918248.db2.gz KJNRYCBRSYEWMW-UXHICEINSA-N 2 0 349.453 4.163 20 0 EIADRP CC(C)COCC[C@@H](C)[NH2+]CC1CC[NH+](CC2CCCCC2)CC1 ZINC001172467558 1049919998 /nfs/dbraw/zinc/91/99/98/1049919998.db2.gz LKVVNHFXXCBKON-LJQANCHMSA-N 2 0 338.580 4.320 20 0 EIADRP CCCCCC[C@@H](CCCC)[NH2+]CCN1CC[NH+](C(C)C)CC1 ZINC001172516706 1049927859 /nfs/dbraw/zinc/92/78/59/1049927859.db2.gz LCWKPDWTJDWGAY-HXUWFJFHSA-N 2 0 325.585 4.131 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@@H]1CCC[N@H+](C)CC1 ZINC001172576991 1049931187 /nfs/dbraw/zinc/93/11/87/1049931187.db2.gz QLAKXGGTKDLWKQ-GXTWGEPZSA-N 2 0 330.850 4.013 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@H]1CC[C@@H]([NH+](C)C)CC1 ZINC001172570632 1049939835 /nfs/dbraw/zinc/93/98/35/1049939835.db2.gz HHNQRBFTWKGRRX-AEGPPILISA-N 2 0 344.877 4.402 20 0 EIADRP [NH3+]C1(Cc2cccnc2)CC[NH+]([C@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172541830 1049944411 /nfs/dbraw/zinc/94/44/11/1049944411.db2.gz BXDWOHJGLASCHU-YADHBBJMSA-N 2 0 349.522 4.144 20 0 EIADRP COc1cccc(C2([NH3+])CC[NH+](C3CCC4(CCCC4)CC3)CC2)c1 ZINC001172728374 1049968171 /nfs/dbraw/zinc/96/81/71/1049968171.db2.gz HXZJNDRFOHQRRF-UHFFFAOYSA-N 2 0 342.527 4.448 20 0 EIADRP CC[N@H+]([C@H]1CCOC1)C1CC[NH+](C2CCC3(CCCC3)CC2)CC1 ZINC001172729938 1049968963 /nfs/dbraw/zinc/96/89/63/1049968963.db2.gz OHGNATILXHKHMS-FQEVSTJZSA-N 2 0 334.548 4.065 20 0 EIADRP C[C@@]12CC3([NH3+])CC([NH2+][C@@H]4Cc5ccc(Cl)cc5C4)(C1)C[C@](C)(C3)C2 ZINC001172714805 1049972734 /nfs/dbraw/zinc/97/27/34/1049972734.db2.gz DBQXWOLFTDYOCZ-WPOXQQAKSA-N 2 0 344.930 4.227 20 0 EIADRP Cc1cc(C)c([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)cc1C ZINC000246510443 1049981522 /nfs/dbraw/zinc/98/15/22/1049981522.db2.gz TZKVRCFXXPVOHI-YUXAGFNASA-N 2 0 344.543 4.030 20 0 EIADRP CC[C@@H]1C[C@H](C)CC[C@H]1[NH2+]C1CCN([C@H](C)c2ccncc2)CC1 ZINC000246547253 1049984856 /nfs/dbraw/zinc/98/48/56/1049984856.db2.gz WHFRBBYBBHCZOH-NEYJZJCJSA-N 2 0 329.532 4.411 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)[C@H](C)c2nc3ccccc3s2)C1 ZINC000246968517 1050007393 /nfs/dbraw/zinc/00/73/93/1050007393.db2.gz JGIVLSNKGKSIEI-ULQDDVLXSA-N 2 0 345.556 4.498 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1cncc(F)c1 ZINC000246959030 1050008142 /nfs/dbraw/zinc/00/81/42/1050008142.db2.gz ILVWQLCTZKDODH-DLBZAZTESA-N 2 0 341.474 4.446 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cc(C)sc2C)[C@H](C)C1 ZINC000247087700 1050012943 /nfs/dbraw/zinc/01/29/43/1050012943.db2.gz PEQLWUNCNZJPFO-OGWOLHLISA-N 2 0 338.561 4.153 20 0 EIADRP Cc1c([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cnn1C(C)(C)C ZINC000248713472 1050074336 /nfs/dbraw/zinc/07/43/36/1050074336.db2.gz QVAHCMPZCNMFOT-IAGOWNOFSA-N 2 0 334.552 4.252 20 0 EIADRP c1sc(C2CCCC2)nc1C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000649417951 1050090620 /nfs/dbraw/zinc/09/06/20/1050090620.db2.gz PUPUEPUSLWEQRX-SJORKVTESA-N 2 0 333.545 4.012 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1cccc(O)c1 ZINC000249380537 1050097205 /nfs/dbraw/zinc/09/72/05/1050097205.db2.gz BECWMRSHCLBGMU-QZTJIDSGSA-N 2 0 338.495 4.475 20 0 EIADRP CCO[C@H]1CCC[C@H]([NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)C1 ZINC001177180993 1050164843 /nfs/dbraw/zinc/16/48/43/1050164843.db2.gz SEPCJBOWFMRBKK-VXKWHMMOSA-N 2 0 344.543 4.356 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([NH2+][C@H]1CCN(Cc3ccccc3)C[C@@H]1C)CC2 ZINC001172837772 1050173035 /nfs/dbraw/zinc/17/30/35/1050173035.db2.gz MWUAHBKSJWLZRK-IEXUWNMDSA-N 2 0 348.534 4.353 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([NH2+]C1CC[NH+](C[C@@H]3CC=CCC3)CC1)CC2 ZINC001172840133 1050180302 /nfs/dbraw/zinc/18/03/02/1050180302.db2.gz ZRTDEOJAJVJMON-AUSIDOKSSA-N 2 0 338.539 4.263 20 0 EIADRP CC(C)C[NH+]1CCC(C[NH2+][C@H](C)Cc2c(F)cccc2Cl)CC1 ZINC001172844708 1050184455 /nfs/dbraw/zinc/18/44/55/1050184455.db2.gz DKFCXTLYXYBQNS-OAHLLOKOSA-N 2 0 340.914 4.368 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)[C@H](C)Cc2c(F)cccc2Cl)CC1 ZINC001172851563 1050190028 /nfs/dbraw/zinc/19/00/28/1050190028.db2.gz APWSMVTYBKLFAF-OAHLLOKOSA-N 2 0 340.914 4.462 20 0 EIADRP C[C@@H](C[NH2+]Cc1ccc(-c2cccc(F)c2)s1)C[NH+]1CCCC1 ZINC001177328103 1050192688 /nfs/dbraw/zinc/19/26/88/1050192688.db2.gz HNJRYTCAJGFLME-HNNXBMFYSA-N 2 0 332.488 4.376 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[NH2+]C[C@@H](C)CC(C)(C)CC[NH3+] ZINC001172861383 1050197968 /nfs/dbraw/zinc/19/79/68/1050197968.db2.gz QSKGALJWIZZNAB-UONOGXRCSA-N 2 0 328.903 4.401 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC001172861597 1050198873 /nfs/dbraw/zinc/19/88/73/1050198873.db2.gz UOTHHCFQKUMJCN-AWEZNQCLSA-N 2 0 347.865 4.064 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[N@@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001172860344 1050199257 /nfs/dbraw/zinc/19/92/57/1050199257.db2.gz CMWHILMRNJKCCY-HUUCEWRRSA-N 2 0 326.887 4.251 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC001172883861 1050224712 /nfs/dbraw/zinc/22/47/12/1050224712.db2.gz UYMZMBSYVAXANW-CQSZACIVSA-N 2 0 338.948 4.427 20 0 EIADRP CO[C@@H]1CCC[C@H]([N@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172928124 1050238881 /nfs/dbraw/zinc/23/88/81/1050238881.db2.gz IXZRQQUZHITUAG-XSDIEEQYSA-N 2 0 330.516 4.025 20 0 EIADRP CO[C@H]1CCC[C@H]([N@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172927987 1050239058 /nfs/dbraw/zinc/23/90/58/1050239058.db2.gz IETBPSYETATTOD-TUFLPTIASA-N 2 0 330.516 4.025 20 0 EIADRP C[NH+](C)CCCCCCC[NH2+]Cc1ccc(F)cc1C(F)(F)F ZINC001177537556 1050246568 /nfs/dbraw/zinc/24/65/68/1050246568.db2.gz SVPTVMMDBJMCAQ-UHFFFAOYSA-N 2 0 334.401 4.446 20 0 EIADRP CCCC[N@@H+]1CCCC[C@H]1CNC1CC[NH+](C2CCCCC2)CC1 ZINC001177744126 1050291971 /nfs/dbraw/zinc/29/19/71/1050291971.db2.gz RSXMYEQMKFCAPP-NRFANRHFSA-N 2 0 335.580 4.028 20 0 EIADRP CCC[NH+]1CCC(C[NH2+]Cc2cc(Br)c(C)s2)CC1 ZINC001177737845 1050292261 /nfs/dbraw/zinc/29/22/61/1050292261.db2.gz VVSMKNPTUMRZAZ-UHFFFAOYSA-N 2 0 345.350 4.031 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCSCc2ccc(F)cc2)CC1 ZINC001173101168 1050301422 /nfs/dbraw/zinc/30/14/22/1050301422.db2.gz DSXZWCBQHTYRGZ-UHFFFAOYSA-N 2 0 338.536 4.302 20 0 EIADRP CC[NH+](CC)C1CCC(n2cc(CC[NH3+])c3cc(F)ccc32)CC1 ZINC001173101085 1050302436 /nfs/dbraw/zinc/30/24/36/1050302436.db2.gz CQXSGSKDYGKYQK-UHFFFAOYSA-N 2 0 331.479 4.107 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2cccc(Br)c2)CC1 ZINC001173101103 1050303456 /nfs/dbraw/zinc/30/34/56/1050303456.db2.gz CTGMNXCEZPFDOY-UHFFFAOYSA-N 2 0 339.321 4.192 20 0 EIADRP CC[NH+](CC)C1CCC(n2c(C)c(CC[NH3+])c3ccccc32)CC1 ZINC001173104575 1050304722 /nfs/dbraw/zinc/30/47/22/1050304722.db2.gz IRYOEMRIYOATGH-UHFFFAOYSA-N 2 0 327.516 4.276 20 0 EIADRP CCC(CC)[NH+]1CCC(C[NH2+]C2CCC([NH+](CC)CC)CC2)CC1 ZINC001173107317 1050307094 /nfs/dbraw/zinc/30/70/94/1050307094.db2.gz OQBVOJBXKHZNNO-UHFFFAOYSA-N 3 0 337.596 4.130 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccccc2C(F)(F)F)CC1 ZINC001173106259 1050307708 /nfs/dbraw/zinc/30/77/08/1050307708.db2.gz RWBLLXDWHNCVKD-UHFFFAOYSA-N 2 0 328.422 4.448 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2(Cc3ccccc3)CCOCC2)CC1 ZINC001173109864 1050308411 /nfs/dbraw/zinc/30/84/11/1050308411.db2.gz JITKOSCYPHECJU-UHFFFAOYSA-N 2 0 344.543 4.021 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@H](C)CC2CCCCC2)[C@@H](C)C1 ZINC001177843946 1050312010 /nfs/dbraw/zinc/31/20/10/1050312010.db2.gz ICRPCABPNQPXQC-DYXWJJEUSA-N 2 0 338.580 4.320 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCN([C@@H](C)c3ccccc3)CC2)CC1 ZINC001173115222 1050312342 /nfs/dbraw/zinc/31/23/42/1050312342.db2.gz ZMGHJEOVQYKFJH-KPQWGBOZSA-N 2 0 343.559 4.018 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@@H](C)CC2CCCCC2)[C@H](C)C1 ZINC001177843949 1050313485 /nfs/dbraw/zinc/31/34/85/1050313485.db2.gz ICRPCABPNQPXQC-ZVDOUQERSA-N 2 0 338.580 4.320 20 0 EIADRP CC[NH+](CC)CCCN1CC[NH+](C2CCC3(CCCCC3)CC2)CC1 ZINC001173119725 1050317259 /nfs/dbraw/zinc/31/72/59/1050317259.db2.gz WQZKVODXPMIQQU-UHFFFAOYSA-N 2 0 349.607 4.229 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCCC2)[C@H]2CCc3ncsc3C2)CC1 ZINC001173125806 1050318879 /nfs/dbraw/zinc/31/88/79/1050318879.db2.gz HZYZFERAWHBGOJ-BZSNNMDCSA-N 2 0 347.572 4.153 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+][C@@H]3CCO[C@@H](C)C3)[C@H](C)C2)CC[C@H]1[NH3+] ZINC001173170156 1050347859 /nfs/dbraw/zinc/34/78/59/1050347859.db2.gz LYMXSDHTMGCEQE-FQOJGSFKSA-N 2 0 336.564 4.102 20 0 EIADRP CCCC[C@@H](CC(C)C)[NH2+]C1(C(=O)OC(C)(C)C)CCC([NH3+])CC1 ZINC001173249296 1050377005 /nfs/dbraw/zinc/37/70/05/1050377005.db2.gz IPIZXCMBQSVAFY-GNZRSQJKSA-N 2 0 340.552 4.163 20 0 EIADRP CCCC[C@H](CC(C)C)[NH2+]CC1CC[NH+](CC2CCOCC2)CC1 ZINC001173253921 1050379671 /nfs/dbraw/zinc/37/96/71/1050379671.db2.gz SHMRRVRUCVZFBN-OAQYLSRUSA-N 2 0 338.580 4.320 20 0 EIADRP CCSC[C@@H](C)[N@H+]1C[C@H]2c3ccccc3[C@H]([NH+](C)C(C)C)[C@H]2C1 ZINC001173306100 1050404486 /nfs/dbraw/zinc/40/44/86/1050404486.db2.gz LLOWNZHHAGHMCY-TTYHFUOFSA-N 2 0 332.557 4.239 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(Cl)nc2)CC1)CC(C)C ZINC000773731776 1050415723 /nfs/dbraw/zinc/41/57/23/1050415723.db2.gz CLVVFGYPFKESAJ-UHFFFAOYSA-N 2 0 337.939 4.315 20 0 EIADRP C(C1CCOCC1)[NH+]1CCC([NH2+][C@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173344449 1050434943 /nfs/dbraw/zinc/43/49/43/1050434943.db2.gz MKXUNBZOMWGTRW-NRFANRHFSA-N 2 0 348.575 4.360 20 0 EIADRP C(C1CCOCC1)[NH+]1CCC([NH2+][C@@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173344453 1050435106 /nfs/dbraw/zinc/43/51/06/1050435106.db2.gz MKXUNBZOMWGTRW-OAQYLSRUSA-N 2 0 348.575 4.360 20 0 EIADRP CSCc1ccc(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC001178458101 1050474969 /nfs/dbraw/zinc/47/49/69/1050474969.db2.gz PTDPNSDNBIBCTM-APWZRJJASA-N 2 0 332.557 4.292 20 0 EIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)cc1 ZINC000092856910 1050481458 /nfs/dbraw/zinc/48/14/58/1050481458.db2.gz HMQBJUGQARBWOP-HNNXBMFYSA-N 2 0 329.875 4.302 20 0 EIADRP C[N@@H+]1CCCC[C@H]1C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C ZINC001178701277 1050533921 /nfs/dbraw/zinc/53/39/21/1050533921.db2.gz HOZCDCFYTDHOSK-HNNXBMFYSA-N 2 0 328.481 4.056 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CCCCC23CCCC3)cc1 ZINC001178823603 1050565745 /nfs/dbraw/zinc/56/57/45/1050565745.db2.gz HXRDLAGVVOPBCA-FQEVSTJZSA-N 2 0 330.516 4.220 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCCCC23CCCC3)cc1 ZINC001178823604 1050565759 /nfs/dbraw/zinc/56/57/59/1050565759.db2.gz HXRDLAGVVOPBCA-HXUWFJFHSA-N 2 0 330.516 4.220 20 0 EIADRP CCCCCCOc1cccc(C[NH2+][C@@H]2CC[C@H]3C[N@H+](C)C[C@@H]32)c1 ZINC001179816797 1050786008 /nfs/dbraw/zinc/78/60/08/1050786008.db2.gz NTXGFHPXNHPHEP-SESVDKBCSA-N 2 0 330.516 4.076 20 0 EIADRP CC[NH+](CC)CC[C@@H](C)[NH2+]Cc1cc(C)c(OC(F)F)c(C)c1 ZINC001179824819 1050802268 /nfs/dbraw/zinc/80/22/68/1050802268.db2.gz HBVJYKFSUVTIJG-OAHLLOKOSA-N 2 0 328.447 4.115 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001179877560 1050813613 /nfs/dbraw/zinc/81/36/13/1050813613.db2.gz HHNHJOIRRKERDL-INIZCTEOSA-N 2 0 340.433 4.322 20 0 EIADRP CC[NH+]1CCC(C[N@H+](Cc2ccco2)Cc2cccc(C)c2)CC1 ZINC001179942047 1050825952 /nfs/dbraw/zinc/82/59/52/1050825952.db2.gz KZQAUCSQGFTXOY-UHFFFAOYSA-N 2 0 326.484 4.322 20 0 EIADRP CC[N@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)CC1CCC(OC)CC1 ZINC001179945234 1050828107 /nfs/dbraw/zinc/82/81/07/1050828107.db2.gz GFLSUABDPQGTIF-ORFBVSJDSA-N 2 0 344.543 4.036 20 0 EIADRP Cc1ccc(-c2ncc(C[N@H+](C)CC3CC[NH+](C)CC3)s2)cc1C ZINC001180001581 1050844030 /nfs/dbraw/zinc/84/40/30/1050844030.db2.gz ARCBGUSGNHIZRR-UHFFFAOYSA-N 2 0 343.540 4.201 20 0 EIADRP CC[NH+]1CCC(C[N@H+]2Cc3ccccc3[C@@H](c3ccccc3)C2)CC1 ZINC001179969296 1050850619 /nfs/dbraw/zinc/85/06/19/1050850619.db2.gz AFLRUMXUSJPAKG-HSZRJFAPSA-N 2 0 334.507 4.366 20 0 EIADRP C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](C[C@@H]1CCC[NH2+]C1)C1CC1 ZINC000261895237 1050871513 /nfs/dbraw/zinc/87/15/13/1050871513.db2.gz OFRPEUBQQFGASB-UONOGXRCSA-N 2 0 326.406 4.230 20 0 EIADRP C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC000261895233 1050871989 /nfs/dbraw/zinc/87/19/89/1050871989.db2.gz OFRPEUBQQFGASB-KGLIPLIRSA-N 2 0 326.406 4.230 20 0 EIADRP Cc1cc(C)cc(CC[N@@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC001180267396 1050940539 /nfs/dbraw/zinc/94/05/39/1050940539.db2.gz VMXUOQCPDWMLPG-HSZRJFAPSA-N 2 0 336.523 4.300 20 0 EIADRP C[NH+](C)CC1CCN(c2ccc(NCc3cccs3)cc2)CC1 ZINC000151375860 1051127444 /nfs/dbraw/zinc/12/74/44/1051127444.db2.gz FDTDGCCVCOLEOX-UHFFFAOYSA-N 2 0 329.513 4.138 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)CC1 ZINC000775384788 1051176761 /nfs/dbraw/zinc/17/67/61/1051176761.db2.gz GNSPHZHVYGXWMQ-KRWDZBQOSA-N 2 0 340.483 4.310 20 0 EIADRP Cc1ccc(CC[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)cc1C ZINC001181314042 1051204496 /nfs/dbraw/zinc/20/44/96/1051204496.db2.gz BWGZBRFXRXATBA-QHCPKHFHSA-N 2 0 336.523 4.348 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H]2CCCSC2)ccc1OC ZINC000775397547 1051218745 /nfs/dbraw/zinc/21/87/45/1051218745.db2.gz WDDAHFHITGUISV-MAUKXSAKSA-N 2 0 336.545 4.083 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)C1 ZINC000163218472 1051239877 /nfs/dbraw/zinc/23/98/77/1051239877.db2.gz COIYEYQSBOTCQA-RDJZCZTQSA-N 2 0 343.540 4.419 20 0 EIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccc(-c4ccc(F)cc4)o3)C2)CC1 ZINC001181514241 1051246414 /nfs/dbraw/zinc/24/64/14/1051246414.db2.gz BXLBHPKMTJJIQN-GOSISDBHSA-N 2 0 342.458 4.249 20 0 EIADRP CC(C)C[N@H+](CC[C@H]1CCC[NH+]1C)Cc1ccc(F)c(Cl)c1 ZINC001174916077 1051247597 /nfs/dbraw/zinc/24/75/97/1051247597.db2.gz OCJGGDMBIDVXRE-MRXNPFEDSA-N 2 0 326.887 4.421 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)[C@@H]1CC1(C)C ZINC001181656161 1051270843 /nfs/dbraw/zinc/27/08/43/1051270843.db2.gz PJGHGOIWTFLYIA-VQTJNVASSA-N 2 0 330.516 4.074 20 0 EIADRP COc1ccc([C@@H](C)[NH2+][C@H]2CC=CCC2)cc1C[NH+]1CCCCC1 ZINC000775412109 1051275336 /nfs/dbraw/zinc/27/53/36/1051275336.db2.gz RXHHUVYEUOGOEK-XLIONFOSSA-N 2 0 328.500 4.440 20 0 EIADRP Cc1ccc(CC[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1C ZINC001181698600 1051290568 /nfs/dbraw/zinc/29/05/68/1051290568.db2.gz SYIQSSFCRDRLBB-XMMPIXPASA-N 2 0 348.534 4.444 20 0 EIADRP CC[C@H]([NH2+][C@H](C)c1ccc(OC)c(C[NH+](CC)CC)c1)[C@@H]1CCCO1 ZINC000775417836 1051292364 /nfs/dbraw/zinc/29/23/64/1051292364.db2.gz XNBJVSHTZQJSQQ-PBEJRMEISA-N 2 0 348.531 4.145 20 0 EIADRP CC[N@H+](CCc1ccc(F)c(F)c1)Cc1ccc(C[NH+](C)C)cc1 ZINC001175061596 1051313284 /nfs/dbraw/zinc/31/32/84/1051313284.db2.gz INHDFFBPZYDQRY-UHFFFAOYSA-N 2 0 332.438 4.091 20 0 EIADRP C([C@@H]1CCC2(CCCCCC2)O1)[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001191069964 1051338891 /nfs/dbraw/zinc/33/88/91/1051338891.db2.gz JDXLWRBGTDZLKN-PMACEKPBSA-N 2 0 334.548 4.066 20 0 EIADRP CCO[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(C[NH+]3CCCCC3)cc2)C1(C)C ZINC001191164593 1051370605 /nfs/dbraw/zinc/37/06/05/1051370605.db2.gz GXDZCEVPIBNRIG-NHCUHLMSSA-N 2 0 344.543 4.308 20 0 EIADRP C[C@H](CC[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000155862867 1051469640 /nfs/dbraw/zinc/46/96/40/1051469640.db2.gz NEGOSMYXOVFGLO-JKIFEVAISA-N 2 0 328.422 4.271 20 0 EIADRP CCc1ccc(C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)s1 ZINC000156279925 1051515298 /nfs/dbraw/zinc/51/52/98/1051515298.db2.gz DVOFYKLKTOGIOR-OAHLLOKOSA-N 2 0 332.513 4.102 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1ccc2cc(OC)ccc2c1 ZINC000163255882 1051558591 /nfs/dbraw/zinc/55/85/91/1051558591.db2.gz FLZBKIBHOAJHLJ-IERDGZPVSA-N 2 0 326.484 4.231 20 0 EIADRP C[N@@H+]1C[C@@H](C[NH2+][C@@H]2CC[C@](C)(c3ccccc3)C2)[C@H](c2ccccc2)C1 ZINC001182542186 1051635617 /nfs/dbraw/zinc/63/56/17/1051635617.db2.gz CKLFNZKYPJBNHJ-AZOUXBGGSA-N 2 0 348.534 4.432 20 0 EIADRP Cc1ccc2c(ccc(C)c2C[NH+]2CCN(c3cc[nH+]cc3)CC2)c1 ZINC001192234113 1051673854 /nfs/dbraw/zinc/67/38/54/1051673854.db2.gz MUCMXEZMGSPWSL-UHFFFAOYSA-N 2 0 331.463 4.174 20 0 EIADRP CCc1ccccc1C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000157957919 1051687634 /nfs/dbraw/zinc/68/76/34/1051687634.db2.gz NECBQTIMSOFMDZ-KRWDZBQOSA-N 2 0 326.484 4.040 20 0 EIADRP CO[C@H](C[NH+]1CCC(CCC[NH+]2CCCC2)CC1)C1CCCCC1 ZINC001192402036 1051723700 /nfs/dbraw/zinc/72/37/00/1051723700.db2.gz RIZABEOZIMHXGE-OAQYLSRUSA-N 2 0 336.564 4.170 20 0 EIADRP C[C@@H]([NH2+]CC1CCC2(CC2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001183122657 1051783742 /nfs/dbraw/zinc/78/37/42/1051783742.db2.gz MAUSWJWGQOHIHZ-NQIIRXRSSA-N 2 0 326.528 4.457 20 0 EIADRP C[C@H]1CC(C)(C)CC[C@H]1[NH2+]CC1(c2ccccc2)CC[NH+](C)CC1 ZINC001183354472 1051826041 /nfs/dbraw/zinc/82/60/41/1051826041.db2.gz CQZLDHRJJWBQRZ-AZUAARDMSA-N 2 0 328.544 4.454 20 0 EIADRP CC(C)Cc1ccc(C[N@H+](CC(C)C)CC2CC[NH+](C)CC2)cn1 ZINC001183463421 1051846332 /nfs/dbraw/zinc/84/63/32/1051846332.db2.gz DYTQYOCWBNJTFP-UHFFFAOYSA-N 2 0 331.548 4.080 20 0 EIADRP CC(C)C[N@@H+](Cc1cc(F)cc(Cl)c1)CC1CC[NH+](C)CC1 ZINC001183464313 1051848692 /nfs/dbraw/zinc/84/86/92/1051848692.db2.gz RCGMCXVOENBXCY-UHFFFAOYSA-N 2 0 326.887 4.279 20 0 EIADRP CCCOc1cccc(C[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC001193251618 1051891985 /nfs/dbraw/zinc/89/19/85/1051891985.db2.gz VFFRQDNUKCHGGU-MJGOQNOKSA-N 2 0 330.516 4.218 20 0 EIADRP CC1(C)CC[N@H+](Cc2ccccc2N2CCCCC2)CC(C)(C)[NH2+]1 ZINC001184375519 1052000470 /nfs/dbraw/zinc/00/04/70/1052000470.db2.gz UPNJWXVDBYMZJH-UHFFFAOYSA-N 2 0 329.532 4.029 20 0 EIADRP C[C@H](Cc1ccc(-c2ccccc2)cc1)[NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21 ZINC001184386271 1052002403 /nfs/dbraw/zinc/00/24/03/1052002403.db2.gz AMWFWTLGJPVKGC-LMDOGRNLSA-N 2 0 334.507 4.214 20 0 EIADRP CC(C)[C@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cccnc1 ZINC000164121578 1052017857 /nfs/dbraw/zinc/01/78/57/1052017857.db2.gz NQBUZTMWVUAEOX-NRFANRHFSA-N 2 0 329.532 4.208 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cc(O)cc(Cl)c2)cc1 ZINC001177132663 1052233837 /nfs/dbraw/zinc/23/38/37/1052233837.db2.gz LASQBUAYRFPOTK-UHFFFAOYSA-N 2 0 332.875 4.177 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3OC)cc2)C1 ZINC000174299585 1052564975 /nfs/dbraw/zinc/56/49/75/1052564975.db2.gz BEJPXKPFKLCGDY-IBGZPJMESA-N 2 0 338.495 4.184 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623382630 1052640681 /nfs/dbraw/zinc/64/06/81/1052640681.db2.gz NQGYSOUHKZLTGJ-CZUORRHYSA-N 2 0 328.422 4.099 20 0 EIADRP c1ccc2c(c1)NCCC[C@@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000192926054 1052649298 /nfs/dbraw/zinc/64/92/98/1052649298.db2.gz RPIQRXIZLIHIFQ-NRFANRHFSA-N 2 0 327.516 4.320 20 0 EIADRP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+][C@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623487711 1052663839 /nfs/dbraw/zinc/66/38/39/1052663839.db2.gz NVIMUUGRBODESG-ZFWWWQNUSA-N 2 0 328.422 4.099 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CC2(c3ccc(C(F)(F)F)cc3)CC2)CC1(C)C ZINC000623502763 1052668216 /nfs/dbraw/zinc/66/82/16/1052668216.db2.gz ZROXQPHMMZGAQL-INIZCTEOSA-N 2 0 340.433 4.199 20 0 EIADRP COc1cccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)c1 ZINC000177261049 1052675799 /nfs/dbraw/zinc/67/57/99/1052675799.db2.gz WVWDXDOQYXKCGX-QGZVFWFLSA-N 2 0 326.484 4.386 20 0 EIADRP COc1ccccc1[C@@H](C)[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000177977644 1052695144 /nfs/dbraw/zinc/69/51/44/1052695144.db2.gz CIDQWLRCTGDDLI-QGZVFWFLSA-N 2 0 326.484 4.386 20 0 EIADRP C[C@@H]([NH2+][C@H]1CCCc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000178094129 1052699078 /nfs/dbraw/zinc/69/90/78/1052699078.db2.gz NWFGJEJPICMCCM-VGSWGCGISA-N 2 0 338.495 4.355 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccccc1N(C)C ZINC000179399621 1052734606 /nfs/dbraw/zinc/73/46/06/1052734606.db2.gz NHASPOSUASBDBU-SFHVURJKSA-N 2 0 337.511 4.199 20 0 EIADRP C[C@@H]([NH2+]C1(c2ccccc2)CCC1)c1cccc(OCC[NH+](C)C)c1 ZINC000180343701 1052795547 /nfs/dbraw/zinc/79/55/47/1052795547.db2.gz FXGUKDRJNFSVPA-GOSISDBHSA-N 2 0 338.495 4.357 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1cc(-c2ccccc2)n(C)n1 ZINC000623849095 1052822085 /nfs/dbraw/zinc/82/20/85/1052822085.db2.gz VTTBUGXPEKVLRC-ZWKOTPCHSA-N 2 0 342.531 4.248 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCCc3c4cc(Cl)ccc4[nH]c32)CC1 ZINC000623927976 1052837470 /nfs/dbraw/zinc/83/74/70/1052837470.db2.gz AGABNKNWSRUFHS-GOSISDBHSA-N 2 0 329.875 4.050 20 0 EIADRP Cc1ccc(Br)cc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000623996145 1052848996 /nfs/dbraw/zinc/84/89/96/1052848996.db2.gz VBDZNAGGGPLBGI-OHRKKDJYSA-N 2 0 337.305 4.033 20 0 EIADRP Cc1ccc(Br)cc1[C@@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000624002678 1052850845 /nfs/dbraw/zinc/85/08/45/1052850845.db2.gz BHBLQQHOMJYUBR-IUDNXUCKSA-N 2 0 339.321 4.281 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cc(C)ccc1C ZINC000624010109 1052852736 /nfs/dbraw/zinc/85/27/36/1052852736.db2.gz HZMJOQWTADRVHF-QFIPXVFZSA-N 2 0 344.543 4.235 20 0 EIADRP Cc1ccc(C(C)(C)C[NH2+][C@H](C)c2ccc(-n3ccnc3)cc2)nc1 ZINC000624113866 1052866491 /nfs/dbraw/zinc/86/64/91/1052866491.db2.gz OGBSZOPWAVIEDT-QGZVFWFLSA-N 2 0 334.467 4.204 20 0 EIADRP Cn1cc(C[NH+]2CCC(CCC[NH+](C)C)CC2)c(C2CCCCC2)n1 ZINC000183100270 1052963321 /nfs/dbraw/zinc/96/33/21/1052963321.db2.gz SSIJOHFXHCOGFB-UHFFFAOYSA-N 2 0 346.563 4.022 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000381131097 1053054777 /nfs/dbraw/zinc/05/47/77/1053054777.db2.gz KHCIPDQMARXAJU-AZUAARDMSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCCO2)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000850457047 1053232693 /nfs/dbraw/zinc/23/26/93/1053232693.db2.gz FPPOJNVWOYMCJC-SQGPQFPESA-N 2 0 342.527 4.315 20 0 EIADRP COc1ccc(CC[C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000764961014 1053398433 /nfs/dbraw/zinc/39/84/33/1053398433.db2.gz GJEVUWXMXUFTJL-OALUTQOASA-N 2 0 332.532 4.118 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cnn(-c2ccccc2)c1 ZINC000764960054 1053399012 /nfs/dbraw/zinc/39/90/12/1053399012.db2.gz CBYBRKQUXZKJQA-MOPGFXCFSA-N 2 0 340.515 4.035 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)c1cccc(F)c1 ZINC000765361058 1053516632 /nfs/dbraw/zinc/51/66/32/1053516632.db2.gz VDLWRZFSXBFLNH-KGVIQGDOSA-N 2 0 340.486 4.429 20 0 EIADRP C[C@@H](CC[NH2+][C@H](C)c1cscn1)CC[NH2+][C@@H](C)c1cscn1 ZINC000852417840 1053575432 /nfs/dbraw/zinc/57/54/32/1053575432.db2.gz XYRKLVKXRQHMAI-BTTYYORXSA-N 2 0 338.546 4.017 20 0 EIADRP c1ccc(C[C@H]2CCC[C@H]2[NH2+]CCCCC[NH+]2CCCCC2)nc1 ZINC000852566183 1053589025 /nfs/dbraw/zinc/58/90/25/1053589025.db2.gz DUYPSFSAHBFDAQ-TZIWHRDSSA-N 2 0 329.532 4.039 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccc(CSC(F)F)o2)CC1 ZINC000865765928 1053589031 /nfs/dbraw/zinc/58/90/31/1053589031.db2.gz SKRJVPXIODEESC-UHFFFAOYSA-N 2 0 332.460 4.088 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+][C@@H]2CCCO[C@H]2c2ccc(Cl)cc2)CC1(C)C ZINC000865830357 1053601506 /nfs/dbraw/zinc/60/15/06/1053601506.db2.gz MAVYYFBEUVWZIV-KSZLIROESA-N 2 0 336.907 4.023 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc2c(ccnc2Cl)o1 ZINC000866349568 1053699151 /nfs/dbraw/zinc/69/91/51/1053699151.db2.gz JUYTYDLYEFLRCY-GFCCVEGCSA-N 2 0 333.863 4.006 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1cc2c(ccnc2Cl)o1 ZINC000866364580 1053705331 /nfs/dbraw/zinc/70/53/31/1053705331.db2.gz RQTSNRFLEMXGLA-CQSZACIVSA-N 2 0 335.879 4.398 20 0 EIADRP C[C@@H]([NH2+]CCC1CC[NH+](Cc2ccccc2)CC1)c1nccs1 ZINC000866468465 1053741325 /nfs/dbraw/zinc/74/13/25/1053741325.db2.gz AOASNMIRYUVFKK-MRXNPFEDSA-N 2 0 329.513 4.096 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CC[C@H]2CCCS2)C3)cc1 ZINC000866482257 1053746802 /nfs/dbraw/zinc/74/68/02/1053746802.db2.gz ZJEXLENRIZOXDD-IYWMVGAKSA-N 2 0 330.541 4.057 20 0 EIADRP CC[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ccc(OC)c(OC)c1 ZINC000866516226 1053764586 /nfs/dbraw/zinc/76/45/86/1053764586.db2.gz NPLUXCJZLZAPFO-OHTSDLOESA-N 2 0 334.504 4.007 20 0 EIADRP COc1ccc(C)cc1C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386612540 1053803117 /nfs/dbraw/zinc/80/31/17/1053803117.db2.gz KQHGRCAASPCOBQ-UYAOXDASSA-N 2 0 338.495 4.004 20 0 EIADRP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+]CCCC1CCCC1 ZINC001198901765 1054292648 /nfs/dbraw/zinc/29/26/48/1054292648.db2.gz ZYSJHMGCDOFQCS-UHFFFAOYSA-N 2 0 330.516 4.221 20 0 EIADRP c1ccc([C@H](CN2CCCC2)[NH2+][C@H]2CCCc3ccccc3C2)cc1 ZINC001198901020 1054293713 /nfs/dbraw/zinc/29/37/13/1054293713.db2.gz OGUMCLBCHZDMQR-GOTSBHOMSA-N 2 0 334.507 4.361 20 0 EIADRP CS[C@H]1CCC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC001199021165 1054321132 /nfs/dbraw/zinc/32/11/32/1054321132.db2.gz CSFHVULXEFLRER-PMACEKPBSA-N 2 0 332.557 4.436 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+][C@H]3CCOC4(CCCC4)C3)CC2)c1 ZINC000872029801 1054348464 /nfs/dbraw/zinc/34/84/64/1054348464.db2.gz SUAMGRJZQWEFQK-SFHVURJKSA-N 2 0 348.556 4.042 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)c1ccc2c(c1)CCO2 ZINC000123922048 1054361229 /nfs/dbraw/zinc/36/12/29/1054361229.db2.gz IZIISVGUCJNCKH-OAQYLSRUSA-N 2 0 338.495 4.314 20 0 EIADRP CCCOc1cccc(C[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)c1 ZINC001199320038 1054389888 /nfs/dbraw/zinc/38/98/88/1054389888.db2.gz HAGSUXFCMGHING-OALUTQOASA-N 2 0 332.532 4.323 20 0 EIADRP CC(C)c1[nH+]c(CNC[C@@H](C2CCCCC2)[NH+](C)C)c2ccccn21 ZINC001199335785 1054394003 /nfs/dbraw/zinc/39/40/03/1054394003.db2.gz CDWRSAZJAXBGEY-FQEVSTJZSA-N 2 0 342.531 4.058 20 0 EIADRP CC(C)C[C@H]1CCC[C@@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)C1 ZINC001199384058 1054402887 /nfs/dbraw/zinc/40/28/87/1054402887.db2.gz NOZNVTCQPIBVLT-WOJBJXKFSA-N 2 0 332.532 4.322 20 0 EIADRP C[C@H]1C[C@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CCO1 ZINC001199629669 1054435919 /nfs/dbraw/zinc/43/59/19/1054435919.db2.gz LRCRXIZUNPPZKK-FXAWDEMLSA-N 2 0 330.516 4.108 20 0 EIADRP CCC[C@H](C)CCC[C@@H](C)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000858430856 1054489035 /nfs/dbraw/zinc/48/90/35/1054489035.db2.gz IDZQOQKGRFSYCS-RBUKOAKNSA-N 2 0 338.580 4.462 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CC[C@H](C)[C@H](C)C3)CC2)cc1 ZINC001199883536 1054490843 /nfs/dbraw/zinc/49/08/43/1054490843.db2.gz JTHYCUMYQDIHCM-WAOWUJCRSA-N 2 0 344.543 4.322 20 0 EIADRP c1c2ccccc2[nH]c1C[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC001199926308 1054498200 /nfs/dbraw/zinc/49/82/00/1054498200.db2.gz VNSUGRSHLPSIDL-UHFFFAOYSA-N 2 0 325.500 4.302 20 0 EIADRP c1csc(-c2ncc(C[NH2+][C@@H]3CCCCC34CC[NH2+]CC4)s2)c1 ZINC000873232988 1054510653 /nfs/dbraw/zinc/51/06/53/1054510653.db2.gz VGVDYBMQIFXAFS-MRXNPFEDSA-N 2 0 347.553 4.274 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873267870 1054516402 /nfs/dbraw/zinc/51/64/02/1054516402.db2.gz LARJONVFBVMMNO-CHWSQXEVSA-N 2 0 347.503 4.296 20 0 EIADRP c1c2ccccc2oc1[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccnc1 ZINC000873266071 1054518170 /nfs/dbraw/zinc/51/81/70/1054518170.db2.gz ZMHSEWJISSNBSE-TWSMVNEUSA-N 2 0 347.462 4.037 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]C[C@H]3C[C@H]4CC[C@@H](C3)[NH2+]4)cs2)cs1 ZINC000873260301 1054518321 /nfs/dbraw/zinc/51/83/21/1054518321.db2.gz XODDLZMRAIQDMP-YUDUHTQSSA-N 2 0 347.553 4.361 20 0 EIADRP C[N@H+](CCCc1ccc(C(F)(F)F)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000671724920 1054789638 /nfs/dbraw/zinc/78/96/38/1054789638.db2.gz JNIUZBMGZLKEOZ-JWTNVVGKSA-N 2 0 340.433 4.195 20 0 EIADRP CC(C)(C)C[NH+]1CCC(OC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001201441707 1054810625 /nfs/dbraw/zinc/81/06/25/1054810625.db2.gz LBXNXAAATVXZIG-UHFFFAOYSA-N 2 0 344.543 4.178 20 0 EIADRP COC[C@@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](C[C@@H](C)CCC=C(C)C)C2 ZINC001201486253 1054814927 /nfs/dbraw/zinc/81/49/27/1054814927.db2.gz HWJDCUUUPYLZGV-BVSLBCMMSA-N 2 0 348.575 4.049 20 0 EIADRP CCC[C@H](C)C[NH+]1CCC2(CCC[N@@H+]2Cc2c(C)noc2C)CC1 ZINC001201542836 1054836019 /nfs/dbraw/zinc/83/60/19/1054836019.db2.gz MBKIDMCAEUYYGY-INIZCTEOSA-N 2 0 333.520 4.158 20 0 EIADRP CCC(CC)C[NH+]1CCC2(C[C@@H]([N@H+](C)Cc3ccccc3)CO2)CC1 ZINC001201525632 1054843613 /nfs/dbraw/zinc/84/36/13/1054843613.db2.gz IGBXOONESOEJPU-OAQYLSRUSA-N 2 0 344.543 4.178 20 0 EIADRP c1ccc(CCC[NH+]2CCC(N3CCc4ccccc4C3)CC2)cc1 ZINC001201674327 1054872777 /nfs/dbraw/zinc/87/27/77/1054872777.db2.gz XMXBOHYMYCJTCJ-UHFFFAOYSA-N 2 0 334.507 4.142 20 0 EIADRP CSCCC[NH+]1CCC2(CC1)CC[NH+](Cc1ccccc1)CC2 ZINC001201697076 1054881232 /nfs/dbraw/zinc/88/12/32/1054881232.db2.gz ZGUPHASYVJBNLT-UHFFFAOYSA-N 2 0 332.557 4.118 20 0 EIADRP CCCC[NH+]1CCC2(CC1)CC[NH+](Cc1cccc(OC)c1)CC2 ZINC001201705525 1054884311 /nfs/dbraw/zinc/88/43/11/1054884311.db2.gz CZKDNLRRJTVGKJ-UHFFFAOYSA-N 2 0 330.516 4.173 20 0 EIADRP CCCCCC[NH+]1CCC2(CCC[N@@H+]2Cc2c(C)noc2C)CC1 ZINC001201746345 1054893458 /nfs/dbraw/zinc/89/34/58/1054893458.db2.gz DYSVXLCZFRVVLP-UHFFFAOYSA-N 2 0 333.520 4.302 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CCO[C@H](c2ccc(OC)cc2)C1 ZINC001168593009 1054946254 /nfs/dbraw/zinc/94/62/54/1054946254.db2.gz BPMFXOSESGFWAZ-DSKINZAPSA-N 2 0 348.531 4.015 20 0 EIADRP CC[NH+](CC)CCCN1CC[NH+](CC[C@H](C)CCC=C(C)C)CC1 ZINC001201981381 1054956420 /nfs/dbraw/zinc/95/64/20/1054956420.db2.gz MYWYCUBFJFZBOQ-OAQYLSRUSA-N 2 0 337.596 4.109 20 0 EIADRP COC1CC[NH+](C2CC[NH+](CC[C@H](C)CCC=C(C)C)CC2)CC1 ZINC001201981250 1054956485 /nfs/dbraw/zinc/95/64/85/1054956485.db2.gz LDJSSYIPQBPVMY-LJQANCHMSA-N 2 0 336.564 4.334 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(-c2cccnc2)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC001201946720 1054962956 /nfs/dbraw/zinc/96/29/56/1054962956.db2.gz KTXXNFWZQKJBLR-GCJKJVERSA-N 2 0 349.522 4.491 20 0 EIADRP Cc1ccncc1[C@@H](C)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000671750913 1054978835 /nfs/dbraw/zinc/97/88/35/1054978835.db2.gz CJCNDNLGKPFXNE-KMFTYDHNSA-N 2 0 337.511 4.484 20 0 EIADRP COCCC1(C[NH2+]C[C@@H]2CCC[N@@H+]2C2CCCCC2)CCCCC1 ZINC001202185180 1055073355 /nfs/dbraw/zinc/07/33/55/1055073355.db2.gz ZHKWOSDFBULDCF-FQEVSTJZSA-N 2 0 336.564 4.360 20 0 EIADRP FC(F)(F)CCC[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001202415990 1055162032 /nfs/dbraw/zinc/16/20/32/1055162032.db2.gz QKVSRTXRERZFJH-UHFFFAOYSA-N 2 0 340.433 4.317 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)C1 ZINC000655825320 1055677414 /nfs/dbraw/zinc/67/74/14/1055677414.db2.gz DKNKXGBSFJCUOF-TYKWCNGQSA-N 2 0 347.506 4.119 20 0 EIADRP C[C@H]([NH2+]C1CCC(C(F)F)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000282300146 1055792902 /nfs/dbraw/zinc/79/29/02/1055792902.db2.gz MGAHYHHSXLHRKX-BARLLCKDSA-N 2 0 336.470 4.311 20 0 EIADRP CSC[C@@H]([NH2+]CCCC[NH+](C)C)c1ccc(C(F)(F)F)cc1 ZINC000542847701 1056222476 /nfs/dbraw/zinc/22/24/76/1056222476.db2.gz GMYOYPUHQLACQN-OAHLLOKOSA-N 2 0 334.451 4.041 20 0 EIADRP CCCCC[C@H]([NH2+][C@H]1CCN(C2CC[NH+](C)CC2)C1)c1ccccc1 ZINC000765943437 1056690442 /nfs/dbraw/zinc/69/04/42/1056690442.db2.gz KVJOECNMEVKNLP-UNMCSNQZSA-N 2 0 343.559 4.066 20 0 EIADRP Cc1nc(C)c([C@H](C)[NH2+]C[C@@H]2CCCN(Cc3ccccc3)C2)s1 ZINC000383343407 1060247239 /nfs/dbraw/zinc/24/72/39/1060247239.db2.gz LNEFHQLOZUKONT-KXBFYZLASA-N 2 0 343.540 4.323 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1(c3cccc(Br)c3)CCC1)C2 ZINC001169099762 1060637096 /nfs/dbraw/zinc/63/70/96/1060637096.db2.gz VGTIXYAQLYVBTH-BJWYYQGGSA-N 2 0 349.316 4.043 20 0 EIADRP CC1(C)C[C@H](Nc2cc[nH+]c(N3CCCCC3)c2)C[C@](C)(C[NH3+])C1 ZINC001169149343 1060667744 /nfs/dbraw/zinc/66/77/44/1060667744.db2.gz YXECWMXRBBJDKQ-PXNSSMCTSA-N 2 0 330.520 4.028 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H](n1cc(C3CC[NH2+]CC3)c3c1cccc3F)C2 ZINC001169154748 1060671481 /nfs/dbraw/zinc/67/14/81/1060671481.db2.gz UDYQRYKLEYSFEY-BJWYYQGGSA-N 2 0 341.474 4.045 20 0 EIADRP C[C@H]1C[N@H+](Cc2sccc2Oc2ccccc2)CCC[C@@H]1C[NH3+] ZINC001206003737 1060688044 /nfs/dbraw/zinc/68/80/44/1060688044.db2.gz LYSYUHUFUGITRA-JKSUJKDBSA-N 2 0 330.497 4.347 20 0 EIADRP C[NH+]1CCC2(CCC[N@H+](Cc3ccc(Cl)cc3Cl)C2)CC1 ZINC001169780474 1060962804 /nfs/dbraw/zinc/96/28/04/1060962804.db2.gz LJXFZFBRUJLXPG-UHFFFAOYSA-N 2 0 327.299 4.301 20 0 EIADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1cnc(-c2ccccc2F)s1 ZINC000449528798 1031822318 /nfs/dbraw/zinc/82/23/18/1031822318.db2.gz SCAPULIAYRHDGL-UHFFFAOYSA-N 2 0 335.492 4.159 20 0 EIADRP COc1c(Cl)cc(Cl)cc1C[NH2+]C(C)(C)CCC[NH+](C)C ZINC000449524878 1031822447 /nfs/dbraw/zinc/82/24/47/1031822447.db2.gz APXAURARYSOZBZ-UHFFFAOYSA-N 2 0 333.303 4.212 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc2c(c1)CC(C)(C)O2 ZINC000729678863 1032128645 /nfs/dbraw/zinc/12/86/45/1032128645.db2.gz UFNRBILCZJXEEV-QGZVFWFLSA-N 2 0 330.516 4.144 20 0 EIADRP FC(F)(F)C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000459380393 1032130553 /nfs/dbraw/zinc/13/05/53/1032130553.db2.gz ZSNWKDWKSIVANP-SFHVURJKSA-N 2 0 349.400 4.334 20 0 EIADRP CCC1(C[NH2+]Cc2ccc(F)cn2)CC[NH+](Cc2ccccc2)CC1 ZINC000529542872 1032433460 /nfs/dbraw/zinc/43/34/60/1032433460.db2.gz MCNGUIYUZWVBHI-UHFFFAOYSA-N 2 0 341.474 4.003 20 0 EIADRP CC[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccncc1 ZINC000245750729 1032459656 /nfs/dbraw/zinc/45/96/56/1032459656.db2.gz TZBIKJDSJZDLTG-YUMYIRISSA-N 2 0 335.495 4.318 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)CCCO2 ZINC000120916029 1032476279 /nfs/dbraw/zinc/47/62/79/1032476279.db2.gz PLKYMAGOKJRZJQ-FQEVSTJZSA-N 2 0 342.458 4.199 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)c1ccccc1C(C)(C)C ZINC000533170058 1032528625 /nfs/dbraw/zinc/52/86/25/1032528625.db2.gz QQRGKZAJRKBGIA-QZTJIDSGSA-N 2 0 344.543 4.136 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc(Cl)nc1 ZINC000760174782 1032570573 /nfs/dbraw/zinc/57/05/73/1032570573.db2.gz ZCJCNBODKRODBJ-AEFFLSMTSA-N 2 0 343.902 4.298 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000579726810 1018827646 /nfs/dbraw/zinc/82/76/46/1018827646.db2.gz WKMAUYIJQFCDTL-QZTJIDSGSA-N 2 0 340.433 4.273 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643545978 1018896629 /nfs/dbraw/zinc/89/66/29/1018896629.db2.gz GPYFHMGWGNZZQJ-WMLDXEAASA-N 2 0 341.524 4.444 20 0 EIADRP [NH3+]CC1CC[NH+](Cc2ccc(NCc3ccccc3C3CC3)cc2)CC1 ZINC001167052328 1018904800 /nfs/dbraw/zinc/90/48/00/1018904800.db2.gz MIIAREJLGLBOGK-UHFFFAOYSA-N 2 0 349.522 4.347 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643547268 1018924439 /nfs/dbraw/zinc/92/44/39/1018924439.db2.gz BXMNXXKFJCXENZ-IRXDYDNUSA-N 2 0 339.527 4.488 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+]Cc3cccc4cc[nH]c43)CC2)c1 ZINC000236743035 1032827592 /nfs/dbraw/zinc/82/75/92/1032827592.db2.gz LPCYJKKOAYWDHI-UHFFFAOYSA-N 2 0 339.508 4.231 20 0 EIADRP C[NH+]1CCC(CC[NH2+]Cc2c(Cl)ccc(Cl)c2Cl)CC1 ZINC000134403943 1019692384 /nfs/dbraw/zinc/69/23/84/1019692384.db2.gz FZSDFMHZXWECPD-UHFFFAOYSA-N 2 0 335.706 4.468 20 0 EIADRP c1ccc(CSCCC[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000535627064 1020013884 /nfs/dbraw/zinc/01/38/84/1020013884.db2.gz RPBWSOVUWQQMQL-PZJWPPBQSA-N 2 0 344.568 4.259 20 0 EIADRP Clc1ccc(C[NH+]2CCC3(C[NH+](Cc4ccccc4)C3)CC2)s1 ZINC001204443484 1020357283 /nfs/dbraw/zinc/35/72/83/1020357283.db2.gz YEZOAUNYSRIKOY-UHFFFAOYSA-N 2 0 346.927 4.500 20 0 EIADRP C[C@H](c1cccc(Br)c1)[N@H+](C)CCC[NH+]1CCCCC1 ZINC001209452987 1020362763 /nfs/dbraw/zinc/36/27/63/1020362763.db2.gz BHAOPFMVHLUCJN-OAHLLOKOSA-N 2 0 339.321 4.318 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CS1 ZINC000655714691 1020911751 /nfs/dbraw/zinc/91/17/51/1020911751.db2.gz AMQNEZATMXAVIC-APWZRJJASA-N 2 0 344.524 4.285 20 0 EIADRP Cc1cc(OCCC[C@@H](C)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)ccc1Cl ZINC000655804040 1020975301 /nfs/dbraw/zinc/97/53/01/1020975301.db2.gz MYHWQPXKZLYAJF-ZACQAIPSSA-N 2 0 338.923 4.126 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000655803928 1020975946 /nfs/dbraw/zinc/97/59/46/1020975946.db2.gz IPBJWNJOXCJSIO-UWIFEVILSA-N 2 0 340.433 4.271 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655805664 1020976334 /nfs/dbraw/zinc/97/63/34/1020976334.db2.gz KAZVOHXDXOILLG-JCGIZDLHSA-N 2 0 343.540 4.033 20 0 EIADRP CC[C@H]([NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1)[C@H]1CCCCO1 ZINC000655846804 1021010537 /nfs/dbraw/zinc/01/05/37/1021010537.db2.gz LZNVEOHGIYKVDN-BVYCBKJFSA-N 2 0 344.543 4.019 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccncc1F ZINC000340473038 1021084324 /nfs/dbraw/zinc/08/43/24/1021084324.db2.gz GBQQKANGUIDLLL-INIZCTEOSA-N 2 0 327.447 4.057 20 0 EIADRP C[C@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccncc1F ZINC000340529767 1021203506 /nfs/dbraw/zinc/20/35/06/1021203506.db2.gz CYUAWLWYHWAPDO-IVMQYODDSA-N 2 0 341.474 4.315 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1nc(Br)cs1 ZINC000834487863 1021670793 /nfs/dbraw/zinc/67/07/93/1021670793.db2.gz PFHGUCBPLUQSGE-RYUDHWBXSA-N 2 0 348.354 4.067 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccc3cnccc3c2)C1 ZINC000683827228 1021724849 /nfs/dbraw/zinc/72/48/49/1021724849.db2.gz ADAVNNOGCLNGDG-ICSRJNTNSA-N 2 0 337.511 4.321 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(OC)cc2C)c1 ZINC000414083592 1021822083 /nfs/dbraw/zinc/82/20/83/1021822083.db2.gz WIZMHSLHFNHTTI-KRWDZBQOSA-N 2 0 326.484 4.306 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2ccccc2OC2CCCC2)CC1 ZINC000511491441 1021890666 /nfs/dbraw/zinc/89/06/66/1021890666.db2.gz BRZVDUNDICGZCG-UHFFFAOYSA-N 2 0 330.516 4.172 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2c(c1)CCC2 ZINC000398017875 1021898457 /nfs/dbraw/zinc/89/84/57/1021898457.db2.gz IIXQUYISKOXQAP-WZONZLPQSA-N 2 0 334.507 4.176 20 0 EIADRP C[C@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1nc(-c2ccccc2)cs1 ZINC000089553665 1021930258 /nfs/dbraw/zinc/93/02/58/1021930258.db2.gz KRQVOGNXGQSGER-GJZGRUSLSA-N 2 0 329.513 4.191 20 0 EIADRP CC(C)[N@H+](C)CCCNCc1cccc(OCc2ccccc2)c1 ZINC000394441924 1022032797 /nfs/dbraw/zinc/03/27/97/1022032797.db2.gz GWVQQHWRUZSWNF-UHFFFAOYSA-N 2 0 326.484 4.086 20 0 EIADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1nc(-c2ccccc2)cs1 ZINC000414184745 1022061388 /nfs/dbraw/zinc/06/13/88/1022061388.db2.gz OGHHKRXIAGNJHC-HZPDHXFCSA-N 2 0 329.513 4.193 20 0 EIADRP COc1ccc([C@@H]([NH2+]CC[C@@H]2CCC[N@H+](C)C2)c2ccccc2)cc1 ZINC000414199427 1022104960 /nfs/dbraw/zinc/10/49/60/1022104960.db2.gz XAUHQFMPDFKMPA-AVRDEDQJSA-N 2 0 338.495 4.106 20 0 EIADRP C([NH2+]C1CCC2(CCCO2)CC1)[C@H]1CCC[N@@H+]1CC1CCCCC1 ZINC000580501682 1022121747 /nfs/dbraw/zinc/12/17/47/1022121747.db2.gz KZWJVFBYYQPSCA-NYLDSWQDSA-N 2 0 334.548 4.113 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000414202828 1022123504 /nfs/dbraw/zinc/12/35/04/1022123504.db2.gz ZGTPHSNWUGHIHE-LSDHHAIUSA-N 2 0 344.421 4.010 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)C(F)(F)F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000549032161 1022159074 /nfs/dbraw/zinc/15/90/74/1022159074.db2.gz LNPKMDUPMZZCSE-HOCLYGCPSA-N 2 0 328.422 4.075 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)C(F)(F)F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000549032160 1022161057 /nfs/dbraw/zinc/16/10/57/1022161057.db2.gz LNPKMDUPMZZCSE-GOEBONIOSA-N 2 0 328.422 4.075 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(Cl)cc1 ZINC000398097551 1022219225 /nfs/dbraw/zinc/21/92/25/1022219225.db2.gz KWUSLTALRXMGNE-UZLBHIALSA-N 2 0 328.887 4.340 20 0 EIADRP Cc1cc(F)ncc1C[NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC000892581019 1022310194 /nfs/dbraw/zinc/31/01/94/1022310194.db2.gz SDGPPBPBRAYFFD-INIZCTEOSA-N 2 0 341.474 4.051 20 0 EIADRP CO[C@@](C)([C@@H](C)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)C1CC1 ZINC000414249795 1022311441 /nfs/dbraw/zinc/31/14/41/1022311441.db2.gz XINUBNHKNBESPJ-BBGBUTGUSA-N 2 0 344.543 4.223 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](C[C@H]2CCCC23CCOCC3)C1 ZINC001167424094 1022314639 /nfs/dbraw/zinc/31/46/39/1022314639.db2.gz AXNRWPIMZJTFCO-QHAWAJNXSA-N 2 0 348.575 4.170 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](C[C@@H]2CC(C)(C)OC2(C)C)C1 ZINC001167424515 1022320350 /nfs/dbraw/zinc/32/03/50/1022320350.db2.gz KUTWADINFHPBPO-QYZOEREBSA-N 2 0 336.564 4.167 20 0 EIADRP Cc1cn2c(n1)[C@H](C[NH2+][C@H](Cc1ccc(F)cc1)C(C)C)CCC2 ZINC000378182860 1022477619 /nfs/dbraw/zinc/47/76/19/1022477619.db2.gz JUCKMVAGUSUSSS-PKOBYXMFSA-N 2 0 329.463 4.065 20 0 EIADRP COc1cccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000310891196 1022681043 /nfs/dbraw/zinc/68/10/43/1022681043.db2.gz KPYVCGHXNWWOMP-UYAOXDASSA-N 2 0 338.495 4.258 20 0 EIADRP c1cc(-c2nc(C[N@@H+]3CCC[C@@H]([C@H]4CCC[NH2+]C4)C3)cs2)cs1 ZINC000647542796 1022778812 /nfs/dbraw/zinc/77/88/12/1022778812.db2.gz BXMMMHGZBCDVMS-LSDHHAIUSA-N 2 0 347.553 4.083 20 0 EIADRP FC(F)Sc1ccc2c(c1)CCC[C@H]2[NH2+]CCCn1ccnc1 ZINC000182186592 1022781380 /nfs/dbraw/zinc/78/13/80/1022781380.db2.gz VWDJFTNVBDUSIH-MRXNPFEDSA-N 2 0 337.439 4.255 20 0 EIADRP Brc1ccc([C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)C2CC2)cc1 ZINC000378431631 1022815129 /nfs/dbraw/zinc/81/51/29/1022815129.db2.gz ODKQNFPVEZOZLG-FGTMMUONSA-N 2 0 349.316 4.117 20 0 EIADRP COc1ccccc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000311058169 1022819373 /nfs/dbraw/zinc/81/93/73/1022819373.db2.gz WIHIIKPSQURYFO-ICSRJNTNSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCCC[NH+]1CCCC1 ZINC000581146365 1022855232 /nfs/dbraw/zinc/85/52/32/1022855232.db2.gz SAFJNQWUQFQKLX-INIZCTEOSA-N 2 0 342.449 4.492 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000423372067 1022857670 /nfs/dbraw/zinc/85/76/70/1022857670.db2.gz QYWNXQAVZQTLGB-MXASKKJJSA-N 2 0 326.406 4.201 20 0 EIADRP c1c(CC[NH2+]C2c3ccccc3-c3ccccc32)nc2n1CCCC2 ZINC000378526877 1022858173 /nfs/dbraw/zinc/85/81/73/1022858173.db2.gz ATCLECCTVMKJHU-UHFFFAOYSA-N 2 0 329.447 4.122 20 0 EIADRP CCC[C@@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000473307872 1033107599 /nfs/dbraw/zinc/10/75/99/1033107599.db2.gz DVVWSWSNVBESKL-FXAWDEMLSA-N 2 0 345.531 4.024 20 0 EIADRP C[NH+]1CCC2(CCC[N@@H+]2Cc2cccc(OC3CCCC3)c2)CC1 ZINC000472636094 1023196106 /nfs/dbraw/zinc/19/61/06/1023196106.db2.gz HKOPSSLUSFHVRB-UHFFFAOYSA-N 2 0 328.500 4.068 20 0 EIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+]C1CC(C(F)(F)F)C1 ZINC000581511235 1023317042 /nfs/dbraw/zinc/31/70/42/1023317042.db2.gz CGDGAFBGJAQGOJ-UHFFFAOYSA-N 2 0 328.422 4.075 20 0 EIADRP Cc1cc(F)ncc1C[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000892749145 1023365781 /nfs/dbraw/zinc/36/57/81/1023365781.db2.gz JQTKWHAGAIGHJC-UHFFFAOYSA-N 2 0 341.474 4.195 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000415021368 1023393855 /nfs/dbraw/zinc/39/38/55/1023393855.db2.gz YKIWPJUVZPITIQ-JTQLQIEISA-N 2 0 342.327 4.331 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc(F)cc1C(F)(F)F)c1ccccc1 ZINC000415060282 1023410977 /nfs/dbraw/zinc/41/09/77/1023410977.db2.gz WEEJOQAXHZUWRU-QGZVFWFLSA-N 2 0 340.364 4.414 20 0 EIADRP C[C@H]1C[C@H](CC[NH2+]C2C[C@H]3CC[C@@H](C2)S3)C[N@@H+]1Cc1ccccc1 ZINC000925617565 1023411287 /nfs/dbraw/zinc/41/12/87/1023411287.db2.gz XGNRCHOAPCEBGI-HHXCZETCSA-N 2 0 344.568 4.303 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(Cl)s1 ZINC000656684942 1023439196 /nfs/dbraw/zinc/43/91/96/1023439196.db2.gz ZANPIYMCSDORHJ-AWEZNQCLSA-N 2 0 349.931 4.359 20 0 EIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+][C@@H]2COC(C)(C)C2)cc1 ZINC000417863828 1023440192 /nfs/dbraw/zinc/44/01/92/1023440192.db2.gz SWBGBIZBILJNJG-FQEVSTJZSA-N 2 0 338.495 4.072 20 0 EIADRP CC[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(OC)c(OC)c1 ZINC000119867117 1023440447 /nfs/dbraw/zinc/44/04/47/1023440447.db2.gz CASHQMDURXSRJS-QGZVFWFLSA-N 2 0 334.504 4.007 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2c[nH]c3cc(F)ccc32)CC1 ZINC000472732177 1023469255 /nfs/dbraw/zinc/46/92/55/1023469255.db2.gz FQZNOOFDVBAFIT-GOSISDBHSA-N 2 0 343.490 4.361 20 0 EIADRP CC[N@H+](C)C[C@H]1CC[NH+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500075195 1023484111 /nfs/dbraw/zinc/48/41/11/1023484111.db2.gz OOSYAWYCRPPOLI-HUUCEWRRSA-N 2 0 328.422 4.083 20 0 EIADRP CCC1(C[NH2+][C@@H]2C[C@@H](C)O[C@@H](C)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000581647793 1023485606 /nfs/dbraw/zinc/48/56/06/1023485606.db2.gz OVWFUWYOJXQUHA-CEQLMSFQSA-N 2 0 344.543 4.224 20 0 EIADRP c1nc(C2CCCC2)sc1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000656786174 1023526471 /nfs/dbraw/zinc/52/64/71/1023526471.db2.gz LVJHPYKRYAVITB-KRWDZBQOSA-N 2 0 333.545 4.012 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc(CC(C)C)nc2)c1 ZINC000892937203 1023527401 /nfs/dbraw/zinc/52/74/01/1023527401.db2.gz AJDJBWSSVZKTKI-UHFFFAOYSA-N 2 0 325.500 4.022 20 0 EIADRP c1csc(-c2ncc(C[N@@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)s2)c1 ZINC000656786407 1023527754 /nfs/dbraw/zinc/52/77/54/1023527754.db2.gz SFRIPJHBTBWQRJ-HNNXBMFYSA-N 2 0 347.553 4.083 20 0 EIADRP c1cc(-c2nc(C[N@@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)cs2)cs1 ZINC000656786980 1023535901 /nfs/dbraw/zinc/53/59/01/1023535901.db2.gz YVOKIOBOSAQASP-OAHLLOKOSA-N 2 0 347.553 4.083 20 0 EIADRP CCC[NH+]1CCC([N@H+](C)Cc2ccc(OC)c3ccccc23)CC1 ZINC000510449839 1023597426 /nfs/dbraw/zinc/59/74/26/1023597426.db2.gz PBQOROZWXFICJE-UHFFFAOYSA-N 2 0 326.484 4.155 20 0 EIADRP CC[C@H](Cc1cccs1)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000684410403 1023660511 /nfs/dbraw/zinc/66/05/11/1023660511.db2.gz XPGGXCXUAWJJDX-RBUKOAKNSA-N 2 0 328.525 4.181 20 0 EIADRP FC1(F)CCC([NH2+]CC2CC[NH+](Cc3cccs3)CC2)CC1 ZINC000647176872 1023668883 /nfs/dbraw/zinc/66/88/83/1023668883.db2.gz BWBPAFBHLOQKPD-UHFFFAOYSA-N 2 0 328.472 4.128 20 0 EIADRP C[C@@H](N[C@@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1ccc(F)cn1 ZINC000390564570 1023682213 /nfs/dbraw/zinc/68/22/13/1023682213.db2.gz ALDANMRGYVSNQA-OXQOHEQNSA-N 2 0 341.474 4.172 20 0 EIADRP CC[C@@H](c1ccccc1F)[N@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000377688605 1023687690 /nfs/dbraw/zinc/68/76/90/1023687690.db2.gz ACOOSTXBSHGQQG-YYWHXJBOSA-N 2 0 341.474 4.297 20 0 EIADRP Cc1c(Br)cccc1C[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000925702619 1023868035 /nfs/dbraw/zinc/86/80/35/1023868035.db2.gz PIKUQPZGRVLPHK-GOSISDBHSA-N 2 0 347.300 4.327 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(Br)cc1 ZINC000130244938 1023932558 /nfs/dbraw/zinc/93/25/58/1023932558.db2.gz TXOITUSPGAUTNC-ZACQAIPSSA-N 2 0 337.305 4.117 20 0 EIADRP COCC[C@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2ccccc2)CC1 ZINC000660677822 1024013743 /nfs/dbraw/zinc/01/37/43/1024013743.db2.gz PJVIUZJXKRQJNP-JOCHJYFZSA-N 2 0 338.495 4.018 20 0 EIADRP c1c2cnccc2oc1C[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000651692486 1024217989 /nfs/dbraw/zinc/21/79/89/1024217989.db2.gz HMBTXGXQFUMTAM-UHFFFAOYSA-N 2 0 349.478 4.494 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000510735405 1024371317 /nfs/dbraw/zinc/37/13/17/1024371317.db2.gz ONUHUSMTAVQWHW-FHLIZLRMSA-N 2 0 340.433 4.243 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)c1 ZINC000341758965 1024617195 /nfs/dbraw/zinc/61/71/95/1024617195.db2.gz ROAYUYBMACRIBR-IBGZPJMESA-N 2 0 344.886 4.405 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2CCCOc3cc(Cl)ccc32)cc1 ZINC000341761283 1024628863 /nfs/dbraw/zinc/62/88/63/1024628863.db2.gz QAAQUVIPZMKFCJ-IBGZPJMESA-N 2 0 344.886 4.405 20 0 EIADRP C[C@H](c1cccc2ccccc21)[N@@H+]1CCC[C@H]([C@@H]2C[C@H]([NH3+])CCO2)C1 ZINC000652347475 1024699843 /nfs/dbraw/zinc/69/98/43/1024699843.db2.gz BLQMXDKCZYWXMM-TXXUCJGISA-N 2 0 338.495 4.119 20 0 EIADRP CS[C@@H]1CCC[C@H]([NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000548483979 1024831459 /nfs/dbraw/zinc/83/14/59/1024831459.db2.gz RGRSLFXTVNAJIW-FRYIKTPZSA-N 2 0 332.557 4.161 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@@H](C[NH2+][C@H]3CCCNc4ccccc43)C2)cc1 ZINC000249059200 1024875607 /nfs/dbraw/zinc/87/56/07/1024875607.db2.gz ZLRGILIFJDQZNB-REWPJTCUSA-N 2 0 349.522 4.088 20 0 EIADRP c1ccc(C[N@H+]2CCC[C@@H](C[NH2+][C@@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000684611407 1025056904 /nfs/dbraw/zinc/05/69/04/1025056904.db2.gz GLMNPPYBBXFDNC-NZQKXSOJSA-N 2 0 349.522 4.425 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2csc(-c3ccsc3)n2)[C@@H]1CCC[NH3+] ZINC000662313011 1025061865 /nfs/dbraw/zinc/06/18/65/1025061865.db2.gz JLZCKDYPRSNKKP-CZUORRHYSA-N 2 0 335.542 4.211 20 0 EIADRP COCC[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)c1ccc(Cl)c(Cl)c1 ZINC000342056375 1025078892 /nfs/dbraw/zinc/07/88/92/1025078892.db2.gz HOIVARJXZMWINM-WMLDXEAASA-N 2 0 345.314 4.145 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]CCCc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000684613739 1025087417 /nfs/dbraw/zinc/08/74/17/1025087417.db2.gz KWQZEZWWMMSKHA-SUMWQHHRSA-N 2 0 329.315 4.246 20 0 EIADRP Clc1ccc2c(c1Cl)OCCC[C@H]2[NH2+]CCCn1ccnc1 ZINC000151126701 1025265077 /nfs/dbraw/zinc/26/50/77/1025265077.db2.gz URNAYTCKQQXJRB-CQSZACIVSA-N 2 0 340.254 4.084 20 0 EIADRP COCC[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)(C)C ZINC000510994272 1025332863 /nfs/dbraw/zinc/33/28/63/1025332863.db2.gz GEZQVOSMCFXMIE-WOZUAGRISA-N 2 0 344.543 4.223 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc(OC(F)F)cc1 ZINC000663467569 1025409254 /nfs/dbraw/zinc/40/92/54/1025409254.db2.gz GTHWSIXCHJANJD-GOEBONIOSA-N 2 0 338.442 4.061 20 0 EIADRP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663470231 1025411884 /nfs/dbraw/zinc/41/18/84/1025411884.db2.gz TWWIHJDOQUGEGP-YOEHRIQHSA-N 2 0 335.561 4.348 20 0 EIADRP Oc1cc(F)cc(C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)c1 ZINC000472033940 1025442969 /nfs/dbraw/zinc/44/29/69/1025442969.db2.gz AZIFFCKIKZFGIV-UHFFFAOYSA-N 2 0 342.458 4.197 20 0 EIADRP CC(C)(C)C[C@H]([NH2+]C[C@@H]1C[NH2+]CCC1(F)F)c1ccc(F)cc1 ZINC000925783890 1025635729 /nfs/dbraw/zinc/63/57/29/1025635729.db2.gz PDAIYRSDIKYCTE-HOCLYGCPSA-N 2 0 328.422 4.137 20 0 EIADRP Cc1cccc2[nH]c(C[NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)cc21 ZINC000657296368 1025756083 /nfs/dbraw/zinc/75/60/83/1025756083.db2.gz GSIIWUOTVBIQSJ-UHFFFAOYSA-N 2 0 333.479 4.362 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000512030523 1025800157 /nfs/dbraw/zinc/80/01/57/1025800157.db2.gz JFLVGWIEKNVPOZ-PDGQHHTCSA-N 2 0 338.495 4.088 20 0 EIADRP C[C@H]([NH2+][C@@H](c1cccc(Cl)c1)c1ccccn1)C1CC[NH+](C)CC1 ZINC000124639915 1025830040 /nfs/dbraw/zinc/83/00/40/1025830040.db2.gz UMSWXEJLZLHECM-YWZLYKJASA-N 2 0 343.902 4.144 20 0 EIADRP Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000663598590 1025834321 /nfs/dbraw/zinc/83/43/21/1025834321.db2.gz XETBMLFWKIUUBR-HNNXBMFYSA-N 2 0 327.472 4.128 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001167836223 1025846164 /nfs/dbraw/zinc/84/61/64/1025846164.db2.gz XUJIZKVZKPHALS-IBGZPJMESA-N 3 0 337.596 4.226 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc(OCc2cccc(F)c2)cc1 ZINC000415014886 1025856253 /nfs/dbraw/zinc/85/62/53/1025856253.db2.gz NMJRNSOWTZZKEQ-MRXNPFEDSA-N 2 0 330.447 4.012 20 0 EIADRP CC[N@H+](CCC1CC[NH+](C2CC(OC(C)(C)C)C2)CC1)CC(C)C ZINC000450655428 1025867822 /nfs/dbraw/zinc/86/78/22/1025867822.db2.gz XDLMWKVFFFSVKJ-UHFFFAOYSA-N 2 0 338.580 4.413 20 0 EIADRP Cc1cc([C@H](C)[NH2+]CCC2CC[NH+](C)CC2)sc1Br ZINC000512071973 1025880870 /nfs/dbraw/zinc/88/08/70/1025880870.db2.gz MIEAKUOBNIIOIT-LBPRGKRZSA-N 2 0 345.350 4.202 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(Cc2cccc(OC)c2)CC1 ZINC001167841366 1025882763 /nfs/dbraw/zinc/88/27/63/1025882763.db2.gz LMAWZFZRHFXBIR-LJQANCHMSA-N 2 0 346.559 4.460 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@@H](Cc2cccc(OC)c2)C1 ZINC001167841620 1025886931 /nfs/dbraw/zinc/88/69/31/1025886931.db2.gz NEKYNVCMKZZVFX-CTNGQTDRSA-N 2 0 346.559 4.460 20 0 EIADRP CCC[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccsc1 ZINC000187766250 1025890660 /nfs/dbraw/zinc/89/06/60/1025890660.db2.gz HYQYIAKVDWYVCZ-IBGZPJMESA-N 2 0 329.513 4.491 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cccc(F)c1 ZINC000187789279 1025902870 /nfs/dbraw/zinc/90/28/70/1025902870.db2.gz UXDYDHMUIKZVNW-FQEVSTJZSA-N 2 0 330.447 4.007 20 0 EIADRP Clc1ccc2c(c1)C[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3CC1CC1)CC2 ZINC001167969823 1026029807 /nfs/dbraw/zinc/02/98/07/1026029807.db2.gz FDJXMIGJBSBOMY-WVVQBRDUSA-N 2 0 344.930 4.192 20 0 EIADRP CC(C)(Cc1ccccc1F)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167969935 1026042376 /nfs/dbraw/zinc/04/23/76/1026042376.db2.gz IEXBTMLNQOOYGS-YQQQUEKLSA-N 2 0 330.491 4.142 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H]2CCCc3ccc(F)cc32)ccc1F ZINC000344163413 1026083444 /nfs/dbraw/zinc/08/34/44/1026083444.db2.gz HRNDOIKGEYVAJW-HXUWFJFHSA-N 2 0 330.422 4.194 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(Cn2ccnc2)cc1)c1cc(F)cc(F)c1 ZINC000152108973 1026098109 /nfs/dbraw/zinc/09/81/09/1026098109.db2.gz LVHFXMVKMVAVEU-AWEZNQCLSA-N 2 0 327.378 4.060 20 0 EIADRP Cc1ccc2c(CC[NH2+]Cc3cc(-n4ccnc4)cs3)c[nH]c2c1 ZINC000344239041 1026172366 /nfs/dbraw/zinc/17/23/66/1026172366.db2.gz QELKJNWAOWZEND-UHFFFAOYSA-N 2 0 336.464 4.056 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1 ZINC000582122905 1026207372 /nfs/dbraw/zinc/20/73/72/1026207372.db2.gz OAVLPNBFANOILI-SFHVURJKSA-N 2 0 334.385 4.405 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)C[C@H](C)O1 ZINC000582281733 1026406591 /nfs/dbraw/zinc/40/65/91/1026406591.db2.gz ARHVBKQPPZOFOG-RMFSNUHRSA-N 2 0 330.516 4.108 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cccc(-c3cccnc3)c2)CC1 ZINC000506861624 1026478162 /nfs/dbraw/zinc/47/81/62/1026478162.db2.gz LWPPXCMYWXNQCU-UHFFFAOYSA-N 2 0 337.511 4.302 20 0 EIADRP CCCOc1ccc([C@@H](C)[NH2+]C2CCC([NH3+])CC2)cc1OCCC ZINC000261609880 1026695838 /nfs/dbraw/zinc/69/58/38/1026695838.db2.gz DMQMBEJEVCVDMV-FAEJEUNOSA-N 2 0 334.504 4.185 20 0 EIADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511148323 1026751087 /nfs/dbraw/zinc/75/10/87/1026751087.db2.gz XOKFCLNKPINFAN-SJLPKXTDSA-N 2 0 340.433 4.369 20 0 EIADRP CC[C@@H]1C[C@@]1([NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C)c1cccc(C)c1 ZINC000500493363 1026793385 /nfs/dbraw/zinc/79/33/85/1026793385.db2.gz YAASJKYNYHQDQY-KNQAVFIVSA-N 2 0 346.478 4.299 20 0 EIADRP CC(C)Oc1ccc([C@H]2CCC[C@H]2[NH2+]CC2(C)CC[NH+](C)CC2)cc1 ZINC000507452881 1026799106 /nfs/dbraw/zinc/79/91/06/1026799106.db2.gz YNGSAWSXKFWHSF-NHCUHLMSSA-N 2 0 344.543 4.431 20 0 EIADRP c1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH2+][C@H](c4cccnc4)C4CC4)[C@@H]3C2)cc1 ZINC000507463485 1026804628 /nfs/dbraw/zinc/80/46/28/1026804628.db2.gz UCGSBTBJCOGUAY-BJESRGMDSA-N 2 0 347.506 4.033 20 0 EIADRP CCCOc1ccc(C[NH2+][C@@H]2CCN(C)[C@@H](c3ccccc3)C2)cc1 ZINC000582560156 1026805620 /nfs/dbraw/zinc/80/56/20/1026805620.db2.gz CWFFKGAYMQIECV-IFMALSPDSA-N 2 0 338.495 4.401 20 0 EIADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(SCC(F)F)cc1 ZINC000507476217 1026808658 /nfs/dbraw/zinc/80/86/58/1026808658.db2.gz JJDBWBOZMLZAKP-AWEZNQCLSA-N 2 0 342.499 4.426 20 0 EIADRP CCc1cnccc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12 ZINC000507498292 1026812906 /nfs/dbraw/zinc/81/29/06/1026812906.db2.gz UXBRHBDLRBXQHR-RMVZNSSTSA-N 2 0 349.522 4.205 20 0 EIADRP CCc1cnccc1[C@H](C)[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000507498291 1026813150 /nfs/dbraw/zinc/81/31/50/1026813150.db2.gz UXBRHBDLRBXQHR-RBQRNVLBSA-N 2 0 349.522 4.205 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)[C@@H]1CCCOC1 ZINC000507513045 1026822860 /nfs/dbraw/zinc/82/28/60/1026822860.db2.gz QNKHQFOOXBDKMS-VQQMMKBISA-N 2 0 344.543 4.069 20 0 EIADRP CCSCC[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12 ZINC000507532122 1026828686 /nfs/dbraw/zinc/82/86/86/1026828686.db2.gz RKMVCTMSPFKVBF-OJAHFUOMSA-N 2 0 332.557 4.018 20 0 EIADRP CCSCC[C@H](C)[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000507531757 1026829003 /nfs/dbraw/zinc/82/90/03/1026829003.db2.gz RKMVCTMSPFKVBF-IJXRJRJASA-N 2 0 332.557 4.018 20 0 EIADRP CCSCC[C@H](C)[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000507531755 1026829332 /nfs/dbraw/zinc/82/93/32/1026829332.db2.gz RKMVCTMSPFKVBF-FRYIKTPZSA-N 2 0 332.557 4.018 20 0 EIADRP Cc1ccccc1SC[C@@H](C)C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC001167599045 1026943033 /nfs/dbraw/zinc/94/30/33/1026943033.db2.gz NWSPWVTUTKYFDW-PXNSSMCTSA-N 2 0 346.584 4.387 20 0 EIADRP Cc1ccccc1SC[C@H](C)C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC001167599046 1026943191 /nfs/dbraw/zinc/94/31/91/1026943191.db2.gz NWSPWVTUTKYFDW-XLIONFOSSA-N 2 0 346.584 4.387 20 0 EIADRP Cc1ncsc1CC[NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168035739 1027111172 /nfs/dbraw/zinc/11/11/72/1027111172.db2.gz USSNKFGBUAGNNF-HOTGVXAUSA-N 2 0 343.540 4.025 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000474481251 1027117229 /nfs/dbraw/zinc/11/72/29/1027117229.db2.gz VZASRZINIPMTEZ-MOPGFXCFSA-N 2 0 332.532 4.289 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)C1CCOCC1 ZINC000474484332 1027118864 /nfs/dbraw/zinc/11/88/64/1027118864.db2.gz HXOKRCNVJMDSJM-QRVBRYPASA-N 2 0 344.543 4.069 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)C1CCOCC1 ZINC000474483449 1027120227 /nfs/dbraw/zinc/12/02/27/1027120227.db2.gz AAALBMQDAJBZBG-QRVBRYPASA-N 2 0 344.543 4.069 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+]CCCCc2ccc(Cl)c(Cl)c2)C1 ZINC000474484969 1027122840 /nfs/dbraw/zinc/12/28/40/1027122840.db2.gz BWUCKXSDKXVMCA-HNNXBMFYSA-N 2 0 329.315 4.248 20 0 EIADRP COc1ccc([C@H](CNc2cc[nH+]c(C)c2)[NH+]2CCCCC2)cc1 ZINC000302213340 1027261811 /nfs/dbraw/zinc/26/18/11/1027261811.db2.gz FMLCNCMDYUMFQA-FQEVSTJZSA-N 2 0 325.456 4.038 20 0 EIADRP CS[C@H]1CCCC[NH+](CC(C)C[N@H+]2CCCC[C@H](SC)C2)C1 ZINC000441136045 1027301244 /nfs/dbraw/zinc/30/12/44/1027301244.db2.gz UXTYYTNSAHFJQD-ROUUACIJSA-N 2 0 344.634 4.058 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000474628559 1027336428 /nfs/dbraw/zinc/33/64/28/1027336428.db2.gz LBXKIXAXRKKFOX-LJISPDSOSA-N 2 0 326.937 4.215 20 0 EIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1 ZINC000474812439 1027535296 /nfs/dbraw/zinc/53/52/96/1027535296.db2.gz DLGLOJSPEFFUFJ-HOTGVXAUSA-N 2 0 344.474 4.178 20 0 EIADRP CO[C@@]1(C)CCC[N@H+](CC(C)(C)C[NH+](C)Cc2ccccc2)CC1 ZINC000475552717 1027591732 /nfs/dbraw/zinc/59/17/32/1027591732.db2.gz DFGWHBQNNFBYNC-NRFANRHFSA-N 2 0 332.532 4.036 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1cncs1 ZINC000121045800 1027660828 /nfs/dbraw/zinc/66/08/28/1027660828.db2.gz NXTCJCGPUISBJW-INIZCTEOSA-N 2 0 329.513 4.226 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475576787 1027696050 /nfs/dbraw/zinc/69/60/50/1027696050.db2.gz XQMFDLTWTWGIET-NNGSBXSVSA-N 2 0 340.433 4.243 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000150769390 1028051786 /nfs/dbraw/zinc/05/17/86/1028051786.db2.gz WKDZRVQOBNPRSP-HUUCEWRRSA-N 2 0 326.406 4.184 20 0 EIADRP Cc1ccc2cc(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)ccc2n1 ZINC000189370734 1028128548 /nfs/dbraw/zinc/12/85/48/1028128548.db2.gz PLYVHTJABKBDHN-UHFFFAOYSA-N 2 0 337.511 4.430 20 0 EIADRP CSCC1CCC([NH2+]C2CCN(CCc3ccccc3)CC2)CC1 ZINC000395342839 1028170636 /nfs/dbraw/zinc/17/06/36/1028170636.db2.gz CKBFHCFJOGUZRC-UHFFFAOYSA-N 2 0 346.584 4.205 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH+]1CCC(c2ccccc2C)CC1 ZINC000346142079 1028278874 /nfs/dbraw/zinc/27/88/74/1028278874.db2.gz OLKXGBXFFFWTDV-UHFFFAOYSA-N 2 0 346.478 4.264 20 0 EIADRP FC(F)(F)c1ccc([C@H]2C[C@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)C2)cc1 ZINC000280963618 1028312184 /nfs/dbraw/zinc/31/21/84/1028312184.db2.gz ZGTUYTMNSFGFMK-DDBAPUKQSA-N 2 0 338.417 4.168 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000346216063 1028316083 /nfs/dbraw/zinc/31/60/83/1028316083.db2.gz QTBIIKMEEDBLCQ-HXUWFJFHSA-N 2 0 336.414 4.052 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](Cc1ccccc1)[C@@H](C)C1CC1 ZINC000346225045 1028333886 /nfs/dbraw/zinc/33/38/86/1028333886.db2.gz VNBFPQDQCMTRRJ-SFHVURJKSA-N 2 0 346.478 4.376 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C(C)(C)C)cc2)[C@@H](C)C1 ZINC000523733320 1028342287 /nfs/dbraw/zinc/34/22/87/1028342287.db2.gz VVRWNXYVOJKGRP-GHTZIAJQSA-N 2 0 346.559 4.211 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@H]1/C=C/c1ccccc1 ZINC000346350243 1028385790 /nfs/dbraw/zinc/38/57/90/1028385790.db2.gz JTRFTWXYTDLOFE-LCCNJJIFSA-N 2 0 344.462 4.254 20 0 EIADRP COc1cc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)ccc1SC ZINC000125918147 1028496102 /nfs/dbraw/zinc/49/61/02/1028496102.db2.gz DHNDXJXUWVLVFG-JKSUJKDBSA-N 2 0 336.545 4.188 20 0 EIADRP Cc1ncncc1[C@@H](C)[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000574890429 1028653201 /nfs/dbraw/zinc/65/32/01/1028653201.db2.gz YYAGMMWPZPDGIV-QGZVFWFLSA-N 2 0 338.499 4.012 20 0 EIADRP Cc1ccc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1Cl ZINC000443997596 1028719378 /nfs/dbraw/zinc/71/93/78/1028719378.db2.gz NENWPOQRYJSEGZ-UHFFFAOYSA-N 2 0 329.875 4.050 20 0 EIADRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc2ccccc2c1OC(F)F ZINC000650743517 1029054273 /nfs/dbraw/zinc/05/42/73/1029054273.db2.gz VJFQRYSNTOVINR-ZDUSSCGKSA-N 2 0 334.410 4.221 20 0 EIADRP CSc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)s1 ZINC000583722352 1029090271 /nfs/dbraw/zinc/09/02/71/1029090271.db2.gz SMGRENMHQJOJAJ-UHFFFAOYSA-N 2 0 332.538 4.356 20 0 EIADRP Cc1nc(F)ccc1C[NH2+]Cc1ccccc1C[N@H+]1CCC[C@H](C)C1 ZINC000278396765 1029101239 /nfs/dbraw/zinc/10/12/39/1029101239.db2.gz NDTVDHNOTOLAGP-INIZCTEOSA-N 2 0 341.474 4.051 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CNc3ccccc3C2)CC1 ZINC000650749562 1029111613 /nfs/dbraw/zinc/11/16/13/1029111613.db2.gz PXMVNOZYPUPPAG-ATKRNPRHSA-N 2 0 349.522 4.056 20 0 EIADRP C[C@@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1ccc(OC(F)F)cc1 ZINC000522973585 1029138832 /nfs/dbraw/zinc/13/88/32/1029138832.db2.gz BRQKXHXEUKHIBU-CZUORRHYSA-N 2 0 328.447 4.305 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)[C@H](C)c1nc2ccccc2s1 ZINC000650753087 1029148368 /nfs/dbraw/zinc/14/83/68/1029148368.db2.gz GJMMVIMYLKZWAJ-STQMWFEESA-N 2 0 343.471 4.176 20 0 EIADRP COc1ccccc1[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)C1CCCC1 ZINC000650754649 1029176804 /nfs/dbraw/zinc/17/68/04/1029176804.db2.gz NPOAVSJRDPHMNP-OAQYLSRUSA-N 2 0 342.458 4.314 20 0 EIADRP CCc1cccc(Cl)c1C[N@@H+]1CCC[C@@H](Cc2nccn2C)C1 ZINC000475089051 1029234324 /nfs/dbraw/zinc/23/43/24/1029234324.db2.gz NQNQTXGQINBMIK-HNNXBMFYSA-N 2 0 331.891 4.091 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CCC1CC[NH2+]CC1 ZINC000650763926 1029276529 /nfs/dbraw/zinc/27/65/29/1029276529.db2.gz MHVKMPJPOXIEBR-HNNXBMFYSA-N 2 0 343.540 4.083 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CCC1CC[NH2+]CC1 ZINC000650764343 1029280622 /nfs/dbraw/zinc/28/06/22/1029280622.db2.gz WLQKPKXCUXGRFR-CQSZACIVSA-N 2 0 328.422 4.006 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(Cl)c(N)c(Cl)c1 ZINC000278468792 1029294353 /nfs/dbraw/zinc/29/43/53/1029294353.db2.gz NLSPASUCDHZKAA-LLVKDONJSA-N 2 0 342.314 4.101 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)CCS2 ZINC000343493598 1029357379 /nfs/dbraw/zinc/35/73/79/1029357379.db2.gz DCBDPCXJCHHLIS-VQIMIIECSA-N 2 0 348.556 4.476 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@]3(CC3(F)F)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168058834 1029376510 /nfs/dbraw/zinc/37/65/10/1029376510.db2.gz CPEDYAHEHKEJCY-NBMJBFSESA-N 2 0 334.454 4.159 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ncc(-c3ccccc3F)o2)CC1 ZINC000525126679 1029467048 /nfs/dbraw/zinc/46/70/48/1029467048.db2.gz JIHKWDAXDLXUGW-UHFFFAOYSA-N 2 0 345.462 4.033 20 0 EIADRP C[C@@H]1C[C@H](NCc2cc(Cl)ccc2OC2CCCC2)CC[N@@H+]1C ZINC000525207851 1029514650 /nfs/dbraw/zinc/51/46/50/1029514650.db2.gz RFDBKVYVIQJXKK-RHSMWYFYSA-N 2 0 336.907 4.234 20 0 EIADRP C[C@@H]1CC([N@@H+]2CC[C@@H](C(F)(F)F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168061380 1029541312 /nfs/dbraw/zinc/54/13/12/1029541312.db2.gz IFESMEYCIUAQKE-BFYDXBDKSA-N 2 0 340.433 4.312 20 0 EIADRP CCO[C@H](C[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)c1ccccc1 ZINC000446838153 1029600052 /nfs/dbraw/zinc/60/00/52/1029600052.db2.gz FONBMHIUMUCABB-BVYCBKJFSA-N 2 0 344.543 4.397 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CCCc2cccc(C(F)(F)F)c2)CC1(C)C ZINC000623377635 1029605215 /nfs/dbraw/zinc/60/52/15/1029605215.db2.gz DJVMMLADFFFEBO-INIZCTEOSA-N 2 0 328.422 4.100 20 0 EIADRP COCC[N@H+](C)CCCC1CC[NH+](Cc2ccc3occc3c2)CC1 ZINC000584105551 1029624009 /nfs/dbraw/zinc/62/40/09/1029624009.db2.gz DZECDCNGRLJKPX-UHFFFAOYSA-N 2 0 344.499 4.003 20 0 EIADRP FC(F)(F)c1cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)ccc1Cl ZINC000446883523 1029630881 /nfs/dbraw/zinc/63/08/81/1029630881.db2.gz KPNRFXFGTPEWNG-UHFFFAOYSA-N 2 0 346.824 4.323 20 0 EIADRP Cc1cc(F)ccc1-c1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)o1 ZINC000446886403 1029631825 /nfs/dbraw/zinc/63/18/25/1029631825.db2.gz GGPCFOVECSZAFG-UHFFFAOYSA-N 2 0 342.458 4.358 20 0 EIADRP C[NH2+]Cc1cccc(NC2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC001168065249 1029646983 /nfs/dbraw/zinc/64/69/83/1029646983.db2.gz VEXHEPXBITZBLO-ROUUACIJSA-N 2 0 337.511 4.260 20 0 EIADRP CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]CCc1cn2c(n1)CCCC2 ZINC000657834029 1029667497 /nfs/dbraw/zinc/66/74/97/1029667497.db2.gz IIBYNDLIIWWEEQ-KRWDZBQOSA-N 2 0 331.891 4.026 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(C(F)F)nc1 ZINC000657838546 1029721729 /nfs/dbraw/zinc/72/17/29/1029721729.db2.gz VOJBHEFZJPIAHQ-HUUCEWRRSA-N 2 0 325.447 4.324 20 0 EIADRP Cc1cc(C)c(C[NH2+]C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1C ZINC000708511636 1029742819 /nfs/dbraw/zinc/74/28/19/1029742819.db2.gz DYLZFMPNCLCKFL-NZQKXSOJSA-N 2 0 336.523 4.470 20 0 EIADRP Cc1cc(C)c(C[NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1C ZINC000708511638 1029743275 /nfs/dbraw/zinc/74/32/75/1029743275.db2.gz DYLZFMPNCLCKFL-REWPJTCUSA-N 2 0 336.523 4.470 20 0 EIADRP Cc1cc(C)c(C[NH2+]C[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]2C)cc1C ZINC000708511637 1029743594 /nfs/dbraw/zinc/74/35/94/1029743594.db2.gz DYLZFMPNCLCKFL-OFNKIYASSA-N 2 0 336.523 4.470 20 0 EIADRP CCOc1ccccc1[C@H](C)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000089215732 1029846902 /nfs/dbraw/zinc/84/69/02/1029846902.db2.gz SLTPFIHFHWTJJL-KRWDZBQOSA-N 2 0 339.483 4.048 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](c1cccnc1)C(C)C ZINC000091267502 1029882383 /nfs/dbraw/zinc/88/23/83/1029882383.db2.gz AYBHOYDVJADNOQ-NRFANRHFSA-N 2 0 325.500 4.410 20 0 EIADRP CC(C)[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1cccnc1 ZINC000091313435 1029883421 /nfs/dbraw/zinc/88/34/21/1029883421.db2.gz GHCBPUHUQXJASE-FQEVSTJZSA-N 2 0 343.540 4.342 20 0 EIADRP CC(C)[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1cccnc1 ZINC000091313439 1029883789 /nfs/dbraw/zinc/88/37/89/1029883789.db2.gz GHCBPUHUQXJASE-HXUWFJFHSA-N 2 0 343.540 4.342 20 0 EIADRP Cc1cc(F)ccc1-c1ccc(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)o1 ZINC000092072515 1029899210 /nfs/dbraw/zinc/89/92/10/1029899210.db2.gz ZPQHQZNHRNACNO-HNNXBMFYSA-N 2 0 339.414 4.497 20 0 EIADRP Cc1cc(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)ccc1Oc1cccnc1 ZINC000092072959 1029899773 /nfs/dbraw/zinc/89/97/73/1029899773.db2.gz SQRBVBWPQOOVLG-SFHVURJKSA-N 2 0 348.450 4.285 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccc(F)cn1 ZINC000092720864 1029930186 /nfs/dbraw/zinc/93/01/86/1029930186.db2.gz IKVFNZDNGHBANK-INIZCTEOSA-N 2 0 327.447 4.057 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCSc2ccccc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183183497 1029987026 /nfs/dbraw/zinc/98/70/26/1029987026.db2.gz UDTWLPJFSYPALN-GPMSIDNRSA-N 2 0 330.541 4.466 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccccc1Br ZINC000171126601 1030061965 /nfs/dbraw/zinc/06/19/65/1030061965.db2.gz TVJNBSYJDZKIKQ-CQSZACIVSA-N 2 0 347.300 4.362 20 0 EIADRP C[C@@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]CC1CC[NH+](C)CC1 ZINC000657871131 1030077120 /nfs/dbraw/zinc/07/71/20/1030077120.db2.gz HMPMPNZILCUTEE-LBPRGKRZSA-N 2 0 348.840 4.221 20 0 EIADRP CC1CC[NH+](Cc2cccc(C[NH2+]C3CC(CF)(CF)C3)c2)CC1 ZINC000657872920 1030107217 /nfs/dbraw/zinc/10/72/17/1030107217.db2.gz QHTNLECNEYJVKS-UHFFFAOYSA-N 2 0 336.470 4.096 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H](C)c1cc(C)oc1C ZINC000447545036 1030151972 /nfs/dbraw/zinc/15/19/72/1030151972.db2.gz QLJSIGNNODBBSL-QGZVFWFLSA-N 2 0 344.499 4.468 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CCCS2 ZINC000447569195 1030153703 /nfs/dbraw/zinc/15/37/03/1030153703.db2.gz BCRWADDXJDFKCE-LJQANCHMSA-N 2 0 346.540 4.086 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(Br)c(Cl)c1 ZINC000657877300 1030154153 /nfs/dbraw/zinc/15/41/53/1030154153.db2.gz PUYOODWCPKWMGA-RYUDHWBXSA-N 2 0 345.712 4.095 20 0 EIADRP CC(C)[C@@H](CSc1ccccc1)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447571347 1030157001 /nfs/dbraw/zinc/15/70/01/1030157001.db2.gz JWIGFXWMRVKDNW-HXUWFJFHSA-N 2 0 332.557 4.267 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cccc(OC(F)(F)F)c1 ZINC000447557018 1030168944 /nfs/dbraw/zinc/16/89/44/1030168944.db2.gz KFPYHLQHUHOUER-ZDUSSCGKSA-N 2 0 342.405 4.110 20 0 EIADRP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)c1 ZINC000447561106 1030172608 /nfs/dbraw/zinc/17/26/08/1030172608.db2.gz WNQVHNBFVYJFKO-CQSZACIVSA-N 2 0 338.442 4.121 20 0 EIADRP Cc1cc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)cc(C(F)(F)F)c1 ZINC001143457330 1030181320 /nfs/dbraw/zinc/18/13/20/1030181320.db2.gz GPWCJCYEVXFKME-UHFFFAOYSA-N 2 0 340.433 4.322 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(C(F)F)nc1 ZINC000657884148 1030183539 /nfs/dbraw/zinc/18/35/39/1030183539.db2.gz LCHJYOFIJHZSIO-LBPRGKRZSA-N 2 0 337.389 4.071 20 0 EIADRP CCc1cnccc1[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447579678 1030206657 /nfs/dbraw/zinc/20/66/57/1030206657.db2.gz LIYQORLFAAVAOQ-HLRQEUIKSA-N 2 0 349.522 4.490 20 0 EIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3cc(F)cc(C(F)(F)F)c3)C2)CC1 ZINC000685463174 1030342175 /nfs/dbraw/zinc/34/21/75/1030342175.db2.gz XDZAADOWVRDWDS-HNNXBMFYSA-N 2 0 344.396 4.008 20 0 EIADRP C[C@@H](NC1CC[NH+](CC2CC2)CC1)c1ccc(Br)s1 ZINC000527197316 1030563365 /nfs/dbraw/zinc/56/33/65/1030563365.db2.gz OXJSUDRTNVKMNW-LLVKDONJSA-N 2 0 343.334 4.036 20 0 EIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3ccc(F)c(F)c3)CC2)C1 ZINC000527291165 1030616307 /nfs/dbraw/zinc/61/63/07/1030616307.db2.gz RAZJNCDDQSBPLZ-YJBOKZPZSA-N 2 0 336.470 4.140 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000527348870 1030636122 /nfs/dbraw/zinc/63/61/22/1030636122.db2.gz BSHMWCCXLXWXSK-RTWAWAEBSA-N 2 0 338.495 4.053 20 0 EIADRP C[C@@H](N[C@@H](C)c1cc2cnccc2o1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000657968525 1030711565 /nfs/dbraw/zinc/71/15/65/1030711565.db2.gz AVYDFSDXBNKYKE-PMPSAXMXSA-N 2 0 327.472 4.131 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)[C@@H](C)C1CCCCC1 ZINC000658066997 1030812718 /nfs/dbraw/zinc/81/27/18/1030812718.db2.gz JHHIDCNEAXLQAT-QZTJIDSGSA-N 2 0 336.564 4.072 20 0 EIADRP C[C@H]1CC[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)c2sccc21 ZINC000658069522 1030816180 /nfs/dbraw/zinc/81/61/80/1030816180.db2.gz GNFZVGVGUFBMSK-HNAYVOBHSA-N 2 0 348.556 4.167 20 0 EIADRP C[C@@H](Cc1ccc(Cl)cc1)[NH+]1CCC(C2CC[NH+](C)CC2)CC1 ZINC001168181043 1030818622 /nfs/dbraw/zinc/81/86/22/1030818622.db2.gz WNNPRGYDQSQTGL-INIZCTEOSA-N 2 0 334.935 4.325 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2cc3cc(Cl)cnc3o2)CC1 ZINC000648424308 1030855258 /nfs/dbraw/zinc/85/52/58/1030855258.db2.gz XAMKEGYQNKFHKG-UHFFFAOYSA-N 2 0 335.879 4.083 20 0 EIADRP Cc1cccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1C ZINC000658167398 1030864819 /nfs/dbraw/zinc/86/48/19/1030864819.db2.gz RVVGYRVZEPLCCK-IBGZPJMESA-N 2 0 337.511 4.261 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cccc(F)c1 ZINC000658168754 1030864963 /nfs/dbraw/zinc/86/49/63/1030864963.db2.gz YKDALUAJNGAPQJ-OAQYLSRUSA-N 2 0 341.474 4.174 20 0 EIADRP c1ccc([C@H](C[C@@H]2CCOC2)[NH2+]CCCCC[NH+]2CCCCC2)cc1 ZINC000166595096 1030888744 /nfs/dbraw/zinc/88/87/44/1030888744.db2.gz VMAXPOIJGGTOKK-UNMCSNQZSA-N 2 0 344.543 4.400 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCN1C1CCCCC1)c1cnc2ccsc2c1 ZINC000527949020 1030965581 /nfs/dbraw/zinc/96/55/81/1030965581.db2.gz NQICBPAWJMESSN-WMLDXEAASA-N 2 0 329.513 4.354 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c(C)c1 ZINC000532485412 1031215532 /nfs/dbraw/zinc/21/55/32/1031215532.db2.gz JJKXURQIEVWGFM-LJQANCHMSA-N 2 0 340.511 4.485 20 0 EIADRP C[C@@H](CCc1ccco1)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449059244 1031390524 /nfs/dbraw/zinc/39/05/24/1031390524.db2.gz PDRWXWFVJPCYFN-OALUTQOASA-N 2 0 340.511 4.286 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCOC2(CCC2)C1 ZINC000449084227 1031411526 /nfs/dbraw/zinc/41/15/26/1031411526.db2.gz XABGBPIYMUBUKX-RXVVDRJESA-N 2 0 342.527 4.252 20 0 EIADRP Cc1nc(CC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cs1 ZINC000449070284 1031423422 /nfs/dbraw/zinc/42/34/22/1031423422.db2.gz BWUYJKCKQGRJKI-UHFFFAOYSA-N 2 0 337.577 4.263 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000532626172 1031443203 /nfs/dbraw/zinc/44/32/03/1031443203.db2.gz MCVBXDINYMBSLK-IRXDYDNUSA-N 2 0 343.540 4.350 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)c1 ZINC000449131134 1031466487 /nfs/dbraw/zinc/46/64/87/1031466487.db2.gz KHIGTBUXYXMVDT-KRWDZBQOSA-N 2 0 348.412 4.333 20 0 EIADRP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000531715398 1031502011 /nfs/dbraw/zinc/50/20/11/1031502011.db2.gz ZOOLAGCFLCYWSC-GOEBONIOSA-N 2 0 326.937 4.142 20 0 EIADRP CCSCC[C@H](C)[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449166131 1031506062 /nfs/dbraw/zinc/50/60/62/1031506062.db2.gz BYARVEZAMCZYJB-ZWKOTPCHSA-N 2 0 334.573 4.203 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C[C@H](CO)c2ccccc2)CC1 ZINC000449168478 1031508329 /nfs/dbraw/zinc/50/83/29/1031508329.db2.gz DMKXHPQTHWWSAL-LJQANCHMSA-N 2 0 346.559 4.031 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC(C)(C)c1ccc(F)cc1Cl ZINC000531718365 1031518885 /nfs/dbraw/zinc/51/88/85/1031518885.db2.gz WNYOXBZCPLLBQG-IIYDPXPESA-N 2 0 326.887 4.075 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+]C2CCC(OC3CCCC3)CC2)cc1F ZINC000449200358 1031543206 /nfs/dbraw/zinc/54/32/06/1031543206.db2.gz DKXSJPZUMZOQBK-UHFFFAOYSA-N 2 0 348.506 4.247 20 0 EIADRP Cc1cnccc1CC[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449202079 1031546449 /nfs/dbraw/zinc/54/64/49/1031546449.db2.gz DZPXYVCDIYOAEN-UHFFFAOYSA-N 2 0 331.548 4.201 20 0 EIADRP COc1cccc2c(C[NH2+]Cc3cccc(C[NH+](C)C)c3)cccc12 ZINC000449218394 1031551299 /nfs/dbraw/zinc/55/12/99/1031551299.db2.gz HWXVVNZZCFEKSR-UHFFFAOYSA-N 2 0 334.463 4.200 20 0 EIADRP Cc1nc2c(n1[C@H]1CC[N@H+](Cc3cccc4ccoc43)C1)CCCC2 ZINC000449265598 1031602444 /nfs/dbraw/zinc/60/24/44/1031602444.db2.gz SEWNUAFVENJNMY-SFHVURJKSA-N 2 0 335.451 4.264 20 0 EIADRP FC(F)(F)CCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000453122749 1031615308 /nfs/dbraw/zinc/61/53/08/1031615308.db2.gz PKDYFHQYRJQBTC-RCCFBDPRSA-N 2 0 340.433 4.362 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H]2[C@H]3Cc4ccccc4[C@@H]23)CC1 ZINC000449325400 1031623273 /nfs/dbraw/zinc/62/32/73/1031623273.db2.gz MLPUSLOGCMFIPC-TXCSNJEZSA-N 2 0 346.518 4.010 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H](C)c1cccc(C2CC2)c1 ZINC000449349093 1031646623 /nfs/dbraw/zinc/64/66/23/1031646623.db2.gz ILWSVQXIZRHVBP-OAHLLOKOSA-N 2 0 332.451 4.304 20 0 EIADRP CC(C)OCCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21 ZINC000453194482 1031701793 /nfs/dbraw/zinc/70/17/93/1031701793.db2.gz NNTVXDIWILJMOG-VSKRKVRLSA-N 2 0 344.543 4.224 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21)C(F)(F)F ZINC000453207619 1031719825 /nfs/dbraw/zinc/71/98/25/1031719825.db2.gz WMJQURBRAGWVNG-VDHUWJSZSA-N 2 0 340.433 4.218 20 0 EIADRP FC1(F)CC(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)C1 ZINC000453242256 1031797365 /nfs/dbraw/zinc/79/73/65/1031797365.db2.gz PYGGRXLLNVIYBE-IPMKNSEASA-N 2 0 334.454 4.065 20 0 EIADRP COc1ccc(-c2ccccc2)cc1CNC1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449554129 1031844129 /nfs/dbraw/zinc/84/41/29/1031844129.db2.gz AOWIPWMRMXJFOF-SEJPIABJSA-N 2 0 336.479 4.077 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449561692 1031847639 /nfs/dbraw/zinc/84/76/39/1031847639.db2.gz XHFFIDVNXQQLDE-IAJPZMCFSA-N 2 0 338.417 4.324 20 0 EIADRP Fc1ccc(CC2([NH2+]C3CC[NH+](C4CCCCC4)CC3)CC2)cc1 ZINC000453353174 1031882606 /nfs/dbraw/zinc/88/26/06/1031882606.db2.gz NKROVCGIVCOSCO-UHFFFAOYSA-N 2 0 330.491 4.288 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1cc(Br)ccc1F ZINC000453386205 1031896656 /nfs/dbraw/zinc/89/66/56/1031896656.db2.gz AHVISPUHFOUOBJ-GFCCVEGCSA-N 2 0 343.284 4.113 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1cc(Br)ccc1F ZINC000453386206 1031897139 /nfs/dbraw/zinc/89/71/39/1031897139.db2.gz AHVISPUHFOUOBJ-LBPRGKRZSA-N 2 0 343.284 4.113 20 0 EIADRP COc1ccc([C@H](CCC(C)C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000453363558 1031902223 /nfs/dbraw/zinc/90/22/23/1031902223.db2.gz RRFTVQNVIXLPME-QYYYHEGRSA-N 2 0 330.516 4.387 20 0 EIADRP C[C@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2cccc(Br)c21 ZINC000453366823 1031908663 /nfs/dbraw/zinc/90/86/63/1031908663.db2.gz SWLNWJYQITZZPD-NBAQXMRJSA-N 2 0 349.316 4.212 20 0 EIADRP C[N@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)CC1CCC(F)(F)CC1 ZINC000459360529 1031911781 /nfs/dbraw/zinc/91/17/81/1031911781.db2.gz OPVWCXOHGLPXGV-LJQANCHMSA-N 2 0 336.470 4.266 20 0 EIADRP CCN(c1ccccc1)c1ccc(C[NH2+][C@@H]2CC[N@H+](C)C[C@@H]2C)cc1 ZINC000531980183 1031929047 /nfs/dbraw/zinc/92/90/47/1031929047.db2.gz AOEPSNZGRMTPHM-PGRDOPGGSA-N 2 0 337.511 4.274 20 0 EIADRP Cc1nccn1CCCC[NH+]1CCC(Oc2cc(C)ccc2C)CC1 ZINC000119452513 1031936396 /nfs/dbraw/zinc/93/63/96/1031936396.db2.gz BYTDHHRZMYWHOK-UHFFFAOYSA-N 2 0 341.499 4.132 20 0 EIADRP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000531993866 1031959517 /nfs/dbraw/zinc/95/95/17/1031959517.db2.gz CLAQBNDNXQCGCH-QVKFZJNVSA-N 2 0 330.491 4.446 20 0 EIADRP C[N@H+](CCCC[NH2+][C@@H](c1ccccc1)c1ccc(F)cc1)C1CC1 ZINC000453395880 1031964363 /nfs/dbraw/zinc/96/43/63/1031964363.db2.gz ICQZHQWDPUSDOO-NRFANRHFSA-N 2 0 326.459 4.379 20 0 EIADRP CC[NH+]1CCC(N(C)Cc2ccc(-c3ccccc3)cc2OC)CC1 ZINC000512756439 1033855540 /nfs/dbraw/zinc/85/55/40/1033855540.db2.gz UJWPHFZTRHZUAF-UHFFFAOYSA-N 2 0 338.495 4.278 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ncc(C(F)(F)F)s2)C1 ZINC000433336627 1034253292 /nfs/dbraw/zinc/25/32/92/1034253292.db2.gz WJMMDWJQBGJPDJ-BETUJISGSA-N 2 0 349.466 4.010 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2nccc3ccccc32)c1 ZINC000894191480 1034660168 /nfs/dbraw/zinc/66/01/68/1034660168.db2.gz LULAUAOQZHNCRP-UHFFFAOYSA-N 2 0 333.479 4.366 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC1 ZINC000333321543 1034674147 /nfs/dbraw/zinc/67/41/47/1034674147.db2.gz UNHXPQOGVDXSJT-GPANFISMSA-N 2 0 345.487 4.186 20 0 EIADRP Cc1[nH]c2c(cc(C)cc2C[NH2+]C2CC[NH+](C(C)(C)C)CC2)c1C ZINC000513214789 1034837892 /nfs/dbraw/zinc/83/78/92/1034837892.db2.gz ZZKXXKARJZQUTN-UHFFFAOYSA-N 2 0 327.516 4.446 20 0 EIADRP Cc1nc(C)c(C[NH2+]CC[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)s1 ZINC000513493699 1034984561 /nfs/dbraw/zinc/98/45/61/1034984561.db2.gz CDCMRPVIUGMDNV-DNVCBOLYSA-N 2 0 343.540 4.150 20 0 EIADRP C/C(=C\c1ccc(Cl)cc1)C[NH2+]C[C@@H]1CCCn2cc(C)nc21 ZINC000513526805 1035021545 /nfs/dbraw/zinc/02/15/45/1035021545.db2.gz QFNJNVYAEMNPIM-SHRNQRGKSA-N 2 0 329.875 4.415 20 0 EIADRP CC(C)[NH2+]C1CCN(C[C@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000501009507 1035344174 /nfs/dbraw/zinc/34/41/74/1035344174.db2.gz CEOPUZAKQQOTBG-AWEZNQCLSA-N 2 0 328.422 4.271 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CCCc2cccc(C(F)(F)F)c2)[C@@H]2CCC[C@H]21 ZINC000513712195 1035424607 /nfs/dbraw/zinc/42/46/07/1035424607.db2.gz AJPCAEFOAIROLQ-OKZBNKHCSA-N 2 0 340.433 4.100 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000501408070 1035440037 /nfs/dbraw/zinc/44/00/37/1035440037.db2.gz TXJQPTJSMYJFAH-NMVBRADZSA-N 2 0 338.417 4.325 20 0 EIADRP C[C@H](c1ccc2ccccc2c1)[NH+]1CCC([C@@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420383846 1035561703 /nfs/dbraw/zinc/56/17/03/1035561703.db2.gz FWFZXRZVOGUHEE-HVETUWLQSA-N 2 0 338.495 4.119 20 0 EIADRP CC(C)c1ccc([C@H](C)[NH+]2CCC([C@H]3OCCC[C@@H]3[NH3+])CC2)cc1 ZINC000420388714 1035564585 /nfs/dbraw/zinc/56/45/85/1035564585.db2.gz XIPPFYBOQCYDQM-ORYQWCPZSA-N 2 0 330.516 4.089 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000420418676 1035570877 /nfs/dbraw/zinc/57/08/77/1035570877.db2.gz XDYDWSLVNPCRNC-JSGCOSHPSA-N 2 0 349.931 4.422 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2cc(Cl)cc3cccnc32)CC1 ZINC000501774095 1035584439 /nfs/dbraw/zinc/58/44/39/1035584439.db2.gz JONJIIRBSZTVAC-UHFFFAOYSA-N 2 0 345.918 4.442 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc3sccc3c2)[C@@H](C)C1 ZINC000575222288 1035727802 /nfs/dbraw/zinc/72/78/02/1035727802.db2.gz ZMWVFJIJQRIMIX-QFBILLFUSA-N 2 0 346.540 4.128 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccccc1F ZINC000491062903 1035798321 /nfs/dbraw/zinc/79/83/21/1035798321.db2.gz BMKWVHJBGOHMBS-OAQYLSRUSA-N 2 0 344.474 4.397 20 0 EIADRP Cc1ccc(COc2ccc(C[NH2+]CC3CC[NH+](C)CC3)cc2)cc1 ZINC000237161175 1036074970 /nfs/dbraw/zinc/07/49/70/1036074970.db2.gz VWBWAGHUSHNRLW-UHFFFAOYSA-N 2 0 338.495 4.005 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502688541 1036484212 /nfs/dbraw/zinc/48/42/12/1036484212.db2.gz WYVSZTGKEQXXIC-GUDVDZBRSA-N 2 0 346.563 4.407 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000502696882 1036513746 /nfs/dbraw/zinc/51/37/46/1036513746.db2.gz MFQOATVOKHOPOL-VXKWHMMOSA-N 2 0 344.543 4.357 20 0 EIADRP COCC[C@H]1CCC[C@@H]1[NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000502708757 1036563895 /nfs/dbraw/zinc/56/38/95/1036563895.db2.gz LJXCKWWHDNEXGD-YADHBBJMSA-N 2 0 344.543 4.213 20 0 EIADRP CSC1(C[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)CC1 ZINC000589169078 1036683186 /nfs/dbraw/zinc/68/31/86/1036683186.db2.gz XOYMDUNFNQBONE-UHFFFAOYSA-N 2 0 338.948 4.037 20 0 EIADRP COc1ccsc1C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000513756559 1036700494 /nfs/dbraw/zinc/70/04/94/1036700494.db2.gz YVNOOXFMOFTMBY-UHFFFAOYSA-N 2 0 344.524 4.101 20 0 EIADRP Fc1ccc2c(c1)CC[C@H]([NH2+]C1CC[NH+](CC3CCCCC3)CC1)C2 ZINC001168413790 1036766710 /nfs/dbraw/zinc/76/67/10/1036766710.db2.gz AREPHTQIQDFRQL-QFIPXVFZSA-N 2 0 344.518 4.317 20 0 EIADRP C[C@H](CSC(C)(C)C)[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000165313376 1036774683 /nfs/dbraw/zinc/77/46/83/1036774683.db2.gz PINRHQNEEJFJCZ-MJGOQNOKSA-N 2 0 334.573 4.061 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cc3ccc(F)cc3[nH]2)c1 ZINC000486713185 1036823617 /nfs/dbraw/zinc/82/36/17/1036823617.db2.gz VOQFWEDCIUAKSO-UHFFFAOYSA-N 2 0 339.458 4.439 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Br)ccc1F ZINC000421869315 1036838161 /nfs/dbraw/zinc/83/81/61/1036838161.db2.gz DGZJZYGHPOZONJ-XGNXJENSSA-N 2 0 343.284 4.112 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]C/C=C/c2ccncc2)C1 ZINC000486935526 1036906557 /nfs/dbraw/zinc/90/65/57/1036906557.db2.gz JKOJRLHJEKUGPQ-QTWIXLPOSA-N 2 0 335.495 4.117 20 0 EIADRP C[N@H+](Cc1ccccc1C[NH2+]C[C@@H]1CCSC1)C1CCCCC1 ZINC000486979778 1036930354 /nfs/dbraw/zinc/93/03/54/1036930354.db2.gz GNKBATLSYJMYPJ-KRWDZBQOSA-N 2 0 332.557 4.294 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2CCC23CCOCC3)cc1 ZINC000669698636 1037014512 /nfs/dbraw/zinc/01/45/12/1037014512.db2.gz VPQYIEAEZUJZCL-GHTZIAJQSA-N 2 0 342.527 4.110 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000271842541 1037032673 /nfs/dbraw/zinc/03/26/73/1037032673.db2.gz HCSFFYORJQOBNA-AWEZNQCLSA-N 2 0 327.497 4.031 20 0 EIADRP C[C@H]1CC2(C[N@@H+]1Cc1cccc(C[NH+]3CCCCC3)c1)CCOCC2 ZINC000646097541 1037070223 /nfs/dbraw/zinc/07/02/23/1037070223.db2.gz XLIXXUQNFBYVJU-IBGZPJMESA-N 2 0 342.527 4.064 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168418235 1037402534 /nfs/dbraw/zinc/40/25/34/1037402534.db2.gz WOOAPUASKNYOKM-HMXCVIKNSA-N 2 0 330.491 4.198 20 0 EIADRP C[C@H](c1ccc(OC(F)F)cc1)[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000488313491 1037501424 /nfs/dbraw/zinc/50/14/24/1037501424.db2.gz VACAMYGQOWLIJK-OAHLLOKOSA-N 2 0 338.442 4.157 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+]Cc2cc3c(cccc3O)s2)ccc1F ZINC000894270734 1037564887 /nfs/dbraw/zinc/56/48/87/1037564887.db2.gz ZBFRCLDEQUYHOG-UHFFFAOYSA-N 2 0 344.455 4.097 20 0 EIADRP CC(C)[NH2+]CCC[NH2+][C@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000573474514 1037566599 /nfs/dbraw/zinc/56/65/99/1037566599.db2.gz ZVURNOIKJQOIGA-INIZCTEOSA-N 2 0 329.513 4.165 20 0 EIADRP CC(C)[C@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CS1 ZINC000488436638 1037591845 /nfs/dbraw/zinc/59/18/45/1037591845.db2.gz YAGQONXUJIIPBB-KXMRHNKVSA-N 2 0 344.568 4.302 20 0 EIADRP Cc1cccnc1C(C)(C)C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000574005090 1037802739 /nfs/dbraw/zinc/80/27/39/1037802739.db2.gz DDYSVJXDHMOMPA-UHFFFAOYSA-N 2 0 329.532 4.054 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C1CCC([NH3+])CC1 ZINC000422733981 1037809107 /nfs/dbraw/zinc/80/91/07/1037809107.db2.gz BUTPPQZKGHXLLJ-VHWKEVPUSA-N 2 0 333.476 4.178 20 0 EIADRP COc1ccc(C2(C[NH2+][C@H](C)CCCC[NH3+])CCCCC2)cc1OC ZINC000422738391 1037820231 /nfs/dbraw/zinc/82/02/31/1037820231.db2.gz YNKAZZMMNHSKCP-QGZVFWFLSA-N 2 0 348.531 4.013 20 0 EIADRP CCc1ccc([C@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422741917 1037822369 /nfs/dbraw/zinc/82/23/69/1037822369.db2.gz FPGMCERHCOVOBM-BUKVSMQUSA-N 2 0 336.479 4.156 20 0 EIADRP Cc1[nH]c2c(cc(C)cc2C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)c1C ZINC000422746698 1037823474 /nfs/dbraw/zinc/82/34/74/1037823474.db2.gz WYOQVTUGDJZLBG-MISYRCLQSA-N 2 0 325.500 4.103 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(Cl)cc1 ZINC000422745357 1037824179 /nfs/dbraw/zinc/82/41/79/1037824179.db2.gz MDZNLDSIVONFDC-DCPHZVHLSA-N 2 0 342.870 4.247 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(Cl)c1 ZINC000422748884 1037825024 /nfs/dbraw/zinc/82/50/24/1037825024.db2.gz WPUQIYRVBOMEOS-DCPHZVHLSA-N 2 0 342.870 4.247 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+][C@H]2CCC[NH2+]CC2)cc1OCCC ZINC000422766506 1037826955 /nfs/dbraw/zinc/82/69/55/1037826955.db2.gz QDXPOICHKFEDPS-WMZOPIPTSA-N 2 0 334.504 4.057 20 0 EIADRP COc1ccccc1[C@H]([NH2+][C@@H](C)CCC[NH3+])c1ccccc1Cl ZINC000422778031 1037830809 /nfs/dbraw/zinc/83/08/09/1037830809.db2.gz GWVQZBJYDDAKDO-IFXJQAMLSA-N 2 0 332.875 4.155 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+][C@H]3CC[NH2+]CC[C@H]3C)cc2)cs1 ZINC000422800628 1037836808 /nfs/dbraw/zinc/83/68/08/1037836808.db2.gz CLWURUFELMMDFY-GLJUWKHASA-N 2 0 329.513 4.157 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(Cl)s1 ZINC000422807364 1037838544 /nfs/dbraw/zinc/83/85/44/1037838544.db2.gz MMMJLSILKPCPHR-YEWDVWPNSA-N 2 0 348.899 4.308 20 0 EIADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(COCc2ccccc2)cc1 ZINC000422867691 1037848416 /nfs/dbraw/zinc/84/84/16/1037848416.db2.gz SYZUZLYNZRKONA-VXKWHMMOSA-N 2 0 338.495 4.011 20 0 EIADRP CSCc1cc(F)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000422864244 1037849130 /nfs/dbraw/zinc/84/91/30/1037849130.db2.gz MMYZHNZFQPLRIA-CEXWTWQISA-N 2 0 336.520 4.089 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000422863234 1037849300 /nfs/dbraw/zinc/84/93/00/1037849300.db2.gz RJVNQIDYGIVBLD-GOEBONIOSA-N 2 0 329.513 4.295 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CN[C@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000422863320 1037849365 /nfs/dbraw/zinc/84/93/65/1037849365.db2.gz OOGSDHXIGRQNMG-ZQMYSKGWSA-N 2 0 349.522 4.295 20 0 EIADRP Fc1cccc2c1SCC[C@@H]2[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000422844722 1037850956 /nfs/dbraw/zinc/85/09/56/1037850956.db2.gz MWFIJMMHMDEMJQ-PILAGYSTSA-N 2 0 334.504 4.263 20 0 EIADRP CCOc1ccccc1[C@@H](CC)[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422880291 1037852281 /nfs/dbraw/zinc/85/22/81/1037852281.db2.gz NWHCAIDOLLPORS-DNVCBOLYSA-N 2 0 327.472 4.049 20 0 EIADRP CCCCCOc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1OC ZINC000422889860 1037855947 /nfs/dbraw/zinc/85/59/47/1037855947.db2.gz HBCNFPVGGQIKFP-UBLGTCEWSA-N 2 0 346.515 4.198 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1F ZINC000422873731 1037861146 /nfs/dbraw/zinc/86/11/46/1037861146.db2.gz LYCFIIBPQGFCAV-DLVCFXQMSA-N 2 0 340.442 4.041 20 0 EIADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1cccc2ccccc21 ZINC000422902441 1037864178 /nfs/dbraw/zinc/86/41/78/1037864178.db2.gz DDWXNGVEVSZUDS-OFNKIYASSA-N 2 0 348.490 4.273 20 0 EIADRP CO[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422911802 1037866901 /nfs/dbraw/zinc/86/69/01/1037866901.db2.gz LOPNYHHTODRSAB-BTINSWFASA-N 2 0 330.859 4.150 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H](C)CCCC[NH3+] ZINC000422914653 1037868193 /nfs/dbraw/zinc/86/81/93/1037868193.db2.gz VIFLAKUHTLFSES-STQMWFEESA-N 2 0 335.492 4.426 20 0 EIADRP CC[C@@H](C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C)Oc1cccc(Cl)c1 ZINC000422927382 1037871603 /nfs/dbraw/zinc/87/16/03/1037871603.db2.gz GKJPMZSJTQCCLK-DYVFJYSZSA-N 2 0 347.890 4.010 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]C1CCC(C[NH3+])CC1 ZINC000422931227 1037873120 /nfs/dbraw/zinc/87/31/20/1037873120.db2.gz BCDSPZXHOHQGPN-KTAKPFMOSA-N 2 0 329.513 4.287 20 0 EIADRP Clc1cccc(CC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)c1Cl ZINC000422948263 1037885216 /nfs/dbraw/zinc/88/52/16/1037885216.db2.gz QZZAVQPQRLXNAH-BMFZPTHFSA-N 2 0 327.299 4.046 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]C2CCC(C[NH3+])CC2)cc1OC ZINC000422949934 1037887267 /nfs/dbraw/zinc/88/72/67/1037887267.db2.gz VAAASDSYHYFDLU-HJOIGYKYSA-N 2 0 334.504 4.042 20 0 EIADRP CC(C)[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(C(F)(F)F)cc1 ZINC000422995128 1037891510 /nfs/dbraw/zinc/89/15/10/1037891510.db2.gz JLDWZMBHFUTJCY-WFVVYAPDSA-N 2 0 326.406 4.275 20 0 EIADRP c1ccc(-c2cccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)c2)nc1 ZINC000422997587 1037896575 /nfs/dbraw/zinc/89/65/75/1037896575.db2.gz OLXKLVUDFPKWAL-CEMLEFRQSA-N 2 0 335.495 4.149 20 0 EIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000423006234 1037899740 /nfs/dbraw/zinc/89/97/40/1037899740.db2.gz USEAIOWJEKYFRU-YXYSEUPNSA-N 2 0 330.516 4.055 20 0 EIADRP c1ccc2c(c1)O[C@@]1(CC[NH2+]C1)C[C@@H]2[NH2+]Cc1ccc(C2CCC2)cc1 ZINC000423067841 1037933868 /nfs/dbraw/zinc/93/38/68/1037933868.db2.gz AGHPXJNQYUNESD-GMAHTHKFSA-N 2 0 348.490 4.300 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)C1(c2ccccc2)CCCC1 ZINC000423050778 1037937882 /nfs/dbraw/zinc/93/78/82/1037937882.db2.gz MAUOOPCMMYSTRD-AEFFLSMTSA-N 2 0 337.511 4.400 20 0 EIADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC2(CCOCc3ccccc3)CC2)c2ccccc21 ZINC000423054525 1037941934 /nfs/dbraw/zinc/94/19/34/1037941934.db2.gz USCMEPFRRCXFHK-NHCUHLMSSA-N 2 0 336.479 4.108 20 0 EIADRP Cc1ccc(C2(C[NH2+][C@H](C)c3ccc(C[NH3+])nc3C)CCC2)cc1C ZINC000423085426 1037946437 /nfs/dbraw/zinc/94/64/37/1037946437.db2.gz JXFDQQBILMASTD-QGZVFWFLSA-N 2 0 337.511 4.238 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423100302 1037957970 /nfs/dbraw/zinc/95/79/70/1037957970.db2.gz VCPJDHIYANZKPY-DDUZABMNSA-N 2 0 329.875 4.099 20 0 EIADRP FC(F)(F)c1cccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CCC[NH2+]CC2)c1 ZINC000423103141 1037962364 /nfs/dbraw/zinc/96/23/64/1037962364.db2.gz KSESKEJSJVRLSR-IKGGRYGDSA-N 2 0 326.406 4.073 20 0 EIADRP C[C@@H]([NH2+]CCc1cccc2[nH]ccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000503903623 1037974798 /nfs/dbraw/zinc/97/47/98/1037974798.db2.gz RDJZNOIOIUYCQB-WIYYLYMNSA-N 2 0 347.506 4.211 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000423112097 1037992757 /nfs/dbraw/zinc/99/27/57/1037992757.db2.gz XBMHIUHDDQEUEK-GQGLESIBSA-N 2 0 326.406 4.201 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1F ZINC000423145670 1037997001 /nfs/dbraw/zinc/99/70/01/1037997001.db2.gz LYCFIIBPQGFCAV-MFMILTCTSA-N 2 0 340.442 4.041 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423260847 1038073291 /nfs/dbraw/zinc/07/32/91/1038073291.db2.gz QXNIENKYUAQWJZ-CRAIPNDOSA-N 2 0 343.540 4.083 20 0 EIADRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423244930 1038077452 /nfs/dbraw/zinc/07/74/52/1038077452.db2.gz HYSSCFKCIHTVPR-IAGOWNOFSA-N 2 0 342.458 4.055 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cccc2c1OC(C)(C)C2 ZINC000606469329 1038091586 /nfs/dbraw/zinc/09/15/86/1038091586.db2.gz RAJHQOIYLPYSFV-QGZVFWFLSA-N 2 0 330.516 4.144 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2CCc3c2cccc3Br)cc1 ZINC000423293482 1038096520 /nfs/dbraw/zinc/09/65/20/1038096520.db2.gz RMIRBKIBTIKEHS-XIKOKIGWSA-N 2 0 345.284 4.246 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423321456 1038119818 /nfs/dbraw/zinc/11/98/18/1038119818.db2.gz GEERVCXDNSNNCV-ZDUSSCGKSA-N 2 0 347.503 4.298 20 0 EIADRP COc1cc([C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)ccc1SC ZINC000423295901 1038122754 /nfs/dbraw/zinc/12/27/54/1038122754.db2.gz XSQAJXOUXNRECJ-KGLIPLIRSA-N 2 0 330.497 4.288 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)CCCS2 ZINC000423295677 1038124705 /nfs/dbraw/zinc/12/47/05/1038124705.db2.gz XEICSOYVSQAHKA-AUUYWEPGSA-N 2 0 342.508 4.432 20 0 EIADRP Cc1cccc(COc2ccc([C@@H](C)[NH2+]CC3=CC[NH2+]CC3)cc2)c1 ZINC000423345404 1038138091 /nfs/dbraw/zinc/13/80/91/1038138091.db2.gz NZADKPWSKXRGOV-GOSISDBHSA-N 2 0 336.479 4.144 20 0 EIADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@@H](Cc1ccccc1Cl)c1cccs1 ZINC000423362611 1038174715 /nfs/dbraw/zinc/17/47/15/1038174715.db2.gz BIWMMTFTMIXDKU-COXVUDFISA-N 2 0 334.916 4.273 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423368687 1038184318 /nfs/dbraw/zinc/18/43/18/1038184318.db2.gz FERGPVLGUXAWBC-GQIGUUNPSA-N 2 0 342.458 4.196 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC[NH2+]1 ZINC000423385834 1038193515 /nfs/dbraw/zinc/19/35/15/1038193515.db2.gz RCCHAWSARPKDGS-VDNDLQMASA-N 2 0 326.406 4.072 20 0 EIADRP Clc1cccc([C@@H]2CC[C@@H]([NH2+]Cc3ccc4c(c3)C[NH2+]C4)C2)c1 ZINC000423383638 1038194145 /nfs/dbraw/zinc/19/41/45/1038194145.db2.gz KMWFNNZRWIVIFN-OXQOHEQNSA-N 2 0 326.871 4.369 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@@H](Cc2ccccc2Cl)c2ccsc2)CC[NH2+]1 ZINC000423393606 1038197129 /nfs/dbraw/zinc/19/71/29/1038197129.db2.gz YZJWHDYMABKGPC-SKDZVZGDSA-N 2 0 334.916 4.415 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@H]1C)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423396364 1038203181 /nfs/dbraw/zinc/20/31/81/1038203181.db2.gz NSSWVROZIWJJNO-XFQAVAEZSA-N 2 0 342.458 4.053 20 0 EIADRP C[C@H]1C[NH2+]CC[C@@H]1[NH2+]C1CCC(c2cccc(C(F)(F)F)c2)CC1 ZINC000423406508 1038215591 /nfs/dbraw/zinc/21/55/91/1038215591.db2.gz UTIVOXCIPPJCER-DKVDKTFMSA-N 2 0 340.433 4.319 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1csc(-c2ccccc2)n1 ZINC000423418363 1038222290 /nfs/dbraw/zinc/22/22/90/1038222290.db2.gz HMMVDVYYAJMBIL-JYJNAYRXSA-N 2 0 329.513 4.226 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000423459881 1038240553 /nfs/dbraw/zinc/24/05/53/1038240553.db2.gz RNQWVHAMBHDERN-WFASDCNBSA-N 2 0 333.476 4.044 20 0 EIADRP COc1ccc([C@H]([NH2+]C[C@H]2CCC[C@H]([NH3+])C2)c2ccc(F)cc2)cc1 ZINC000423465917 1038241871 /nfs/dbraw/zinc/24/18/71/1038241871.db2.gz ICDBOCSRTQANMA-PAXLWEDBSA-N 2 0 342.458 4.031 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000423478568 1038249707 /nfs/dbraw/zinc/24/97/07/1038249707.db2.gz TYBNDJBLPOVVMF-VUCTXSBTSA-N 2 0 326.406 4.264 20 0 EIADRP COc1cccc(C[C@H]([NH2+]C[C@H]2CCC[C@H]([NH3+])C2)c2ccccc2)c1 ZINC000423478703 1038250377 /nfs/dbraw/zinc/25/03/77/1038250377.db2.gz UKRLFEJDIIFMAV-VCOUNFBDSA-N 2 0 338.495 4.086 20 0 EIADRP CCc1nc2c(s1)[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)CCC2 ZINC000423500569 1038254733 /nfs/dbraw/zinc/25/47/33/1038254733.db2.gz KMCWPMXQVREISF-JKSUJKDBSA-N 2 0 329.513 4.153 20 0 EIADRP Brc1ccc([C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)C2CC2)s1 ZINC000423486860 1038259876 /nfs/dbraw/zinc/25/98/76/1038259876.db2.gz SWDBUKNNFKASCD-IUODEOHRSA-N 2 0 343.334 4.084 20 0 EIADRP Cc1c([C@@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)cnn1-c1cccc(Cl)c1 ZINC000423487319 1038262676 /nfs/dbraw/zinc/26/26/76/1038262676.db2.gz UBRZHVKBOOIRPN-PBHICJAKSA-N 2 0 346.906 4.017 20 0 EIADRP CC(C)Oc1ccc([C@H]2CCC[C@H]2[NH2+]CCC2=CC[NH2+]CC2)cc1 ZINC000423534828 1038268993 /nfs/dbraw/zinc/26/89/93/1038268993.db2.gz AZHSNOYFEQRFOC-NHCUHLMSSA-N 2 0 328.500 4.009 20 0 EIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cccc(OC(F)F)c1 ZINC000423511497 1038269889 /nfs/dbraw/zinc/26/98/89/1038269889.db2.gz TWQDSKLPKUEVKW-KSSFIOAISA-N 2 0 334.410 4.419 20 0 EIADRP COc1ccc(Cl)cc1[C@@H](C)[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423514005 1038270346 /nfs/dbraw/zinc/27/03/46/1038270346.db2.gz WCUSJERTUIECRU-KDOFPFPSSA-N 2 0 332.875 4.479 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc(SCC(F)F)cc1 ZINC000423557446 1038281463 /nfs/dbraw/zinc/28/14/63/1038281463.db2.gz ZRNJQWNIOHXFBH-DRPJVOAASA-N 2 0 340.483 4.083 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423562613 1038283997 /nfs/dbraw/zinc/28/39/97/1038283997.db2.gz WRNNWJRCVNMWLF-NYCLONFESA-N 2 0 340.433 4.004 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc2cc(OC)ccc2c1 ZINC000423537922 1038285589 /nfs/dbraw/zinc/28/55/89/1038285589.db2.gz DWZXAPZJIWBCMY-KEZQHZCBSA-N 2 0 338.495 4.277 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423538647 1038286328 /nfs/dbraw/zinc/28/63/28/1038286328.db2.gz NTANIKRFBFIVFM-ZDUSSCGKSA-N 2 0 345.487 4.218 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc2cc(OC)ccc2c1 ZINC000423537920 1038286764 /nfs/dbraw/zinc/28/67/64/1038286764.db2.gz DWZXAPZJIWBCMY-DYQZNNLLSA-N 2 0 338.495 4.277 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CCC[C@@H]2[NH2+]CCC2=CC[NH2+]CC2)cc1 ZINC000423544176 1038289052 /nfs/dbraw/zinc/28/90/52/1038289052.db2.gz VZTQAPPWSQYDMZ-ROUUACIJSA-N 2 0 338.417 4.241 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)cc1 ZINC000423547981 1038292187 /nfs/dbraw/zinc/29/21/87/1038292187.db2.gz QRKSUKSPDWOVEH-MWGJNXKLSA-N 2 0 342.527 4.088 20 0 EIADRP C[C@H]1CCC[C@H](C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C1 ZINC000574553054 1038301541 /nfs/dbraw/zinc/30/15/41/1038301541.db2.gz YRSHWDOPZLGQIJ-HKUYNNGSSA-N 2 0 330.516 4.076 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@H](c1cccc(F)c1)c1cccc(Cl)c1 ZINC000490155541 1038346660 /nfs/dbraw/zinc/34/66/60/1038346660.db2.gz DPBKQFDOEWAGMC-IBGZPJMESA-N 2 0 334.866 4.500 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(C[NH+](CC)CC)c1)c1ccc(F)cn1 ZINC000490190913 1038378859 /nfs/dbraw/zinc/37/88/59/1038378859.db2.gz NQBHMLZYXVXZTL-LJQANCHMSA-N 2 0 329.463 4.303 20 0 EIADRP c1coc([C@@H]2CC[NH+](CCCCC[N@@H+]3CC[C@H](c4ccco4)C3)C2)c1 ZINC000607152481 1038394682 /nfs/dbraw/zinc/39/46/82/1038394682.db2.gz YNOXRAYMXQLHBM-KDURUIRLSA-N 2 0 342.483 4.322 20 0 EIADRP CCOc1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)cc1C(F)(F)F ZINC001168311923 1038779625 /nfs/dbraw/zinc/77/96/25/1038779625.db2.gz FBPYUCOPCSBTTL-UHFFFAOYSA-N 2 0 344.421 4.067 20 0 EIADRP CCCCCOc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000480769818 1038796602 /nfs/dbraw/zinc/79/66/02/1038796602.db2.gz MQSLKWJNMVCVTM-ROUUACIJSA-N 2 0 330.516 4.391 20 0 EIADRP CCc1ccc([C@H](CC)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000539058427 1038805365 /nfs/dbraw/zinc/80/53/65/1038805365.db2.gz JONIJNGJMLMQFX-BDTNDASRSA-N 2 0 344.543 4.058 20 0 EIADRP CSC1(C[NH2+][C@@H](C)CCc2ccc(Cl)s2)CC[NH+](C)CC1 ZINC000554997732 1038821668 /nfs/dbraw/zinc/82/16/68/1038821668.db2.gz BKFAHTQQPDSOTQ-ZDUSSCGKSA-N 2 0 346.993 4.140 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(Cl)c(F)c1 ZINC000539072299 1038822008 /nfs/dbraw/zinc/82/20/08/1038822008.db2.gz PJLGDIXAFNPVBJ-QLFBSQMISA-N 2 0 342.886 4.019 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CCOc2ccccc2-c2ccccc2)[C@H](C)C1 ZINC000539093781 1038834198 /nfs/dbraw/zinc/83/41/98/1038834198.db2.gz TWODIFIATSLHCX-NQIIRXRSSA-N 2 0 338.495 4.052 20 0 EIADRP Cc1ccc(-c2ncc(C[N@H+]3CC4(C[C@@H]3C)CC[NH2+]CC4)s2)cc1 ZINC000424376285 1038837819 /nfs/dbraw/zinc/83/78/19/1038837819.db2.gz KWHWQZQYLXJXQR-INIZCTEOSA-N 2 0 341.524 4.083 20 0 EIADRP [NH3+][C@@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000424381083 1038839643 /nfs/dbraw/zinc/83/96/43/1038839643.db2.gz YENNDNIOTLRCEK-RKTXRCNFSA-N 2 0 326.406 4.201 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H](C)c3c2cccc3C)[C@@H](C)C1 ZINC000504921122 1038844440 /nfs/dbraw/zinc/84/44/40/1038844440.db2.gz QXKPVXUODWIJDB-YXYSEUPNSA-N 2 0 344.543 4.270 20 0 EIADRP CC(C)[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc(C(F)(F)F)c1 ZINC000539162852 1038864435 /nfs/dbraw/zinc/86/44/35/1038864435.db2.gz MLXCARWRSAMKGX-KSSFIOAISA-N 2 0 340.433 4.476 20 0 EIADRP Cc1ccc2c(c1)C1(CC2)CC[NH+](C2CCC([NH+](C)C)CC2)CC1 ZINC001168322432 1038866600 /nfs/dbraw/zinc/86/66/00/1038866600.db2.gz BKKLDNPCODYIBS-UHFFFAOYSA-N 2 0 326.528 4.148 20 0 EIADRP CC(C)(C[NH2+]Cc1cc(Cl)cc2cccnc21)C[NH+]1CCCC1 ZINC000480914515 1038869382 /nfs/dbraw/zinc/86/93/82/1038869382.db2.gz QVPLPNCLLWAPRA-UHFFFAOYSA-N 2 0 331.891 4.100 20 0 EIADRP C[NH+](C)C1CCC([N@@H+]2CC[C@H](c3cccc(C(F)(F)F)c3)C2)CC1 ZINC001168324861 1038873977 /nfs/dbraw/zinc/87/39/77/1038873977.db2.gz YQRAATMDXKTNIR-ZLPCBKJTSA-N 2 0 340.433 4.368 20 0 EIADRP CCC[C@H](CCc1ccccc1)[NH2+]C[C@@H]1CCCn2cc(C)nc21 ZINC000462119602 1038936895 /nfs/dbraw/zinc/93/68/95/1038936895.db2.gz GEFXFVRDFNTKDC-VQTJNVASSA-N 2 0 325.500 4.460 20 0 EIADRP CCOc1cc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc(Cl)c1OC ZINC000414804490 1038999136 /nfs/dbraw/zinc/99/91/36/1038999136.db2.gz FIRXEQPMOKNWCK-CYBMUJFWSA-N 2 0 348.874 4.057 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+][C@@H](C)CC[NH+](C)C)cc1 ZINC000470246866 1039030744 /nfs/dbraw/zinc/03/07/44/1039030744.db2.gz QSZGLAUWZOKWGD-IRXDYDNUSA-N 2 0 326.484 4.353 20 0 EIADRP C[C@@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)C(F)(F)F ZINC000552067023 1039093129 /nfs/dbraw/zinc/09/31/29/1039093129.db2.gz YUJLUOJZLYMZBV-OOHWJJMZSA-N 2 0 328.422 4.218 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CCc2c[nH]c3cc(Cl)cc(Cl)c23)CC[N@@H+]1C ZINC000477855744 1039135656 /nfs/dbraw/zinc/13/56/56/1039135656.db2.gz IIFFFLGGDGYIIG-BXUZGUMPSA-N 2 0 340.298 4.090 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CC2(C(F)(F)F)CC2)CC1 ZINC000552097816 1039152487 /nfs/dbraw/zinc/15/24/87/1039152487.db2.gz NOZDSWNWKHUUPN-UHFFFAOYSA-N 2 0 340.433 4.362 20 0 EIADRP COc1ccccc1[C@H](C)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000481333299 1039311287 /nfs/dbraw/zinc/31/12/87/1039311287.db2.gz RWSXOIRORFQTRH-SFHVURJKSA-N 2 0 338.495 4.319 20 0 EIADRP CC[C@H]([NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1)c1c(C)noc1C ZINC000090886761 1039317144 /nfs/dbraw/zinc/31/71/44/1039317144.db2.gz GPHUMWFGSRCGHX-KUHUBIRLSA-N 2 0 345.487 4.034 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cccc(OC3CCCC3)c2)C[C@@H]1C ZINC000537634894 1039341275 /nfs/dbraw/zinc/34/12/75/1039341275.db2.gz YIJWXQGPPRYHIS-HKUYNNGSSA-N 2 0 330.516 4.313 20 0 EIADRP C[NH+]1CC2(C1)CC[NH+](C1CCC(c3ccc(Cl)cc3)CC1)CC2 ZINC001168346569 1039392499 /nfs/dbraw/zinc/39/24/99/1039392499.db2.gz BJPYNJXUXPLNCI-UHFFFAOYSA-N 2 0 332.919 4.394 20 0 EIADRP Cc1ccnc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)c1 ZINC000514087937 1039590727 /nfs/dbraw/zinc/59/07/27/1039590727.db2.gz JHRCZCHKILILQC-RBUKOAKNSA-N 2 0 337.511 4.473 20 0 EIADRP CC[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1F ZINC000092856897 1039600253 /nfs/dbraw/zinc/60/02/53/1039600253.db2.gz CAOBHTZHRFFWRV-HXUWFJFHSA-N 2 0 345.437 4.317 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000122164245 1039603353 /nfs/dbraw/zinc/60/33/53/1039603353.db2.gz VDDUFOJCKWMKQL-YOEHRIQHSA-N 2 0 340.433 4.057 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CC2(c3cccc(C(F)(F)F)c3)CCC2)CC[N@@H+]1C ZINC000122160872 1039605582 /nfs/dbraw/zinc/60/55/82/1039605582.db2.gz QHKXXMRBHYNJQP-RHSMWYFYSA-N 2 0 340.433 4.199 20 0 EIADRP CC(C)[NH+]1CCC([N@H+](C)CCc2cccc(Cl)c2Cl)CC1 ZINC000434543066 1039632332 /nfs/dbraw/zinc/63/23/32/1039632332.db2.gz FGFTXEFLGIGIJK-UHFFFAOYSA-N 2 0 329.315 4.341 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(CC)s2)[C@@H](C)C1 ZINC000122344079 1039655838 /nfs/dbraw/zinc/65/58/38/1039655838.db2.gz VJBVKJMUFCTYPB-BQFCYCMXSA-N 2 0 338.561 4.098 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cc(C)ccc1OC ZINC000093370291 1039672742 /nfs/dbraw/zinc/67/27/42/1039672742.db2.gz JGMRUGHSMRUHJX-FQEVSTJZSA-N 2 0 326.484 4.306 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2ccc(-c3cc[nH]n3)o2)CC1 ZINC000434981187 1039973036 /nfs/dbraw/zinc/97/30/36/1039973036.db2.gz DRYWAZWTAABXAH-UHFFFAOYSA-N 2 0 344.503 4.004 20 0 EIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]CCc1cc(F)cc(F)c1 ZINC000482132482 1040024144 /nfs/dbraw/zinc/02/41/44/1040024144.db2.gz YHANFRQDDNUZKB-IIBYNOLFSA-N 2 0 344.449 4.008 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC(C)(C)c1ccc(Cl)c(Cl)c1 ZINC000482137202 1040031764 /nfs/dbraw/zinc/03/17/64/1040031764.db2.gz ILYPSMHDXFWQAX-MLGOLLRUSA-N 2 0 329.315 4.201 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)C1 ZINC000482355199 1040194615 /nfs/dbraw/zinc/19/46/15/1040194615.db2.gz FKRXCVUQOCIMEU-HUUCEWRRSA-N 2 0 344.421 4.356 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(Br)s2)CC1 ZINC000482507814 1040305444 /nfs/dbraw/zinc/30/54/44/1040305444.db2.gz IKAGTVKJSUBIHC-LBPRGKRZSA-N 2 0 345.350 4.283 20 0 EIADRP C[C@H](C[N@@H+]1CCC[C@@H]2C[NH+](C)CC[C@H]21)c1ccc(C(F)(F)F)cc1 ZINC000514890643 1040328079 /nfs/dbraw/zinc/32/80/79/1040328079.db2.gz KVYNOJCNKJXPKN-QGPMSJSTSA-N 2 0 340.433 4.225 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000482562926 1040353014 /nfs/dbraw/zinc/35/30/14/1040353014.db2.gz DYWFPQPKUIAJQF-STQMWFEESA-N 2 0 345.314 4.081 20 0 EIADRP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000479466321 1040391696 /nfs/dbraw/zinc/39/16/96/1040391696.db2.gz RNJJXZYXLKYOIR-RADWXHQJSA-N 2 0 338.470 4.171 20 0 EIADRP CC(C)COc1ccc(C(C)(C)C[NH2+][C@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000482643058 1040402039 /nfs/dbraw/zinc/40/20/39/1040402039.db2.gz ODJBWYZZBYIQOU-HKUYNNGSSA-N 2 0 332.532 4.071 20 0 EIADRP c1ccc(CC(Cc2ccccc2)[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000666995033 1040403545 /nfs/dbraw/zinc/40/35/45/1040403545.db2.gz AWOPSLLXCSXIHP-NRFANRHFSA-N 2 0 334.507 4.105 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccnc(Cl)c2)c1 ZINC000163556854 1040513254 /nfs/dbraw/zinc/51/32/54/1040513254.db2.gz DESYXCLHKYGULQ-OAHLLOKOSA-N 2 0 331.891 4.428 20 0 EIADRP Cc1ccsc1[C@@H](C)[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000482861592 1040530252 /nfs/dbraw/zinc/53/02/52/1040530252.db2.gz CIJCILQZTJQDAN-QGZVFWFLSA-N 2 0 344.524 4.382 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC000479859888 1040720460 /nfs/dbraw/zinc/72/04/60/1040720460.db2.gz NCPAJMWSNTVIRW-CQSZACIVSA-N 2 0 331.529 4.357 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)C[NH+](C)C)c1ccc(SCC(F)F)cc1 ZINC000479877894 1040739443 /nfs/dbraw/zinc/73/94/43/1040739443.db2.gz ZUUOCJIIGVTUQS-ZDUSSCGKSA-N 2 0 330.488 4.282 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(C)c(OC(F)F)c(C)c2)C[C@@H]1C ZINC000539838134 1040820005 /nfs/dbraw/zinc/82/00/05/1040820005.db2.gz LAWFABGJPQUATP-RDJZCZTQSA-N 2 0 340.458 4.209 20 0 EIADRP CCC[C@H]([NH2+][C@H]1CC[N@H+](CCCOCC)C[C@H]1C)c1ccccc1 ZINC000480034153 1040870664 /nfs/dbraw/zinc/87/06/64/1040870664.db2.gz JJSHPFSSAUJFHH-GIVPXCGWSA-N 2 0 332.532 4.254 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccc(COc2ccccc2)cc1 ZINC000537988275 1040967005 /nfs/dbraw/zinc/96/70/05/1040967005.db2.gz WHISYYCMHTXXKA-FGSXEWAUSA-N 2 0 338.495 4.084 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@@H](C)N(C)C1CC1 ZINC000462805139 1040970717 /nfs/dbraw/zinc/97/07/17/1040970717.db2.gz MJTAMGJJFYDZKO-HZPDHXFCSA-N 2 0 327.516 4.296 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2ccc(F)cc2OC(F)F)CC1 ZINC000483710610 1040980280 /nfs/dbraw/zinc/98/02/80/1040980280.db2.gz IHPPHMQVHPPDNW-CYBMUJFWSA-N 2 0 344.421 4.200 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@@H]3CC[C@@H](c4ccccc4)C3)C2)cc1 ZINC000436241143 1040989196 /nfs/dbraw/zinc/98/91/96/1040989196.db2.gz QNCYICSGDBNDEB-GMKZXUHWSA-N 2 0 348.534 4.477 20 0 EIADRP CCN(CC)[C@H](C[NH2+][C@@H](c1cccnc1)C(C)C)c1ccccc1 ZINC000538060565 1041031967 /nfs/dbraw/zinc/03/19/67/1041031967.db2.gz NNKYZICGTMYVAD-NHCUHLMSSA-N 2 0 325.500 4.451 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC1 ZINC000436287741 1041037044 /nfs/dbraw/zinc/03/70/44/1041037044.db2.gz UWITYXFYJUXLAG-RZDIXWSQSA-N 2 0 340.433 4.415 20 0 EIADRP CCO[C@H]1C[C@@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C12CCCC2 ZINC000483841133 1041039668 /nfs/dbraw/zinc/03/96/68/1041039668.db2.gz VWMCBVHQELTRHW-UXHICEINSA-N 2 0 334.548 4.111 20 0 EIADRP F[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000554374162 1041059357 /nfs/dbraw/zinc/05/93/57/1041059357.db2.gz PKOFMVVZQXZXPM-CRSSMBPESA-N 2 0 330.491 4.157 20 0 EIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H]3CC[C@@H]3C(C)(C)C)cc2)CC1 ZINC000554378062 1041064888 /nfs/dbraw/zinc/06/48/88/1041064888.db2.gz ZHPGULOQJXOICV-PMACEKPBSA-N 2 0 330.516 4.074 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CCC[NH+]1CCCC1 ZINC000462884102 1041068481 /nfs/dbraw/zinc/06/84/81/1041068481.db2.gz YZWOQEJJDWPBRQ-QGZVFWFLSA-N 2 0 327.516 4.300 20 0 EIADRP c1ccc(C[C@@H]2CC[C@H]([NH2+]C3CC[NH+](C4CCCC4)CC3)C2)cc1 ZINC000436299782 1041070082 /nfs/dbraw/zinc/07/00/82/1041070082.db2.gz HKHPKHDORIPZHP-FPOVZHCZSA-N 2 0 326.528 4.394 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)[C@H](C)C1 ZINC000436317363 1041085062 /nfs/dbraw/zinc/08/50/62/1041085062.db2.gz UZEUBPKAFHZRKB-MOIQIXESSA-N 2 0 340.433 4.271 20 0 EIADRP Fc1ccc(CC2(C[NH2+]C3CC[NH+](CC4CC4)CC3)CCC2)cc1 ZINC001168368614 1041103618 /nfs/dbraw/zinc/10/36/18/1041103618.db2.gz NABBIXNWTAKBIP-UHFFFAOYSA-N 2 0 330.491 4.003 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCC2CC2)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000480273622 1041149632 /nfs/dbraw/zinc/14/96/32/1041149632.db2.gz IVBDNFBHXZIEMG-XLIONFOSSA-N 2 0 342.527 4.218 20 0 EIADRP CCCC[C@H](CCC)C[NH2+][C@H]1CCN(Cc2ccccn2)C[C@H]1C ZINC000484306400 1041190510 /nfs/dbraw/zinc/19/05/10/1041190510.db2.gz WPXAPDOBMHOKAL-DYXWJJEUSA-N 2 0 331.548 4.488 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1cccc(NC(C)=O)c1 ZINC000484293020 1041195947 /nfs/dbraw/zinc/19/59/47/1041195947.db2.gz PWYHZOVNGHSYEW-PBEJRMEISA-N 2 0 345.531 4.196 20 0 EIADRP CCc1nc(C)c([C@@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)s1 ZINC000484297797 1041199710 /nfs/dbraw/zinc/19/97/10/1041199710.db2.gz VNRNLRVCZQKEOS-OAHLLOKOSA-N 2 0 337.577 4.423 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc2ccccc21 ZINC000540169049 1041211118 /nfs/dbraw/zinc/21/11/18/1041211118.db2.gz JJQUMKAGIHPQNS-OTWHNJEPSA-N 2 0 340.511 4.380 20 0 EIADRP C[C@@H](CCCC(F)(F)F)[NH2+]CCCN1CCc2ccccc2C1 ZINC000480333958 1041218871 /nfs/dbraw/zinc/21/88/71/1041218871.db2.gz MIVRAKADUOYMCP-HNNXBMFYSA-N 2 0 328.422 4.146 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]CC[C@H]2CCC[N@@H+]2C)cc1 ZINC000538259732 1041221165 /nfs/dbraw/zinc/22/11/65/1041221165.db2.gz NEMQVUHNXZRIPY-FXAWDEMLSA-N 2 0 338.495 4.497 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1cccc(O)c1 ZINC000194852036 1041232941 /nfs/dbraw/zinc/23/29/41/1041232941.db2.gz OSRRLZCQGGDWCB-MSOLQXFVSA-N 2 0 338.495 4.475 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1cccc(O)c1 ZINC000194850318 1041235787 /nfs/dbraw/zinc/23/57/87/1041235787.db2.gz BECWMRSHCLBGMU-MSOLQXFVSA-N 2 0 338.495 4.475 20 0 EIADRP COc1ccc2cc([C@H](C)[NH2+][C@@H]3CCC[C@H]([NH+](C)C)C3)ccc2c1 ZINC000484471411 1041249937 /nfs/dbraw/zinc/24/99/37/1041249937.db2.gz ILZUVRGOJICWPD-BEVDRBHNSA-N 2 0 326.484 4.372 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1cccc(OC(F)(F)F)c1 ZINC000484475482 1041268878 /nfs/dbraw/zinc/26/88/78/1041268878.db2.gz RRWSQYWEZSECIN-QEJZJMRPSA-N 2 0 330.394 4.109 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(OC(F)(F)F)cc1 ZINC000484476814 1041268988 /nfs/dbraw/zinc/26/89/88/1041268988.db2.gz WPKQSXCAKRUKGY-QEJZJMRPSA-N 2 0 330.394 4.109 20 0 EIADRP COCCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CCCC1 ZINC000484508609 1041291963 /nfs/dbraw/zinc/29/19/63/1041291963.db2.gz PZOPMQYWSOVDFT-CTNGQTDRSA-N 2 0 344.543 4.084 20 0 EIADRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3scnc3C)cc2)C1 ZINC000667677214 1041318078 /nfs/dbraw/zinc/31/80/78/1041318078.db2.gz LXTXTLJCVUNOJX-SFHVURJKSA-N 2 0 343.540 4.282 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](c2ccc(C(F)(F)F)cc2)C(C)C)C1 ZINC000540258962 1041325592 /nfs/dbraw/zinc/32/55/92/1041325592.db2.gz KLUZKOPAYWHPDU-PBHICJAKSA-N 2 0 328.422 4.334 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C(C)C)C1 ZINC000540261236 1041327977 /nfs/dbraw/zinc/32/79/77/1041327977.db2.gz XIANTHRQDXOUMZ-PBHICJAKSA-N 2 0 328.422 4.334 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1nc2ccc(Cl)cc2n1C ZINC000516030781 1041356555 /nfs/dbraw/zinc/35/65/55/1041356555.db2.gz XGGKXXPQULQUQO-OAHLLOKOSA-N 2 0 348.922 4.143 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000554742377 1041372415 /nfs/dbraw/zinc/37/24/15/1041372415.db2.gz VRNLIMIBTQTOJZ-NRFANRHFSA-N 2 0 337.511 4.318 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(C[NH+](C)C)c2)cc1OC ZINC000924796828 1041393700 /nfs/dbraw/zinc/39/37/00/1041393700.db2.gz DIAWULFSVSFOLK-CVEARBPZSA-N 2 0 342.483 4.177 20 0 EIADRP COc1cc(C)c([C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1OC ZINC000480614636 1041424827 /nfs/dbraw/zinc/42/48/27/1041424827.db2.gz NRVBPIBIDIRDGM-GOSISDBHSA-N 2 0 348.531 4.175 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CCSCc2ccc(Cl)cc2Cl)CC[N@@H+]1C ZINC000540396773 1041440016 /nfs/dbraw/zinc/44/00/16/1041440016.db2.gz DLILSPOWAWAWBZ-IUODEOHRSA-N 2 0 347.355 4.299 20 0 EIADRP C[C@@H]([NH2+]C1(Cc2ccccc2)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000480661596 1041451700 /nfs/dbraw/zinc/45/17/00/1041451700.db2.gz KOSHNZUSUTYJMR-GOSISDBHSA-N 2 0 338.495 4.053 20 0 EIADRP c1ccc(N2CCC([NH2+]C[C@H]3CCC[N@@H+]3C3CCCCC3)CC2)cc1 ZINC000463247976 1041452944 /nfs/dbraw/zinc/45/29/44/1041452944.db2.gz LIAWPQJVVYILDE-JOCHJYFZSA-N 2 0 341.543 4.042 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CCc2ccc3[nH]ccc3c2)CCN1Cc1ccccc1 ZINC000463262585 1041459120 /nfs/dbraw/zinc/45/91/20/1041459120.db2.gz ZKCOIRDQSKPOTC-PGRDOPGGSA-N 2 0 347.506 4.353 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C3(Cc4ccccc4)CC3)CC2)C1 ZINC000480668079 1041460903 /nfs/dbraw/zinc/46/09/03/1041460903.db2.gz VDHWVBLGLJIIEX-NQIIRXRSSA-N 2 0 326.528 4.394 20 0 EIADRP COc1ccc([C@H](CCC(C)C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000480692416 1041475971 /nfs/dbraw/zinc/47/59/71/1041475971.db2.gz IGUSJXWGIZQOAW-DYXWJJEUSA-N 2 0 330.516 4.389 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000195132201 1041484203 /nfs/dbraw/zinc/48/42/03/1041484203.db2.gz WJKCORPLOJQRGP-FUHWJXTLSA-N 2 0 342.458 4.007 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)c(F)c1 ZINC000195135337 1041486644 /nfs/dbraw/zinc/48/66/44/1041486644.db2.gz VLLZXWUJLQVAST-WBVHZDCISA-N 2 0 330.422 4.138 20 0 EIADRP CC[C@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000480733988 1041496959 /nfs/dbraw/zinc/49/69/59/1041496959.db2.gz BLHRAZKPJLFGAW-IXDOHACOSA-N 2 0 338.948 4.427 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cccc(OC)c2)CC1)CC1CC1 ZINC000538857294 1041561611 /nfs/dbraw/zinc/56/16/11/1041561611.db2.gz HCQOBGUKQRLOLG-UHFFFAOYSA-N 2 0 330.516 4.029 20 0 EIADRP CC(C)[C@H](CC(F)(F)F)[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000437101879 1041659888 /nfs/dbraw/zinc/65/98/88/1041659888.db2.gz FDFOUSWFXFQUTM-PBHICJAKSA-N 2 0 346.437 4.255 20 0 EIADRP [NH3+]CC1CCC([NH2+][C@@H](Cc2ccc(Cl)cc2)c2ccccn2)CC1 ZINC000516964693 1041829360 /nfs/dbraw/zinc/82/93/60/1041829360.db2.gz ZSPFCDBTZJWZCY-NLPFYKDJSA-N 2 0 343.902 4.126 20 0 EIADRP [NH3+][C@H]1CCC[C@H]([NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 ZINC000414909771 1041856238 /nfs/dbraw/zinc/85/62/38/1041856238.db2.gz CKIUBBMSXKSADX-STQMWFEESA-N 2 0 340.311 4.084 20 0 EIADRP CCN1CCC[C@H]1C[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000425936779 1041985962 /nfs/dbraw/zinc/98/59/62/1041985962.db2.gz JPVZDYSRRQHCGK-VQTJNVASSA-N 2 0 343.902 4.093 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@@H](c2ccco2)c2ccccc2)C1 ZINC000541549226 1042006551 /nfs/dbraw/zinc/00/65/51/1042006551.db2.gz PWOUUFIZYRXYQX-GHTZIAJQSA-N 2 0 326.484 4.471 20 0 EIADRP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000467365302 1042012143 /nfs/dbraw/zinc/01/21/43/1042012143.db2.gz PDSUALYQBJGFJS-XYPHTWIQSA-N 2 0 328.422 4.099 20 0 EIADRP C[C@]1(c2ccccc2)CC[C@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C1 ZINC000438192923 1042084126 /nfs/dbraw/zinc/08/41/26/1042084126.db2.gz RQNMERPIXNAZLH-UNMCSNQZSA-N 2 0 326.528 4.493 20 0 EIADRP C[C@]1(c2ccccc2)CC[C@@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C1 ZINC000438192919 1042085354 /nfs/dbraw/zinc/08/53/54/1042085354.db2.gz RQNMERPIXNAZLH-IRLDBZIGSA-N 2 0 326.528 4.493 20 0 EIADRP CCC[NH+]1CCC([NH2+]CC2(c3cccc(F)c3F)CCCC2)CC1 ZINC000426060376 1042239171 /nfs/dbraw/zinc/23/91/71/1042239171.db2.gz HKXKARQDQUIPDB-UHFFFAOYSA-N 2 0 336.470 4.241 20 0 EIADRP CCC[NH+]1CCC(C[NH2+]Cc2cc(Cl)cc(Cl)c2OC)CC1 ZINC000518275859 1042448363 /nfs/dbraw/zinc/44/83/63/1042448363.db2.gz UXURLXRSLXMREY-UHFFFAOYSA-N 2 0 345.314 4.214 20 0 EIADRP FC(F)Oc1ccc2ccccc2c1C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414977358 1042476580 /nfs/dbraw/zinc/47/65/80/1042476580.db2.gz RIVKXBLADNVBEV-HNNXBMFYSA-N 2 0 334.410 4.063 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1OC ZINC000173324986 1042565377 /nfs/dbraw/zinc/56/53/77/1042565377.db2.gz BQCANOFDKOKIMO-SJORKVTESA-N 2 0 334.504 4.009 20 0 EIADRP CSc1ccc([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1 ZINC000173364743 1042568126 /nfs/dbraw/zinc/56/81/26/1042568126.db2.gz MIRPHRKCZSVTCX-INIZCTEOSA-N 2 0 344.524 4.200 20 0 EIADRP C[C@@H]([NH2+]CC1(N[C@@H](C)c2ccccc2)CCOCC1)c1ccccc1 ZINC000173434140 1042572929 /nfs/dbraw/zinc/57/29/29/1042572929.db2.gz MIIUGACFOAMCMQ-MOPGFXCFSA-N 2 0 338.495 4.237 20 0 EIADRP C[NH+](C)CCC1CC[NH+](CCOc2cccc(C(C)(C)C)c2)CC1 ZINC000506584891 1042641591 /nfs/dbraw/zinc/64/15/91/1042641591.db2.gz DTQYZKVODVPNBP-UHFFFAOYSA-N 2 0 332.532 4.027 20 0 EIADRP CC(C)Oc1ccc([C@H]2CCC[C@@H]2[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)cc1 ZINC000415000256 1042676724 /nfs/dbraw/zinc/67/67/24/1042676724.db2.gz AOKSGEPSJSBNAV-CLAROIROSA-N 2 0 342.527 4.088 20 0 EIADRP Cc1ccc(COc2ccc(C[NH2+]CCC[NH+]3CCCC3)cc2)cc1 ZINC000518770556 1042684697 /nfs/dbraw/zinc/68/46/97/1042684697.db2.gz QCRDAYUNUFFYFK-UHFFFAOYSA-N 2 0 338.495 4.150 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1nccc2ccccc21 ZINC000894385536 1042709970 /nfs/dbraw/zinc/70/99/70/1042709970.db2.gz SOFNOIQRXCGCLP-UHFFFAOYSA-N 2 0 333.479 4.365 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000415004117 1042738039 /nfs/dbraw/zinc/73/80/39/1042738039.db2.gz NUHCPKVLIWDWEP-GIUOSPMZSA-N 2 0 330.516 4.217 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(Cl)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309875647 1042823038 /nfs/dbraw/zinc/82/30/38/1042823038.db2.gz SYKBHBQASWVKIU-QFBILLFUSA-N 2 0 328.887 4.340 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc2ccccc2n1 ZINC000178099085 1042858911 /nfs/dbraw/zinc/85/89/11/1042858911.db2.gz DXRAEQFAPDHHRN-ROUUACIJSA-N 2 0 325.500 4.398 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc2ccccc2n1 ZINC000178172620 1042860710 /nfs/dbraw/zinc/86/07/10/1042860710.db2.gz WNLFKZDVAGSJHV-QGZVFWFLSA-N 2 0 349.478 4.026 20 0 EIADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1nc(-c2ccccc2)cs1 ZINC000178748159 1042874060 /nfs/dbraw/zinc/87/40/60/1042874060.db2.gz ABCCZLXBPZNXHN-HNNXBMFYSA-N 2 0 329.513 4.193 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(OC(C)C)c(Cl)c2)C[C@@H]1C ZINC000493282722 1042891938 /nfs/dbraw/zinc/89/19/38/1042891938.db2.gz TZGWWDYVRCVDTC-DOTOQJQBSA-N 2 0 338.923 4.432 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C2CC(F)(F)C2)cc1C[NH+]1CCCCC1 ZINC000760040650 1042893195 /nfs/dbraw/zinc/89/31/95/1042893195.db2.gz UJLLRWYYEFDJGX-AWEZNQCLSA-N 2 0 338.442 4.129 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc3nc(C)sc3c2)c1 ZINC000494027603 1043006139 /nfs/dbraw/zinc/00/61/39/1043006139.db2.gz NBCFTDWITAWCBU-UHFFFAOYSA-N 2 0 339.508 4.346 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc2cc(OC)ccc2c1 ZINC000152418038 1043006663 /nfs/dbraw/zinc/00/66/63/1043006663.db2.gz ANTQRRABYMDJEE-AOMKIAJQSA-N 2 0 338.495 4.373 20 0 EIADRP C[C@@H]([NH2+][C@@H](COc1ccccc1)c1ccccc1)C1CC[NH+](C)CC1 ZINC000678583958 1043075406 /nfs/dbraw/zinc/07/54/06/1043075406.db2.gz HQYGENFWQVOEHR-GCJKJVERSA-N 2 0 338.495 4.127 20 0 EIADRP CC(C)[NH+](CCNC1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC001168008694 1043078116 /nfs/dbraw/zinc/07/81/16/1043078116.db2.gz FTKIJGFLVGKRGX-PMACEKPBSA-N 2 0 345.575 4.136 20 0 EIADRP CSc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000310082535 1043099772 /nfs/dbraw/zinc/09/97/72/1043099772.db2.gz KJRBCKLMSDCTHQ-FQEVSTJZSA-N 2 0 340.536 4.410 20 0 EIADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CCCC1 ZINC000665246945 1043222640 /nfs/dbraw/zinc/22/26/40/1043222640.db2.gz RTWIRAJQVYAVTO-HOTGVXAUSA-N 2 0 326.406 4.203 20 0 EIADRP COc1cccc2cc(C[NH2+]CCCC[N@@H+]3CCCC[C@@H]3C)oc21 ZINC000727643643 1043255499 /nfs/dbraw/zinc/25/54/99/1043255499.db2.gz IEQMPYJGRGAGFB-INIZCTEOSA-N 2 0 330.472 4.186 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)C[C@H]1C ZINC000674005777 1043270398 /nfs/dbraw/zinc/27/03/98/1043270398.db2.gz OKTPLRBLDJJRIR-CRAIPNDOSA-N 2 0 342.449 4.443 20 0 EIADRP CCOc1ccccc1[C@H](CC(C)C)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000166756044 1043312277 /nfs/dbraw/zinc/31/22/77/1043312277.db2.gz PCSDHKPESNIUQL-NSHGMRRFSA-N 2 0 330.516 4.389 20 0 EIADRP c1csc(N2CCC([NH2+]C3CC[NH+](C4CCCCC4)CC3)CC2)c1 ZINC000168404056 1043373406 /nfs/dbraw/zinc/37/34/06/1043373406.db2.gz OLRRGWOQCHXFKE-UHFFFAOYSA-N 2 0 347.572 4.104 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CC2(C)CC(F)(F)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168012806 1043453189 /nfs/dbraw/zinc/45/31/89/1043453189.db2.gz FKQZBWLYAGEQPB-ALXJQNPVSA-N 2 0 336.470 4.453 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(Br)cs1 ZINC000494522382 1043548450 /nfs/dbraw/zinc/54/84/50/1043548450.db2.gz HNFRMTMUYIVMDP-NSHDSACASA-N 2 0 343.334 4.036 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(Cl)c3cccnc23)CC1 ZINC000521196976 1043646550 /nfs/dbraw/zinc/64/65/50/1043646550.db2.gz XSVSRTNOXNJARB-UHFFFAOYSA-N 2 0 345.918 4.442 20 0 EIADRP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+]CC1CC[NH+](C)CC1 ZINC000521222093 1043655113 /nfs/dbraw/zinc/65/51/13/1043655113.db2.gz JUNLHDKIIOTFCT-UVTDQMKNSA-N 2 0 326.406 4.040 20 0 EIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1csc(Cl)c1 ZINC000191348985 1043810317 /nfs/dbraw/zinc/81/03/17/1043810317.db2.gz RAULOUHSOJCRKZ-CYBMUJFWSA-N 2 0 335.904 4.364 20 0 EIADRP COCCC[C@@H]([NH2+]C[C@@H](C)C[NH+]1CCCCC1)c1ccc(F)cc1 ZINC000442723114 1043823669 /nfs/dbraw/zinc/82/36/69/1043823669.db2.gz YONZDLNTGGLDAV-YLJYHZDGSA-N 2 0 336.495 4.005 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CC(C)(C)c2ccc(C(F)(F)F)cc2)CC[N@@H+]1C ZINC000191548918 1043825357 /nfs/dbraw/zinc/82/53/57/1043825357.db2.gz MDHZUEBSKVIIJX-CZUORRHYSA-N 2 0 328.422 4.055 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000442793257 1043842068 /nfs/dbraw/zinc/84/20/68/1043842068.db2.gz OAJRERATAJCWEN-NVXWUHKLSA-N 2 0 328.422 4.273 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3ccc4[nH]ccc4c3)CC2)C1 ZINC000442796124 1043842450 /nfs/dbraw/zinc/84/24/50/1043842450.db2.gz FSNUNKJFDWQNQO-DYESRHJHSA-N 2 0 339.527 4.343 20 0 EIADRP FC(F)(F)c1cccc(CCCC[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000192469801 1043925983 /nfs/dbraw/zinc/92/59/83/1043925983.db2.gz FDGSUYVDSVKXJP-INIZCTEOSA-N 2 0 340.433 4.102 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000521814052 1043980648 /nfs/dbraw/zinc/98/06/48/1043980648.db2.gz UOXPCCXHFAEPSI-HNNXBMFYSA-N 2 0 332.488 4.376 20 0 EIADRP Clc1cccc2c1C[C@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)C2 ZINC001168708770 1044001004 /nfs/dbraw/zinc/00/10/04/1044001004.db2.gz OVYDGORHLVRXCN-GOSISDBHSA-N 2 0 332.919 4.051 20 0 EIADRP Cc1cccc2[nH]c(C[NH2+]C[C@@H]3CC[N@H+](Cc4ccccc4)C3)cc21 ZINC000657452426 1044094829 /nfs/dbraw/zinc/09/48/29/1044094829.db2.gz FJARTXOLDIOFFB-IBGZPJMESA-N 2 0 333.479 4.088 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCC[C@@H]1[C@@H]1CCOC1 ZINC000474043038 1044164245 /nfs/dbraw/zinc/16/42/45/1044164245.db2.gz YUZAUSYSQXRLHW-YPAWHYETSA-N 2 0 344.543 4.212 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000193973954 1044225102 /nfs/dbraw/zinc/22/51/02/1044225102.db2.gz SYSNDIKJARECGP-ZBFHGGJFSA-N 2 0 340.433 4.100 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCCC[C@@H]1[C@@H]1CCOC1 ZINC000474046376 1044284473 /nfs/dbraw/zinc/28/44/73/1044284473.db2.gz NDVFJQFHLMFXCK-YPAWHYETSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CC2(c3ccccn3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168017571 1044311019 /nfs/dbraw/zinc/31/10/19/1044311019.db2.gz BDQWSGDSSPVRDP-CEQLMSFQSA-N 2 0 349.522 4.144 20 0 EIADRP [NH3+]CCCCCC[NH2+][C@H]1CCSc2ccc(Br)cc21 ZINC000843341046 1044317612 /nfs/dbraw/zinc/31/76/12/1044317612.db2.gz BWBVABKSXGOZDE-AWEZNQCLSA-N 2 0 343.334 4.095 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)CC1 ZINC000326984277 1044349300 /nfs/dbraw/zinc/34/93/00/1044349300.db2.gz QWNJBCFMUBSONU-HXUWFJFHSA-N 2 0 326.459 4.237 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3ncccc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168020342 1044379242 /nfs/dbraw/zinc/37/92/42/1044379242.db2.gz MHNNIWZKHMIXGR-DNGCBJQESA-N 2 0 349.522 4.490 20 0 EIADRP COc1ccc(C2(C[NH2+][C@H](C)C3CC[NH+](C)CC3)CCCCC2)cc1 ZINC000675771192 1044484725 /nfs/dbraw/zinc/48/47/25/1044484725.db2.gz NYFUIOZOTSQERY-GOSISDBHSA-N 2 0 344.543 4.217 20 0 EIADRP CCC[C@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccccn1 ZINC000675815276 1044513932 /nfs/dbraw/zinc/51/39/32/1044513932.db2.gz AOJGPKRKCJBZFQ-UWJYYQICSA-N 2 0 341.499 4.214 20 0 EIADRP C[C@H]([NH2+][C@@H](Cc1ccccc1)c1ccccc1F)C1CC[NH+](C)CC1 ZINC000675898223 1044544340 /nfs/dbraw/zinc/54/43/40/1044544340.db2.gz GLNVENRJTNQFMS-JTSKRJEESA-N 2 0 340.486 4.429 20 0 EIADRP CS[C@H](C[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1)C(C)(C)C ZINC000543412096 1044554056 /nfs/dbraw/zinc/55/40/56/1044554056.db2.gz VQRKGHXMMJSPKU-BPQIPLTHSA-N 2 0 326.594 4.397 20 0 EIADRP CC[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc(F)cn1 ZINC000494967978 1044563197 /nfs/dbraw/zinc/56/31/97/1044563197.db2.gz JTKVIZOTIZUMRQ-CTWPCTMYSA-N 2 0 333.495 4.305 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](C/C=C\c2ccncc2)CC1 ZINC000494984909 1044569020 /nfs/dbraw/zinc/56/90/20/1044569020.db2.gz HQEDPDXVFVUXNP-GJEJWFRCSA-N 2 0 327.516 4.071 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3ccc(F)cc32)c1 ZINC000177978428 1044606498 /nfs/dbraw/zinc/60/64/98/1044606498.db2.gz OLVZTOLXHXRKJG-OAQYLSRUSA-N 2 0 326.459 4.443 20 0 EIADRP Clc1nccc2cc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)sc21 ZINC000895352369 1044646974 /nfs/dbraw/zinc/64/69/74/1044646974.db2.gz NQYWNOLIJBQDEE-UHFFFAOYSA-N 2 0 349.931 4.161 20 0 EIADRP Cc1ccccc1[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)C1CCCC1 ZINC000495081004 1044649483 /nfs/dbraw/zinc/64/94/83/1044649483.db2.gz FLTKWKNGFHJEMQ-UNMCSNQZSA-N 2 0 344.543 4.053 20 0 EIADRP C[C@@H]1C[C@@H](Nc2ccc(C[NH3+])c(F)c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168031593 1044831203 /nfs/dbraw/zinc/83/12/03/1044831203.db2.gz AJKMJSYVZQENCK-CWPLJXCYSA-N 2 0 341.474 4.138 20 0 EIADRP C[NH+](C)CC(C)(C)C[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000495255854 1044832023 /nfs/dbraw/zinc/83/20/23/1044832023.db2.gz QTQRKUDYEHQKSJ-LJQANCHMSA-N 2 0 345.918 4.196 20 0 EIADRP C[NH+](C)C[C@@H]1CC[N@H+](CCCCc2ccc(Cl)c(Cl)c2)C1 ZINC000474273494 1044832659 /nfs/dbraw/zinc/83/26/59/1044832659.db2.gz LWLWYJSWXCIFIE-HNNXBMFYSA-N 2 0 329.315 4.200 20 0 EIADRP CCC[C@@H]([NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1)c1cccnc1 ZINC000544570187 1044942822 /nfs/dbraw/zinc/94/28/22/1044942822.db2.gz WPZYJFSKSXZZKF-WIYYLYMNSA-N 2 0 325.500 4.423 20 0 EIADRP CC[N@H+](CCC1CC[NH+](CCc2scnc2C)CC1)CC(C)C ZINC000509029881 1044967410 /nfs/dbraw/zinc/96/74/10/1044967410.db2.gz JGTFQNWOQYZUHO-UHFFFAOYSA-N 2 0 337.577 4.074 20 0 EIADRP S=c1ccn(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c2ccccc12 ZINC000738271545 1045048717 /nfs/dbraw/zinc/04/87/17/1045048717.db2.gz NLNRZMKYIPGWMK-KRWDZBQOSA-N 2 0 341.524 4.279 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[N@H+](C)CCC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000923319176 1045059299 /nfs/dbraw/zinc/05/92/99/1045059299.db2.gz MJDPFPVTIYXRHX-HNSVSWJLSA-N 2 0 329.513 4.210 20 0 EIADRP c1ccc([C@@H]2C[C@@H](N[C@H]3CC[N@@H+]4CCC[C@H]4C3)c3ccccc3O2)cc1 ZINC000922887093 1045085057 /nfs/dbraw/zinc/08/50/57/1045085057.db2.gz YXDDQWCLAJJRSN-VKUXKFIQSA-N 2 0 348.490 4.468 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCCNc3ccccc32)C1 ZINC000347919705 1045097395 /nfs/dbraw/zinc/09/73/95/1045097395.db2.gz KIPXHLLYKJFQPS-UEXGIBASSA-N 2 0 329.532 4.281 20 0 EIADRP Cc1ccc(CC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)o1 ZINC000671741210 1045166311 /nfs/dbraw/zinc/16/63/11/1045166311.db2.gz QVHOBPJPIMZZTM-UHFFFAOYSA-N 2 0 326.484 4.163 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1scnc1C1CC1 ZINC000486943612 1045220771 /nfs/dbraw/zinc/22/07/71/1045220771.db2.gz OAHUWMRKDXHXTO-UHFFFAOYSA-N 2 0 329.513 4.152 20 0 EIADRP Cc1ccc(COc2ccc(C[NH2+]C[C@@H]3CCC[N@@H+](C)C3)cc2)cc1 ZINC000237178384 1045377792 /nfs/dbraw/zinc/37/77/92/1045377792.db2.gz ZUXVTLSWGBONAT-NRFANRHFSA-N 2 0 338.495 4.005 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001168498144 1045455492 /nfs/dbraw/zinc/45/54/92/1045455492.db2.gz QTXMWMNPGDULOT-WIYYLYMNSA-N 2 0 340.486 4.211 20 0 EIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]CCc1cccs1 ZINC000763079953 1045499839 /nfs/dbraw/zinc/49/98/39/1045499839.db2.gz CTXUXOWMXAWYIR-IAGOWNOFSA-N 2 0 328.525 4.037 20 0 EIADRP c1cc(OCC2CC2)ccc1C[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000790972059 1045658296 /nfs/dbraw/zinc/65/82/96/1045658296.db2.gz CHSWXFBBLHPONJ-UHFFFAOYSA-N 2 0 342.527 4.362 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767874492 1045667984 /nfs/dbraw/zinc/66/79/84/1045667984.db2.gz FUWBUTWZHJRUHT-WMZOPIPTSA-N 2 0 340.433 4.369 20 0 EIADRP CCn1cc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)cn1 ZINC000246946361 1045834639 /nfs/dbraw/zinc/83/46/39/1045834639.db2.gz HVBCAFDYUAKRLT-QZTJIDSGSA-N 2 0 340.515 4.128 20 0 EIADRP Cc1cc(C)cc(C[N@@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)c1 ZINC001170206172 1045925399 /nfs/dbraw/zinc/92/53/99/1045925399.db2.gz RJNURJMPOHTNCS-QHCPKHFHSA-N 2 0 334.507 4.401 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc3c(c2)COC3)CC1 ZINC000769544478 1046017552 /nfs/dbraw/zinc/01/75/52/1046017552.db2.gz XGZDMEIYABLGKF-SFHVURJKSA-N 2 0 342.527 4.193 20 0 EIADRP C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1C(F)(F)F ZINC000459390013 1046165039 /nfs/dbraw/zinc/16/50/39/1046165039.db2.gz IAQATAIBKPDHRP-AWEZNQCLSA-N 2 0 349.400 4.420 20 0 EIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1 ZINC000123681455 1046190818 /nfs/dbraw/zinc/19/08/18/1046190818.db2.gz UNQUCVRONAYIRS-QGZVFWFLSA-N 2 0 326.484 4.386 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C(c1ccccc1)c1ccccc1 ZINC000124379855 1046233491 /nfs/dbraw/zinc/23/34/91/1046233491.db2.gz MFHDJIAQENILBZ-RBUKOAKNSA-N 2 0 334.507 4.281 20 0 EIADRP COc1cc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1C ZINC000508698035 1046328053 /nfs/dbraw/zinc/32/80/53/1046328053.db2.gz KSTQEXQRXZCKPL-WIYYLYMNSA-N 2 0 338.495 4.004 20 0 EIADRP Cc1cccc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c1C ZINC000162543871 1046330069 /nfs/dbraw/zinc/33/00/69/1046330069.db2.gz AKRGKCXQXINDAB-GOSISDBHSA-N 2 0 326.484 4.095 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1C ZINC000162557029 1046333278 /nfs/dbraw/zinc/33/32/78/1046333278.db2.gz LUMIAHXWRADHSA-GOSISDBHSA-N 2 0 326.484 4.095 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1C ZINC000162557136 1046333925 /nfs/dbraw/zinc/33/39/25/1046333925.db2.gz LUMIAHXWRADHSA-SFHVURJKSA-N 2 0 326.484 4.095 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cc2c(s1)CCC2 ZINC000162567121 1046353089 /nfs/dbraw/zinc/35/30/89/1046353089.db2.gz JCBWJVNQGJSEBH-OAHLLOKOSA-N 2 0 344.524 4.028 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@H]1Cc1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508709192 1046358792 /nfs/dbraw/zinc/35/87/92/1046358792.db2.gz GMDXFVKHFKIQPO-JBJBFBLISA-N 2 0 334.507 4.118 20 0 EIADRP Cc1ccsc1CC[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508722735 1046426577 /nfs/dbraw/zinc/42/65/77/1046426577.db2.gz UGQANSABYXSSDN-MJGOQNOKSA-N 2 0 328.525 4.099 20 0 EIADRP Cc1cc(N2CCC[C@@H]([NH+](C)C)CC2)c2cc(Cl)cc(C)c2[nH+]1 ZINC000428669406 1046511253 /nfs/dbraw/zinc/51/12/53/1046511253.db2.gz JZIZJYRCJOPUAF-MRXNPFEDSA-N 2 0 331.891 4.426 20 0 EIADRP COc1ccccc1[C@H](C)[NH2+]C[C@H]1CCCN(Cc2cccs2)C1 ZINC000126815755 1046563586 /nfs/dbraw/zinc/56/35/86/1046563586.db2.gz HBSGMMGTHLUOLE-DLBZAZTESA-N 2 0 344.524 4.320 20 0 EIADRP CCCn1c2ccccc2nc1C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000536696229 1046690393 /nfs/dbraw/zinc/69/03/93/1046690393.db2.gz XEJRMGIYTDMSOI-UHFFFAOYSA-N 2 0 342.531 4.000 20 0 EIADRP CC[N@@H+](Cc1cccc(OC)c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536711382 1046721452 /nfs/dbraw/zinc/72/14/52/1046721452.db2.gz TZGQVIYUNRGPAH-NRFANRHFSA-N 2 0 338.495 4.039 20 0 EIADRP Fc1ccc2c(CC[NH2+]C3CC[NH+](C4CCCCC4)CC3)c[nH]c2c1 ZINC000127746313 1046721761 /nfs/dbraw/zinc/72/17/61/1046721761.db2.gz UTASPLSORNLDRJ-UHFFFAOYSA-N 2 0 343.490 4.236 20 0 EIADRP c1ccc([C@@H]2CCC[C@@H]([NH2+]C3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000459498285 1046726794 /nfs/dbraw/zinc/72/67/94/1046726794.db2.gz AGTPLUJFHKMYDP-TZIWHRDSSA-N 2 0 335.495 4.366 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ccccc3C2)CCN1Cc1ccccc1 ZINC000379647797 1046740091 /nfs/dbraw/zinc/74/00/91/1046740091.db2.gz LDHKQHFRDZSORX-YSZBQJHXSA-N 2 0 334.507 4.187 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(-c3ccc(OC)cc3)cc2)[C@H](C)C1 ZINC000536874173 1046838348 /nfs/dbraw/zinc/83/83/48/1046838348.db2.gz CJHDNVFGNKGAKV-VGSWGCGISA-N 2 0 338.495 4.182 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2sc(C)nc2C)CC1)CC(C)C ZINC000536887404 1046848112 /nfs/dbraw/zinc/84/81/12/1046848112.db2.gz WIHOULOGGUWSTO-UHFFFAOYSA-N 2 0 337.577 4.340 20 0 EIADRP C[N@@H+]1CCC[C@@H](CC[NH2+]C2CC(c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000459726848 1046865963 /nfs/dbraw/zinc/86/59/63/1046865963.db2.gz BWUGPPLJBVSNFQ-NXVRBGIVSA-N 2 0 340.433 4.273 20 0 EIADRP Cc1c([C@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)cnn1C(C)(C)C ZINC000786914891 1046881144 /nfs/dbraw/zinc/88/11/44/1046881144.db2.gz HYLUUYVUNPUSCN-IVMQYODDSA-N 2 0 346.563 4.394 20 0 EIADRP C/C(=C/c1ccccc1OC(F)F)C[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459796846 1046892490 /nfs/dbraw/zinc/89/24/90/1046892490.db2.gz WLKVQCLGSLPSTE-RTYFKUQISA-N 2 0 338.442 4.013 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CCC[NH+]2CCCC2)ccc1OC1CCCC1 ZINC000537054049 1046919502 /nfs/dbraw/zinc/91/95/02/1046919502.db2.gz OCCCCBGXESEUNT-QGZVFWFLSA-N 2 0 346.515 4.153 20 0 EIADRP Clc1ccc2c(n1)CC[C@H]2[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000806129150 1047152173 /nfs/dbraw/zinc/15/21/73/1047152173.db2.gz CIQBUIOKDYWUIS-GOSISDBHSA-N 2 0 341.886 4.108 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCc2ccc(Cl)nc21 ZINC000788502882 1047205980 /nfs/dbraw/zinc/20/59/80/1047205980.db2.gz AVUWSXISLUZARS-SFHVURJKSA-N 2 0 343.902 4.354 20 0 EIADRP CC1CC[NH+](CCCC[NH2+][C@H]2COCc3cccc(Cl)c32)CC1 ZINC000788529820 1047228812 /nfs/dbraw/zinc/22/88/12/1047228812.db2.gz ULADMHBUDZCZPR-SFHVURJKSA-N 2 0 336.907 4.013 20 0 EIADRP C[C@H]([NH2+]CCCCCCC[NH+]1CCCC1)c1cn2ccccc2n1 ZINC000788595675 1047243472 /nfs/dbraw/zinc/24/34/72/1047243472.db2.gz USDTUAULNZJGHD-SFHVURJKSA-N 2 0 328.504 4.031 20 0 EIADRP COc1ccc(C[NH2+]C[C@@H](C)C[NH+]2CCCCC2)c2ccccc12 ZINC000325579943 1047261795 /nfs/dbraw/zinc/26/17/95/1047261795.db2.gz NTLFJKCTVBAHFQ-QGZVFWFLSA-N 2 0 326.484 4.060 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)C1 ZINC000129221323 1047334768 /nfs/dbraw/zinc/33/47/68/1047334768.db2.gz ZUGZYLZXYNWOIS-QZTJIDSGSA-N 2 0 340.433 4.493 20 0 EIADRP FC(F)(F)[C@H]1CCC[C@H]([NH2+]C2CC[NH+](CC3CCCC3)CC2)C1 ZINC000129558595 1047430319 /nfs/dbraw/zinc/43/03/19/1047430319.db2.gz XDIOEDIIAWMGDD-RDJZCZTQSA-N 2 0 332.454 4.352 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@@H]2CCN(Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000897793520 1047482574 /nfs/dbraw/zinc/48/25/74/1047482574.db2.gz NYKKORCOSLZHGD-RTBURBONSA-N 2 0 344.568 4.447 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccccc1OC(F)F ZINC000556231101 1047607158 /nfs/dbraw/zinc/60/71/58/1047607158.db2.gz SIWILZIOBUXLGV-HNNXBMFYSA-N 2 0 326.431 4.205 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC(N[C@@H]2CCc3c2cccc3O)CC1 ZINC000130623608 1047755819 /nfs/dbraw/zinc/75/58/19/1047755819.db2.gz SFNKYRYMTNQBSO-CDHQVMDDSA-N 2 0 328.500 4.012 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H](c2ccc(C(F)(F)F)cn2)C2CC2)CC1 ZINC001168305326 1047764753 /nfs/dbraw/zinc/76/47/53/1047764753.db2.gz ICRDNNLDSAOHQB-VMBOVVBDSA-N 2 0 341.421 4.014 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@@H](C)[C@H]2C[C@@H]2c2ccc(OC)cc2)CC1 ZINC000556587131 1047832856 /nfs/dbraw/zinc/83/28/56/1047832856.db2.gz VELJICKUPKWNJX-ZLGUVYLKSA-N 2 0 330.516 4.041 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+]([C@@H]1CCc3c(Cl)cccc3C1)CC2 ZINC001171057502 1047873894 /nfs/dbraw/zinc/87/38/94/1047873894.db2.gz YWNFNZCHJPDZBN-QGZVFWFLSA-N 2 0 332.919 4.005 20 0 EIADRP Cc1ccc2c(C[NH+]3CCC(C4CC[NH+](C)CC4)CC3)c[nH]c2c1 ZINC001136972928 1048017610 /nfs/dbraw/zinc/01/76/10/1048017610.db2.gz FQYYKHJPPZCMHW-UHFFFAOYSA-N 2 0 325.500 4.030 20 0 EIADRP C[NH+]1CCC2(CC[N@H+](Cc3ccc(C(F)(F)F)cc3Cl)C2)CC1 ZINC001143715072 1048160214 /nfs/dbraw/zinc/16/02/14/1048160214.db2.gz AGPUCCARCSUHQQ-UHFFFAOYSA-N 2 0 346.824 4.277 20 0 EIADRP C[NH+](C)Cc1ccc(CC[NH2+][C@H]2CCc3cc(Cl)ccc3C2)cc1 ZINC001171103227 1048183993 /nfs/dbraw/zinc/18/39/93/1048183993.db2.gz ZLVCOZKYYGUGDH-NRFANRHFSA-N 2 0 342.914 4.091 20 0 EIADRP Clc1ccc2c(c1)CC[C@@H]([NH2+]C1CC[NH+](CC3CCC3)CC1)C2 ZINC001171109755 1048218252 /nfs/dbraw/zinc/21/82/52/1048218252.db2.gz MFKRSUXOSRCRCB-HXUWFJFHSA-N 2 0 332.919 4.051 20 0 EIADRP CCCC[NH+]1CCC(C[NH2+][C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171110837 1048226039 /nfs/dbraw/zinc/22/60/39/1048226039.db2.gz PLVMJCJKKMUTEE-HXUWFJFHSA-N 2 0 334.935 4.299 20 0 EIADRP CN(C)c1ccccc1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499126480 1048306930 /nfs/dbraw/zinc/30/69/30/1048306930.db2.gz WPPIZEHJKPAYEC-DKUWSORSSA-N 2 0 349.522 4.038 20 0 EIADRP C[C@H](CC[N@@H+]1CCC[C@]2(CC2(F)F)C1)[NH+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844437262 1048333903 /nfs/dbraw/zinc/33/39/03/1048333903.db2.gz MTLKTALOLQNCTL-OWCLPIDISA-N 2 0 348.428 4.007 20 0 EIADRP c1ccc([C@@H]2CC[C@@H]([NH2+]CC3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000132608419 1048368543 /nfs/dbraw/zinc/36/85/43/1048368543.db2.gz SUHIWPFVIXEILL-NHCUHLMSSA-N 2 0 335.495 4.224 20 0 EIADRP C[NH+](C)CCCCC[NH2+][C@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171138391 1048417342 /nfs/dbraw/zinc/41/73/42/1048417342.db2.gz CLCNMLIFRHWAGG-HNNXBMFYSA-N 2 0 329.315 4.172 20 0 EIADRP CCCCc1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1 ZINC000132797362 1048497754 /nfs/dbraw/zinc/49/77/54/1048497754.db2.gz MAFKPMIZKIMRNM-AZUAARDMSA-N 2 0 344.543 4.181 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+][C@@H]3CCCOCC3)[C@H](C)C2)CC[C@@H]1[NH3+] ZINC001170793291 1048521513 /nfs/dbraw/zinc/52/15/13/1048521513.db2.gz XZMUMOWOUKDTHA-GMSFPVLESA-N 2 0 336.564 4.104 20 0 EIADRP Clc1ncccc1CNC[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000810178715 1048668512 /nfs/dbraw/zinc/66/85/12/1048668512.db2.gz YUTNICHYVKOBRG-SFHVURJKSA-N 2 0 343.902 4.127 20 0 EIADRP c1cc2cccc(C[NH+]3CC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@@H]4C3)c2[nH]1 ZINC001144718328 1048818464 /nfs/dbraw/zinc/81/84/64/1048818464.db2.gz HQZRWDQUAYKAET-IRLDBZIGSA-N 2 0 345.490 4.122 20 0 EIADRP CC(C)n1c2ccccc2nc1[C@H]1CCC[N@@H+]1CCCCCC[NH3+] ZINC000846220264 1048844109 /nfs/dbraw/zinc/84/41/09/1048844109.db2.gz MSXKFOANRCXOLI-LJQANCHMSA-N 2 0 328.504 4.273 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1csc2ccccc21 ZINC000817900676 1049056420 /nfs/dbraw/zinc/05/64/20/1049056420.db2.gz UYNHKSFFUVJSKB-OCCSQVGLSA-N 2 0 325.481 4.475 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[NH2+]C2)ccc1SC(F)F ZINC000817948346 1049063413 /nfs/dbraw/zinc/06/34/13/1049063413.db2.gz YISQGMPNGJVTSY-SCRDCRAPSA-N 2 0 344.471 4.049 20 0 EIADRP [NH3+]CCc1ccc(C[NH2+][C@@H](c2ccccc2F)C2CCCC2)cc1 ZINC000817947343 1049063857 /nfs/dbraw/zinc/06/38/57/1049063857.db2.gz CMVHMMDVNUMMNG-OAQYLSRUSA-N 2 0 326.459 4.348 20 0 EIADRP COc1cc([C@H](C)[NH2+]CCC[NH2+]C(C)C)ccc1SC(F)F ZINC000817953964 1049066962 /nfs/dbraw/zinc/06/69/62/1049066962.db2.gz SZQATLQYEKLPAE-LBPRGKRZSA-N 2 0 332.460 4.049 20 0 EIADRP FC(F)Sc1ccc2c(c1)CCC[C@H]2[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000817976646 1049075504 /nfs/dbraw/zinc/07/55/04/1049075504.db2.gz QCXMIIYYSZTLHQ-HZPDHXFCSA-N 2 0 338.467 4.110 20 0 EIADRP Clc1nccc(C[NH2+]C2CCC([NH+]3CCCCC3)CC2)c1Cl ZINC000811483910 1049079339 /nfs/dbraw/zinc/07/93/39/1049079339.db2.gz RGQBMBFXJGZNLX-UHFFFAOYSA-N 2 0 342.314 4.275 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ccnc(Cl)c2Cl)C1 ZINC000811474205 1049092844 /nfs/dbraw/zinc/09/28/44/1049092844.db2.gz FJOIUHUBXYAABB-OKILXGFUSA-N 2 0 344.330 4.236 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2CCc3cccc(Cl)c3C2)cc1 ZINC001170897545 1049129337 /nfs/dbraw/zinc/12/93/37/1049129337.db2.gz PVRLLAJIZSPLPD-SFHVURJKSA-N 2 0 328.887 4.049 20 0 EIADRP [NH3+]C1(CC2CCC2)CC[NH+]([C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170911178 1049185956 /nfs/dbraw/zinc/18/59/56/1049185956.db2.gz UPSXLQOQHSUFDC-QGZVFWFLSA-N 2 0 332.919 4.181 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170918098 1049232438 /nfs/dbraw/zinc/23/24/38/1049232438.db2.gz SVGFFPWVVAYPCK-BZSNNMDCSA-N 2 0 334.935 4.440 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)[C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170933618 1049353641 /nfs/dbraw/zinc/35/36/41/1049353641.db2.gz IODGJOCXNRQZGZ-GOSISDBHSA-N 2 0 334.935 4.250 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@@H]2CCc3cc(F)cc(F)c3C2)CC1(C)C ZINC001170671253 1049386076 /nfs/dbraw/zinc/38/60/76/1049386076.db2.gz XSGXDYXQJNPWIV-OAHLLOKOSA-N 2 0 336.470 4.063 20 0 EIADRP Oc1ccc2c(c1)[C@H]([NH2+]C1CCC([NH+]3CCCCC3)CC1)CCC2 ZINC000812720545 1049548111 /nfs/dbraw/zinc/54/81/11/1049548111.db2.gz KGNAHYBHYXNDPB-WIXQSORDSA-N 2 0 328.500 4.156 20 0 EIADRP Cc1cccc(C)c1C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000773067025 1049560022 /nfs/dbraw/zinc/56/00/22/1049560022.db2.gz HJOJUTDIHDWJTO-GOSISDBHSA-N 2 0 326.484 4.095 20 0 EIADRP CCC1(C[NH2+][C@H](C)C[C@H]2CCOC2)CC[NH+](Cc2ccccc2)CC1 ZINC000773105041 1049584233 /nfs/dbraw/zinc/58/42/33/1049584233.db2.gz HHJNZRJZMNZCKT-TZIWHRDSSA-N 2 0 344.543 4.084 20 0 EIADRP CCC(CC)[NH+]1CCC(C[NH2+][C@@H]2CCc3c(F)cccc3C2)CC1 ZINC001171411195 1049645664 /nfs/dbraw/zinc/64/56/64/1049645664.db2.gz GMAOXCOKPQYKFM-GOSISDBHSA-N 2 0 332.507 4.173 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1CCc2cc(F)c(F)cc2C1 ZINC001171495143 1049721242 /nfs/dbraw/zinc/72/12/42/1049721242.db2.gz XTNDEBFJWRHBDH-OTWHNJEPSA-N 2 0 348.481 4.161 20 0 EIADRP Cc1cccc2c1CC[C@@H]([N@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171559090 1049754767 /nfs/dbraw/zinc/75/47/67/1049754767.db2.gz VGGJRKZYTOYHMJ-YPAWHYETSA-N 2 0 349.522 4.019 20 0 EIADRP Cc1cccc2c1CC[C@H]([N@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171557460 1049754874 /nfs/dbraw/zinc/75/48/74/1049754874.db2.gz CEYCYRIHGYAKQL-FKBYEOEOSA-N 2 0 349.522 4.019 20 0 EIADRP Cc1cccc2c1CC[C@H]([NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C)C2 ZINC001171573115 1049758717 /nfs/dbraw/zinc/75/87/17/1049758717.db2.gz GNFQTFOEDBDFRO-HBMCJLEFSA-N 2 0 326.528 4.191 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]C2(c3ccc(F)cc3)CCOCC2)CC1(C)C ZINC001171629635 1049762158 /nfs/dbraw/zinc/76/21/58/1049762158.db2.gz AECYPZRRZPEUIR-UHFFFAOYSA-N 2 0 348.506 4.072 20 0 EIADRP Cc1ccc2cccc(C[NH2+]C3CC(C)(C)[NH+](C)C(C)(C)C3)c2n1 ZINC001171628672 1049762294 /nfs/dbraw/zinc/76/22/94/1049762294.db2.gz FSAVBWQICKRBKQ-UHFFFAOYSA-N 2 0 325.500 4.284 20 0 EIADRP COc1cccc(C2([NH2+]C3CC(C)(C)[NH+](C)C(C)(C)C3)CCC2)c1 ZINC001171626777 1049769850 /nfs/dbraw/zinc/76/98/50/1049769850.db2.gz BDPHLVIFVCKZFQ-UHFFFAOYSA-N 2 0 330.516 4.315 20 0 EIADRP Cc1ccc(CC[C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC001171658589 1049771971 /nfs/dbraw/zinc/77/19/71/1049771971.db2.gz TXNNNIOJXHZJKC-NFBKMPQASA-N 2 0 336.523 4.428 20 0 EIADRP C[C@@H]1C[C@H](n2c(C[NH3+])cc3cccc(F)c32)C[N@@H+]1Cc1ccccc1 ZINC001171741661 1049802076 /nfs/dbraw/zinc/80/20/76/1049802076.db2.gz QSJMHHDTQCOPDE-BEFAXECRSA-N 2 0 337.442 4.075 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH+]1CCC([NH3+])(CC2CC2)CC1 ZINC001171964294 1049825273 /nfs/dbraw/zinc/82/52/73/1049825273.db2.gz LXPGIXCVDNERRR-CQSZACIVSA-N 2 0 340.433 4.230 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[C@@H]([NH+](C)C)CC1 ZINC001171962610 1049825392 /nfs/dbraw/zinc/82/53/92/1049825392.db2.gz GDGQLTDPUXAMAP-XYPHTWIQSA-N 2 0 328.422 4.099 20 0 EIADRP CC1(C)C[C@@H]([NH2+]Cc2ccc(F)cc2)CC[N@@H+]1Cc1ccccc1 ZINC001171966220 1049827061 /nfs/dbraw/zinc/82/70/61/1049827061.db2.gz UGHPQZJAGMRFAY-FQEVSTJZSA-N 2 0 326.459 4.359 20 0 EIADRP CC1(C)C[C@@H]([NH+]2CCC(C(F)F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171988969 1049832171 /nfs/dbraw/zinc/83/21/71/1049832171.db2.gz YEQIOKUWPLEYLD-SFHVURJKSA-N 2 0 336.470 4.407 20 0 EIADRP COc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)cc1 ZINC001171969231 1049833523 /nfs/dbraw/zinc/83/35/23/1049833523.db2.gz UOYVCPCSIIQBEJ-HXUWFJFHSA-N 2 0 338.495 4.228 20 0 EIADRP C[C@H](CCCC(C)(C)O)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171972623 1049835110 /nfs/dbraw/zinc/83/51/10/1049835110.db2.gz RRDFWUDAAWBPHJ-UYAOXDASSA-N 2 0 346.559 4.349 20 0 EIADRP Cc1cccc(C(=[NH2+])N[C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)c1 ZINC001171976177 1049837684 /nfs/dbraw/zinc/83/76/84/1049837684.db2.gz QASTWNSOXHVPTO-FQEVSTJZSA-N 2 0 335.495 4.353 20 0 EIADRP CC1(C)C[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C(C)(C)O1 ZINC000245720032 1049838735 /nfs/dbraw/zinc/83/87/35/1049838735.db2.gz OOQTYJZGAFMGEI-YSTOQKLRSA-N 2 0 342.527 4.118 20 0 EIADRP CC1(C)C[C@H]([NH2+]CC2(c3ccccn3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171984162 1049839705 /nfs/dbraw/zinc/83/97/05/1049839705.db2.gz SFWFKTBEGDFXMN-HXUWFJFHSA-N 2 0 349.522 4.146 20 0 EIADRP CC1(C)C[C@@H](N2CC[C@H]([NH3+])c3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC001171984474 1049839821 /nfs/dbraw/zinc/83/98/21/1049839821.db2.gz WBDLPIVSTRLZID-FPOVZHCZSA-N 2 0 349.522 4.340 20 0 EIADRP CCO[C@@H]1CCC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172075205 1049844682 /nfs/dbraw/zinc/84/46/82/1049844682.db2.gz OROAGRMQZDFVLN-CIAFKFPVSA-N 2 0 342.527 4.073 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccncc1 ZINC001172066630 1049851837 /nfs/dbraw/zinc/85/18/37/1049851837.db2.gz JPPHKUJKYSZQNR-HLRQEUIKSA-N 2 0 335.495 4.318 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCc3cc(C(F)(F)F)ccc3C1)C2 ZINC001172127997 1049852708 /nfs/dbraw/zinc/85/27/08/1049852708.db2.gz NHDHFFCBBXHHQZ-PIIMJCKOSA-N 2 0 338.417 4.079 20 0 EIADRP CO[C@H]1CC[C@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172070029 1049853277 /nfs/dbraw/zinc/85/32/77/1049853277.db2.gz IXJKXAMNDOMHJC-UZBCKPFNSA-N 2 0 342.527 4.119 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([N@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001172109907 1049856567 /nfs/dbraw/zinc/85/65/67/1049856567.db2.gz GOXCATJJKNDTNZ-YPHBOWRQSA-N 3 0 347.591 4.154 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](CC1CCOCC1)c1ccccc1)C2 ZINC001172108404 1049857405 /nfs/dbraw/zinc/85/74/05/1049857405.db2.gz AAORPMLCJSBXIZ-YUMYIRISSA-N 2 0 342.527 4.149 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](n1c3ccc(Cl)cc3c3c1CC[NH2+]C3)C2 ZINC001172120164 1049858415 /nfs/dbraw/zinc/85/84/15/1049858415.db2.gz DMCFADXUKJTXMD-ZSHCYNCHSA-N 2 0 343.902 4.128 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC1(Cc3cccc(F)c3)CCC1)C2 ZINC001172112556 1049858538 /nfs/dbraw/zinc/85/85/38/1049858538.db2.gz XPGPDJCLJZHIFH-OWZKRDHZSA-N 2 0 330.491 4.143 20 0 EIADRP Cc1ccc2c(C[C@H](C)[NH3+])cn([C@@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4C)c2c1 ZINC001172113279 1049858987 /nfs/dbraw/zinc/85/89/87/1049858987.db2.gz BTLIXCVKTDMHAZ-KANFNMMFSA-N 2 0 325.500 4.027 20 0 EIADRP C[NH+](C)Cc1ccc(CC[NH2+][C@H]2CCc3c(Cl)cccc3C2)cc1 ZINC001171023631 1049865579 /nfs/dbraw/zinc/86/55/79/1049865579.db2.gz DAXRCZKSUYTKSY-IBGZPJMESA-N 2 0 342.914 4.091 20 0 EIADRP CCC(CC)[NH+]1CCC(C[NH2+][C@H]2CSc3ccccc3C2)CC1 ZINC001172199289 1049869213 /nfs/dbraw/zinc/86/92/13/1049869213.db2.gz VASSACMKFDZHDJ-GOSISDBHSA-N 2 0 332.557 4.194 20 0 EIADRP CC[C@@H](C)OCC[C@H](C)[NH2+]CCC1CC[NH+](Cc2ccccc2)CC1 ZINC001172317867 1049876454 /nfs/dbraw/zinc/87/64/54/1049876454.db2.gz VRWCRZSNOPQFKV-VQTJNVASSA-N 2 0 346.559 4.472 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12 ZINC001172319421 1049877696 /nfs/dbraw/zinc/87/76/96/1049877696.db2.gz QUNPRFHXWOVOBT-MKJVIKKCSA-N 2 0 344.543 4.080 20 0 EIADRP CCC[N@@H+]1CC[C@H](CN[C@H](c2ccccc2)c2ccc(OC)cc2)C1 ZINC000245954244 1049882481 /nfs/dbraw/zinc/88/24/81/1049882481.db2.gz LNQZOYFYNILALM-XMSQKQJNSA-N 2 0 338.495 4.106 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[N@H+](C)C1CCN(Cc2ccccc2)CC1 ZINC001172327955 1049886029 /nfs/dbraw/zinc/88/60/29/1049886029.db2.gz AENGEPFONOVMPI-OALUTQOASA-N 2 0 332.532 4.177 20 0 EIADRP COc1ccccc1CN1CCC([NH2+][C@@H]2CC[C@@H](C)[C@H](C)C2)CC1 ZINC001172359714 1049895619 /nfs/dbraw/zinc/89/56/19/1049895619.db2.gz NHSAEIGPZTWBSO-MBOZVWFJSA-N 2 0 330.516 4.074 20 0 EIADRP CC[C@H](CC(C)C)[NH+]1CCC2(C[C@H]([N@H+](C)Cc3ccco3)CO2)CC1 ZINC001172402920 1049899342 /nfs/dbraw/zinc/89/93/42/1049899342.db2.gz PSRIQKLDUMVNBS-MOPGFXCFSA-N 2 0 348.531 4.160 20 0 EIADRP CCOCC[C@@H](C)[N@@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001172427389 1049901082 /nfs/dbraw/zinc/90/10/82/1049901082.db2.gz OVETZYOVSGKTGP-HXUWFJFHSA-N 2 0 344.543 4.180 20 0 EIADRP CC(C)COCC[C@@H](C)[NH+]1CCC2(CC[N@H+](Cc3ccoc3)C2)CC1 ZINC001172470090 1049908609 /nfs/dbraw/zinc/90/86/09/1049908609.db2.gz GBCXSOXEBZQARW-LJQANCHMSA-N 2 0 348.531 4.019 20 0 EIADRP CC(C)COCC[C@H](C)[NH+]1CCC2(CC[N@H+](Cc3ccoc3)C2)CC1 ZINC001172470089 1049908671 /nfs/dbraw/zinc/90/86/71/1049908671.db2.gz GBCXSOXEBZQARW-IBGZPJMESA-N 2 0 348.531 4.019 20 0 EIADRP COc1cc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)ccc1F ZINC000152664426 1049910012 /nfs/dbraw/zinc/91/00/12/1049910012.db2.gz HKUZRWFLFUWKED-MRXNPFEDSA-N 2 0 342.458 4.281 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccnc2)[C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172554713 1049931641 /nfs/dbraw/zinc/93/16/41/1049931641.db2.gz BSWMPTLOXXKZTC-SSGKUCQKSA-N 2 0 349.522 4.490 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+]([C@@H]2CC[C@@H](c3ccccc3)C2)C2CCOCC2)CC1 ZINC001172556401 1049932358 /nfs/dbraw/zinc/93/23/58/1049932358.db2.gz LXLDGVHWGWNVML-NXLVEIQXSA-N 2 0 342.527 4.074 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[N@H+](C)C1CCC([NH3+])CC1 ZINC001172565996 1049935358 /nfs/dbraw/zinc/93/53/58/1049935358.db2.gz ANMAXRWGPYJYLY-LMWSTFAQSA-N 2 0 330.850 4.141 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](C)CCc2c(F)cc(Cl)cc2F)CC1 ZINC001172566997 1049937002 /nfs/dbraw/zinc/93/70/02/1049937002.db2.gz BHLQBLGZEMZYFS-ZDUSSCGKSA-N 2 0 344.877 4.403 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CCCCC[NH+](C)C ZINC001172576013 1049942937 /nfs/dbraw/zinc/94/29/37/1049942937.db2.gz KYRJCELGWUAJHX-ZDUSSCGKSA-N 2 0 332.866 4.261 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1Cc2ccc(Cl)cc2C1 ZINC001172721649 1049964983 /nfs/dbraw/zinc/96/49/83/1049964983.db2.gz IIPPCFCULXSBKH-ZCNNSNEGSA-N 2 0 332.919 4.146 20 0 EIADRP Clc1ccc2c(c1)C[C@@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)C2 ZINC001172706362 1049971297 /nfs/dbraw/zinc/97/12/97/1049971297.db2.gz GNDLAQVWMUYHNP-NRFANRHFSA-N 2 0 340.898 4.193 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H]1CCN(C)[C@@H](C)C1 ZINC000247044034 1050010985 /nfs/dbraw/zinc/01/09/85/1050010985.db2.gz OIONFXABPGHRHZ-DCGLDWPTSA-N 2 0 347.503 4.391 20 0 EIADRP C[C@H](C[NH2+][C@H](C)[C@H](C)c1nc2ccccc2s1)C[NH+]1CCCC1 ZINC000247046251 1050011065 /nfs/dbraw/zinc/01/10/65/1050011065.db2.gz NABFLIATXLWRBM-OWCLPIDISA-N 2 0 331.529 4.110 20 0 EIADRP Cc1nc(-c2ccc(CC[NH2+][C@@H]3C[C@@H](C)[N@@H+](C)C[C@H]3C)s2)cs1 ZINC000248050826 1050040038 /nfs/dbraw/zinc/04/00/38/1050040038.db2.gz WFPMFNCRTBEFOW-XJKCOSOUSA-N 2 0 349.569 4.041 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(F)cc1N(C)C ZINC000248394303 1050053064 /nfs/dbraw/zinc/05/30/64/1050053064.db2.gz FPTWWGJFYBMTKI-ULQDDVLXSA-N 2 0 347.522 4.195 20 0 EIADRP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(OC)cc1 ZINC000248399828 1050054275 /nfs/dbraw/zinc/05/42/75/1050054275.db2.gz KIMIAYUJTQNZJD-MMOPVJDHSA-N 2 0 330.516 4.389 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCCNc2ccccc2)C3)cc1 ZINC000248997053 1050087489 /nfs/dbraw/zinc/08/74/89/1050087489.db2.gz PGWYTTYZMSJKKF-NUNAXRQHSA-N 2 0 349.522 4.274 20 0 EIADRP CSc1ccc([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000089215219 1050111913 /nfs/dbraw/zinc/11/19/13/1050111913.db2.gz QRBIKOOJTQKAGY-INIZCTEOSA-N 2 0 341.524 4.371 20 0 EIADRP COc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(Cl)c1 ZINC001177142842 1050154680 /nfs/dbraw/zinc/15/46/80/1050154680.db2.gz LZILTYLEXHCPBU-UHFFFAOYSA-N 2 0 344.886 4.234 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2sccc2Br)CC1 ZINC001177294131 1050177952 /nfs/dbraw/zinc/17/79/52/1050177952.db2.gz GHXJZSKJFCANMA-UHFFFAOYSA-N 2 0 345.350 4.112 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([NH2+]C1CC[NH+](C[C@H]3CC=CCC3)CC1)CC2 ZINC001172840137 1050180006 /nfs/dbraw/zinc/18/00/06/1050180006.db2.gz ZRTDEOJAJVJMON-WMZHIEFXSA-N 2 0 338.539 4.263 20 0 EIADRP CC(C)[N@H+]([C@H](C)Cc1c(F)cccc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172847547 1050186107 /nfs/dbraw/zinc/18/61/07/1050186107.db2.gz KMFGNHOLLXTQPW-RBSFLKMASA-N 2 0 326.887 4.390 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[NH2+]CC1CC[NH+](C2CCC2)CC1 ZINC001172848221 1050186575 /nfs/dbraw/zinc/18/65/75/1050186575.db2.gz QYQAXFUGWYZNAU-CQSZACIVSA-N 2 0 338.898 4.264 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[NH2+]C1CC[NH+](CC2CCC2)CC1 ZINC001172847861 1050186781 /nfs/dbraw/zinc/18/67/81/1050186781.db2.gz NOXJORYEXQIURK-CQSZACIVSA-N 2 0 338.898 4.264 20 0 EIADRP COc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cc1OC ZINC000090586764 1050187065 /nfs/dbraw/zinc/18/70/65/1050187065.db2.gz JFAXXFWUQAMPBR-ZWKOTPCHSA-N 2 0 348.531 4.031 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H]([NH2+][C@H](C)Cc2c(F)cccc2Cl)[C@@H](C)C1 ZINC001172849532 1050188631 /nfs/dbraw/zinc/18/86/31/1050188631.db2.gz NPSIXVIBKSUVMT-PMUMKWKESA-N 2 0 326.887 4.119 20 0 EIADRP CC[NH+](CC)Cc1cccc(CNCc2c(F)cc(C)cc2F)c1 ZINC001177315111 1050190694 /nfs/dbraw/zinc/19/06/94/1050190694.db2.gz KACKMJSGKPHJQH-UHFFFAOYSA-N 2 0 332.438 4.405 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)n1cc(CC[NH3+])c2c[nH+]ccc21 ZINC001172851650 1050191354 /nfs/dbraw/zinc/19/13/54/1050191354.db2.gz KQXBUEMSVUPHHZ-LBPRGKRZSA-N 2 0 331.822 4.134 20 0 EIADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2cc(C(F)(F)F)ccc2Cl)CC1 ZINC001206303580 1050209376 /nfs/dbraw/zinc/20/93/76/1050209376.db2.gz CYKPHKCOEPBEQW-OAHLLOKOSA-N 2 0 334.813 4.310 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001172878126 1050218976 /nfs/dbraw/zinc/21/89/76/1050218976.db2.gz INEYFFBTCPOGGA-VNQPRFMTSA-N 2 0 326.937 4.283 20 0 EIADRP c1nn2ccccc2c1C[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC001177566364 1050255783 /nfs/dbraw/zinc/25/57/83/1050255783.db2.gz UKRABQKOCZNLMF-UHFFFAOYSA-N 2 0 348.494 4.000 20 0 EIADRP Cc1ccc(Oc2cccc(C[N@@H+]3CC[C@H]([NH3+])[C@@H](F)CC3)c2)cc1 ZINC001206185390 1050266935 /nfs/dbraw/zinc/26/69/35/1050266935.db2.gz NEXSHDPBOBHIMX-PMACEKPBSA-N 2 0 328.431 4.049 20 0 EIADRP CCCOC1CCC([NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC001173090718 1050283313 /nfs/dbraw/zinc/28/33/13/1050283313.db2.gz GZGHHQSONSPDET-HWELCPFYSA-N 2 0 344.543 4.226 20 0 EIADRP CCC[NH+]1CCC(C[NH2+]Cc2cccc(Oc3ccccn3)c2)CC1 ZINC001177737080 1050287900 /nfs/dbraw/zinc/28/79/00/1050287900.db2.gz JUJYISJORSXHEW-UHFFFAOYSA-N 2 0 339.483 4.086 20 0 EIADRP c1nc2cc(C[NH2+]CCCCCCC[NH+]3CCCC3)ccc2s1 ZINC001177737299 1050288923 /nfs/dbraw/zinc/28/89/23/1050288923.db2.gz LUTHQARHRWDNFO-UHFFFAOYSA-N 2 0 331.529 4.432 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C[C@H](c2ccccc2)N2CCCC2)CC1 ZINC001173101625 1050302099 /nfs/dbraw/zinc/30/20/99/1050302099.db2.gz LQNUCJQHDZSTOJ-LZBANZJXSA-N 2 0 343.559 4.066 20 0 EIADRP CC[NH+](CC)C1CCC(N2CCC[C@@H]([NH3+])c3cc(C)ccc32)CC1 ZINC001173104238 1050305423 /nfs/dbraw/zinc/30/54/23/1050305423.db2.gz LPDJOYNECIYRBT-AFMYVXGZSA-N 2 0 329.532 4.248 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2(c3ccccc3OC)CCC2)CC1 ZINC001173107283 1050307073 /nfs/dbraw/zinc/30/70/73/1050307073.db2.gz NGEWZEQSOQNMTG-UHFFFAOYSA-N 2 0 330.516 4.317 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CC2(CC3CCC3)CCOCC2)CC1 ZINC001173109831 1050308096 /nfs/dbraw/zinc/30/80/96/1050308096.db2.gz HZSWZGKJIZLJMH-UHFFFAOYSA-N 2 0 336.564 4.216 20 0 EIADRP CC[NH+](CC)C1CCC(n2cc(C[C@@H](C)[NH3+])c3ccccc32)CC1 ZINC001173108110 1050308367 /nfs/dbraw/zinc/30/83/67/1050308367.db2.gz XXKGJDOCDBVKEF-IPJUCJBFSA-N 2 0 327.516 4.357 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCN(c3ccc(C)cc3C)CC2)CC1 ZINC001173114473 1050309610 /nfs/dbraw/zinc/30/96/10/1050309610.db2.gz LXESUOYHHXNJEQ-UHFFFAOYSA-N 2 0 343.559 4.078 20 0 EIADRP CC[NH+](CC)C1CCC(n2c3ccc(F)cc3c3c2CC[NH2+]C3)CC1 ZINC001173113084 1050310189 /nfs/dbraw/zinc/31/01/89/1050310189.db2.gz IDISEPVFYOALLX-UHFFFAOYSA-N 2 0 343.490 4.252 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CC[C@H](c3cccc(OC)c3)C2)CC1 ZINC001173113104 1050310572 /nfs/dbraw/zinc/31/05/72/1050310572.db2.gz HEZOERYGOTWEBE-HDYDNRTBSA-N 2 0 330.516 4.138 20 0 EIADRP c1ccc(CC2CC[NH+](CCCC[NH2+]C[C@H]3CCC=CO3)CC2)cc1 ZINC000775032927 1050364035 /nfs/dbraw/zinc/36/40/35/1050364035.db2.gz YBXGJBFMKSWZHU-JOCHJYFZSA-N 2 0 342.527 4.004 20 0 EIADRP CC[NH+](CC)C1CC[NH+](C2CCC(Oc3ccccc3)CC2)CC1 ZINC001173204759 1050365155 /nfs/dbraw/zinc/36/51/55/1050365155.db2.gz WRCWWAIZJUSSNG-UHFFFAOYSA-N 2 0 330.516 4.183 20 0 EIADRP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@H+]1C[C@H]2C[NH+](C)C[C@H]2C1 ZINC001173210551 1050369784 /nfs/dbraw/zinc/36/97/84/1050369784.db2.gz MWZFGTFYRQVIFF-YUXAGFNASA-N 2 0 334.507 4.091 20 0 EIADRP CCCC[C@H](CC(C)C)[N@@H+]1CCc2c(CN(C)C)nn(C(C)C)c2C1 ZINC001173263765 1050386271 /nfs/dbraw/zinc/38/62/71/1050386271.db2.gz WWFWKXPTDRBYPD-GOSISDBHSA-N 2 0 348.579 4.489 20 0 EIADRP CCc1ccc(C[C@H](C)[NH+]2CCC([NH+]3CCC(F)CC3)CC2)cc1 ZINC001173242589 1050397150 /nfs/dbraw/zinc/39/71/50/1050397150.db2.gz GWUXQOGCTVJICR-KRWDZBQOSA-N 2 0 332.507 4.078 20 0 EIADRP COc1ccc2cc(C[NH2+]C[C@H]3CCC[N@H+](CC(C)C)C3)ccc2c1 ZINC001178249566 1050409583 /nfs/dbraw/zinc/40/95/83/1050409583.db2.gz QWDKCJWMNUFDDF-LJQANCHMSA-N 2 0 340.511 4.306 20 0 EIADRP Cc1oc2ccccc2c1C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC001178304354 1050432540 /nfs/dbraw/zinc/43/25/40/1050432540.db2.gz DFCLFAURWZKVMG-UHFFFAOYSA-N 2 0 335.451 4.142 20 0 EIADRP CC[N@@H+]1CC[C@@H](n2c(C)c(CC[NH3+])c3c2cc(Cl)cc3Cl)C1 ZINC001173354835 1050440986 /nfs/dbraw/zinc/44/09/86/1050440986.db2.gz JVEQMMGNFJCULS-CYBMUJFWSA-N 2 0 340.298 4.024 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@H]3CCCNc4ccccc43)C2)cc1 ZINC000253355503 1050455270 /nfs/dbraw/zinc/45/52/70/1050455270.db2.gz HNOFEUCVUDALQA-KNQAVFIVSA-N 2 0 335.495 4.045 20 0 EIADRP CC(C)(C)C[N@H+](C1Cc2cc(F)c(F)cc2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173476090 1050458762 /nfs/dbraw/zinc/45/87/62/1050458762.db2.gz OPWNMHLPYKRWTG-WKILWMFISA-N 2 0 336.470 4.050 20 0 EIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000450740966 1050527006 /nfs/dbraw/zinc/52/70/06/1050527006.db2.gz XGNZIOTZYBGJIC-NUJGCVRESA-N 2 0 336.470 4.168 20 0 EIADRP c1ccc2c(c1)CCC21CCC([NH2+]C2CC[NH+](CC3CC3)CC2)CC1 ZINC001173685544 1050538133 /nfs/dbraw/zinc/53/81/33/1050538133.db2.gz WBUURBCVYXDBAZ-UHFFFAOYSA-N 2 0 338.539 4.277 20 0 EIADRP CC[NH+]1CCC(C[NH2+]C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173688200 1050541324 /nfs/dbraw/zinc/54/13/24/1050541324.db2.gz YAYGBVRJQHWJCM-UHFFFAOYSA-N 2 0 326.528 4.135 20 0 EIADRP COC(=O)c1ccc(C[C@@H](C)[NH2+]CC[PH+](C(C)C)C(C)C)cc1 ZINC001173724449 1050554245 /nfs/dbraw/zinc/55/42/45/1050554245.db2.gz YUXXYYCCCKARKC-MRXNPFEDSA-N 2 0 337.444 4.293 20 0 EIADRP COc1ccc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c2ccccc12 ZINC001179257489 1050663070 /nfs/dbraw/zinc/66/30/70/1050663070.db2.gz BJKKZJABILUQAG-GOSISDBHSA-N 2 0 338.495 4.060 20 0 EIADRP CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCCC2)CCO1 ZINC000763533253 1050728071 /nfs/dbraw/zinc/72/80/71/1050728071.db2.gz ZETWSAUIDQAPDU-RTWAWAEBSA-N 2 0 344.543 4.356 20 0 EIADRP CC(C)[C@H](C[NH2+][C@@H](CC[NH+](C)C)c1cccnc1)c1ccccc1 ZINC001179636705 1050746450 /nfs/dbraw/zinc/74/64/50/1050746450.db2.gz KLKVFUZTLXWNQM-SFTDATJTSA-N 2 0 325.500 4.104 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccc(-n3cccn3)cc2)c1 ZINC000069716241 1050773742 /nfs/dbraw/zinc/77/37/42/1050773742.db2.gz AESIWOILCSROOS-UHFFFAOYSA-N 2 0 348.494 4.004 20 0 EIADRP CC[NH+](CC)CC[C@H]([NH2+][C@@H]1CC[C@@H]2COCC[C@@H]2C1)c1ccccc1 ZINC001179805563 1050782046 /nfs/dbraw/zinc/78/20/46/1050782046.db2.gz KBJKKAICFGUQIW-YSFYHYPLSA-N 2 0 344.543 4.254 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2cccc(O)c2)ccc1OC ZINC000182746793 1050811825 /nfs/dbraw/zinc/81/18/25/1050811825.db2.gz QHTTXKCQQKUQID-MRXNPFEDSA-N 2 0 342.483 4.093 20 0 EIADRP C[C@]1(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)CCCS1 ZINC001179918975 1050833181 /nfs/dbraw/zinc/83/31/81/1050833181.db2.gz GEQHTJJWHJCDFZ-NJDAHSKKSA-N 2 0 344.568 4.259 20 0 EIADRP COc1cccc2c(C[NH+]3CCC(CC[NH+](C)C)CC3)cccc12 ZINC001179970035 1050836207 /nfs/dbraw/zinc/83/62/07/1050836207.db2.gz PNCOGXRVUKDEDT-UHFFFAOYSA-N 2 0 326.484 4.012 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2cccn2C2CC2)CC1 ZINC001180051819 1050868796 /nfs/dbraw/zinc/86/87/96/1050868796.db2.gz LYGZLVALQSLRKZ-UHFFFAOYSA-N 2 0 337.511 4.167 20 0 EIADRP Oc1cc(Cl)cc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c1 ZINC001180077738 1050876844 /nfs/dbraw/zinc/87/68/44/1050876844.db2.gz UBAAVTUVUIWGAK-UHFFFAOYSA-N 2 0 336.907 4.134 20 0 EIADRP Fc1cccc(/C=C/C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c1 ZINC001180125218 1050893147 /nfs/dbraw/zinc/89/31/47/1050893147.db2.gz WFEXFPNTNTWLOY-SOFGYWHQSA-N 2 0 330.491 4.427 20 0 EIADRP C[NH+](C)[C@@H]1CCCN(Cc2ccc(SC(F)(F)F)cc2)CC1 ZINC000763604580 1050977391 /nfs/dbraw/zinc/97/73/91/1050977391.db2.gz HOBWEORFGXOLRF-CQSZACIVSA-N 2 0 332.435 4.215 20 0 EIADRP COc1ccc(SCC[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC001180795290 1051080281 /nfs/dbraw/zinc/08/02/81/1051080281.db2.gz UOTZOKJBQUHDPF-IRXDYDNUSA-N 2 0 348.556 4.030 20 0 EIADRP C[C@@H](CCC1CCCCC1)[NH2+]Cc1ccccc1C[N@@H+]1CC[C@H](O)C1 ZINC001180802464 1051088688 /nfs/dbraw/zinc/08/86/88/1051088688.db2.gz QWLFDKWMGRIRJH-AVRDEDQJSA-N 2 0 344.543 4.092 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2cncc(C)c2)ccc1OC ZINC000183402579 1051109095 /nfs/dbraw/zinc/10/90/95/1051109095.db2.gz TWWMWBDEOACFKO-QGZVFWFLSA-N 2 0 341.499 4.091 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@@H](C)Cc2ccco2)ccc1OC ZINC000775365980 1051135245 /nfs/dbraw/zinc/13/52/45/1051135245.db2.gz RTAJJTMJTSOFIH-DLBZAZTESA-N 2 0 344.499 4.412 20 0 EIADRP CC[NH+]1CCC(C[NH+]2CCC(=Cc3ccc(F)c(F)c3)CC2)CC1 ZINC001181134813 1051165266 /nfs/dbraw/zinc/16/52/66/1051165266.db2.gz POPPBKIQWQIXPR-UHFFFAOYSA-N 2 0 334.454 4.176 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@@H](OC)C(C)C)cc1C[NH+]1CCCCC1 ZINC000775396031 1051219563 /nfs/dbraw/zinc/21/95/63/1051219563.db2.gz OWYVVHMMDCBTCK-LAUBAEHRSA-N 2 0 348.531 4.003 20 0 EIADRP COc1ccccc1CCC[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001190826520 1051286905 /nfs/dbraw/zinc/28/69/05/1051286905.db2.gz HRIVAMYJLKUNSL-FQEVSTJZSA-N 2 0 344.543 4.216 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000163229620 1051290234 /nfs/dbraw/zinc/29/02/34/1051290234.db2.gz NUFZEZZDBLTINP-DOTOQJQBSA-N 2 0 341.524 4.119 20 0 EIADRP COCCN1CCC([NH2+][C@H](C)c2cccc(-c3ccccc3)c2)CC1 ZINC000154817544 1051339516 /nfs/dbraw/zinc/33/95/16/1051339516.db2.gz IMNGZPNFTAMNHF-GOSISDBHSA-N 2 0 338.495 4.115 20 0 EIADRP C([C@H]1CCC2(CCCCCC2)O1)[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC001191098494 1051349849 /nfs/dbraw/zinc/34/98/49/1051349849.db2.gz CWLBBRDOYPZTJC-WOJBJXKFSA-N 2 0 334.548 4.209 20 0 EIADRP C([C@@H]1CCC2(CCCCCC2)O1)[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC001191098492 1051351050 /nfs/dbraw/zinc/35/10/50/1051351050.db2.gz CWLBBRDOYPZTJC-UXHICEINSA-N 2 0 334.548 4.209 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(-c3ccccc3OC)cc2)C1 ZINC000163239995 1051357750 /nfs/dbraw/zinc/35/77/50/1051357750.db2.gz FWKAEEXJTUXSQM-ZWKOTPCHSA-N 2 0 338.495 4.355 20 0 EIADRP C[NH+](C)CC(C)(C)C[NH2+]Cc1cn(Cc2ccccc2)c2ccccc12 ZINC000620848950 1051367118 /nfs/dbraw/zinc/36/71/18/1051367118.db2.gz NJUBLNCYIGKQHX-UHFFFAOYSA-N 2 0 349.522 4.367 20 0 EIADRP CO[C@H](CC(C)C)C[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001191358531 1051429821 /nfs/dbraw/zinc/42/98/21/1051429821.db2.gz MMZBVIWRHYQDJR-FGZHOGPDSA-N 2 0 344.543 4.036 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCc2c(Cl)cccc2Cl)C[C@H]1C ZINC001191417636 1051451709 /nfs/dbraw/zinc/45/17/09/1051451709.db2.gz PZSKEHNRLJOPMB-KGLIPLIRSA-N 2 0 329.315 4.341 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2cc[nH]c2c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311009198 1051453176 /nfs/dbraw/zinc/45/31/76/1051453176.db2.gz WXUZODRPQNQOLU-UWJYYQICSA-N 2 0 333.479 4.168 20 0 EIADRP c1ccc2c(c1)NCCC[C@H]2[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000774217883 1051516624 /nfs/dbraw/zinc/51/66/24/1051516624.db2.gz NQTYWWKDXQQHFI-WIXQSORDSA-N 2 0 327.516 4.320 20 0 EIADRP c1cc(N2CCCC2)c(Nc2ccc(C[NH+]3CCCCC3)cc2)c[nH+]1 ZINC001175362549 1051549899 /nfs/dbraw/zinc/54/98/99/1051549899.db2.gz RNNXLUXVWIGGML-UHFFFAOYSA-N 2 0 336.483 4.411 20 0 EIADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cc2cc(Br)ccc2o1 ZINC000271902766 1051556659 /nfs/dbraw/zinc/55/66/59/1051556659.db2.gz VXQQSJNMBHSFGL-LBPRGKRZSA-N 2 0 349.272 4.108 20 0 EIADRP C[C@@H]([NH2+]CCCCCCC[NH+]1CCCC1)c1nc2ccccc2n1C ZINC000774411739 1051583243 /nfs/dbraw/zinc/58/32/43/1051583243.db2.gz QZFOSXFKZUOYJI-GOSISDBHSA-N 2 0 342.531 4.270 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCOCc2ccccc2)cc1 ZINC000156950040 1051583977 /nfs/dbraw/zinc/58/39/77/1051583977.db2.gz JPZRGPCUNDWKHJ-KRWDZBQOSA-N 2 0 335.451 4.048 20 0 EIADRP CCOc1c(Cl)cc(C[N@@H+]2CCC[C@@](F)(C[NH3+])CC2)cc1Cl ZINC001205581399 1051642043 /nfs/dbraw/zinc/64/20/43/1051642043.db2.gz TTZJGVQSVACNGS-INIZCTEOSA-N 2 0 349.277 4.045 20 0 EIADRP CC(C)C[N@H+](CC[C@H]1CCc2ccccc21)CC1CC[NH+](C)CC1 ZINC001175601021 1051664294 /nfs/dbraw/zinc/66/42/94/1051664294.db2.gz FIHXBNXUPWHRFX-OAQYLSRUSA-N 2 0 328.544 4.406 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc2c(c1)OCCCO2 ZINC000157896464 1051682257 /nfs/dbraw/zinc/68/22/57/1051682257.db2.gz LBPMRJVUTZSQRU-MSOLQXFVSA-N 2 0 346.515 4.153 20 0 EIADRP C[C@H]1c2ccccc2C[C@H]1[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1 ZINC001182805608 1051702652 /nfs/dbraw/zinc/70/26/52/1051702652.db2.gz FGOPHISSJHJAOS-PEYKTXOXSA-N 2 0 326.528 4.348 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(SCC(F)F)cc1 ZINC000158103080 1051709009 /nfs/dbraw/zinc/70/90/09/1051709009.db2.gz BFFSAQLGOJJYKT-KGLIPLIRSA-N 2 0 328.472 4.036 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc2ccccc2c1OC(F)F ZINC000158109973 1051711637 /nfs/dbraw/zinc/71/16/37/1051711637.db2.gz STNZCQWGZNPLOD-HUUCEWRRSA-N 2 0 348.437 4.434 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)cc1 ZINC000158142657 1051720190 /nfs/dbraw/zinc/72/01/90/1051720190.db2.gz BJFQOAQJUJBIEY-QZTJIDSGSA-N 2 0 338.495 4.355 20 0 EIADRP C(CC1CC[NH+](CC2([C@H]3CCCCO3)CCC2)CC1)C[NH+]1CCCC1 ZINC001192401578 1051724397 /nfs/dbraw/zinc/72/43/97/1051724397.db2.gz PFRHBRUJDMGLJF-OAQYLSRUSA-N 2 0 348.575 4.314 20 0 EIADRP C[C@@]1(C[NH3+])CCCCN(Cc2cccc(Cl)c2Br)C1 ZINC001206548273 1051754615 /nfs/dbraw/zinc/75/46/15/1051754615.db2.gz IMLMJJOICAKHNY-HNNXBMFYSA-N 2 0 345.712 4.053 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)c1ccccn1 ZINC000158660050 1051773955 /nfs/dbraw/zinc/77/39/55/1051773955.db2.gz ZDBXKPMCAWAMNK-QRVBRYPASA-N 2 0 337.511 4.410 20 0 EIADRP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]CC[C@@H](C)[NH+](C)C ZINC001183105100 1051790759 /nfs/dbraw/zinc/79/07/59/1051790759.db2.gz YHHIGUYBXBWQEK-VXGBXAGGSA-N 2 0 336.829 4.220 20 0 EIADRP Cc1[nH]c2ccccc2c1CC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000158889847 1051795418 /nfs/dbraw/zinc/79/54/18/1051795418.db2.gz LTSCIIUHLWJOQL-UHFFFAOYSA-N 2 0 339.527 4.406 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2nc3ccccc3o2)CC1 ZINC000159065726 1051808379 /nfs/dbraw/zinc/80/83/79/1051808379.db2.gz VAYCIFIEJJBYJC-QGZVFWFLSA-N 2 0 341.499 4.304 20 0 EIADRP C[C@H](CCc1c[nH]c2ccccc12)[NH2+]C[C@H]1CCN1C1CCCC1 ZINC001183238854 1051809519 /nfs/dbraw/zinc/80/95/19/1051809519.db2.gz QKKYXJHQKFFCQI-VQIMIIECSA-N 2 0 325.500 4.096 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1cccc(OC(F)(F)F)c1 ZINC000775549662 1051815620 /nfs/dbraw/zinc/81/56/20/1051815620.db2.gz ZGZFYQFQQKMWJZ-DZGCQCFKSA-N 2 0 330.394 4.110 20 0 EIADRP CCc1ccccc1C[N@@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001175973094 1051854835 /nfs/dbraw/zinc/85/48/35/1051854835.db2.gz JIFMIXAXIGXXBL-PKTZIBPZSA-N 2 0 334.507 4.203 20 0 EIADRP CC(C)(O)c1ccc(C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)cc1 ZINC000775568848 1051863574 /nfs/dbraw/zinc/86/35/74/1051863574.db2.gz LXRFWSAHRBJQHP-UHFFFAOYSA-N 2 0 344.543 4.048 20 0 EIADRP Cc1cc(C[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)cs1 ZINC001193092681 1051876363 /nfs/dbraw/zinc/87/63/63/1051876363.db2.gz FYZBLEDBKOURSW-HOTGVXAUSA-N 2 0 328.525 4.303 20 0 EIADRP C[C@@H]1CC[N@H+](Cc2c(Cl)cccc2C(F)(F)F)CC[C@@H]1C[NH3+] ZINC001205628565 1051913966 /nfs/dbraw/zinc/91/39/66/1051913966.db2.gz VZXUTCYMPLUGOM-VXGBXAGGSA-N 2 0 334.813 4.166 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+]Cc1ccc(C(C)(C)C)cc1 ZINC000621813854 1051957268 /nfs/dbraw/zinc/95/72/68/1051957268.db2.gz WPTIOIKYJCGLFC-UHFFFAOYSA-N 2 0 340.511 4.214 20 0 EIADRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3cc(F)cc(C(F)(F)F)c3)C[C@@H]2C1 ZINC001184303257 1051981992 /nfs/dbraw/zinc/98/19/92/1051981992.db2.gz NZSBTSAGSRRTRN-JKIFEVAISA-N 2 0 344.396 4.007 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C/C=C/c2ccc(OCc3ccccc3)cc2)C1 ZINC000414913739 1051982026 /nfs/dbraw/zinc/98/20/26/1051982026.db2.gz JPUQDRZYYVKOQO-OCXKFJFWSA-N 2 0 336.479 4.138 20 0 EIADRP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CCc3cccc(F)c3)C2)s1 ZINC001194152588 1052090332 /nfs/dbraw/zinc/09/03/32/1052090332.db2.gz DUHOQJFECXYZTM-SFHVURJKSA-N 2 0 346.515 4.192 20 0 EIADRP C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1cccc(OC(F)F)c1 ZINC000298513394 1052112506 /nfs/dbraw/zinc/11/25/06/1052112506.db2.gz RBVNMRBCUMXEMG-AWEZNQCLSA-N 2 0 347.409 4.003 20 0 EIADRP CCC[C@@H]([NH2+]C[C@@H]1CN(Cc2ccccc2)CCCO1)C(C)(C)C ZINC001194426548 1052146104 /nfs/dbraw/zinc/14/61/04/1052146104.db2.gz LBWINWMPIAIAMK-WOJBJXKFSA-N 2 0 332.532 4.082 20 0 EIADRP c1cc2c(s1)CCC[C@@H]2[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000336707878 1052513130 /nfs/dbraw/zinc/51/31/30/1052513130.db2.gz JFXYQAFAHHBICT-HKUYNNGSSA-N 2 0 326.509 4.237 20 0 EIADRP Cc1ccc2cc(C[NH2+]C[C@H]3CC[N@H+](Cc4ccccc4)C3)ccc2n1 ZINC000336810984 1052520682 /nfs/dbraw/zinc/52/06/82/1052520682.db2.gz KLCUPSCENCKCKM-OAQYLSRUSA-N 2 0 345.490 4.155 20 0 EIADRP C[C@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)C1CC[NH+](C)CC1 ZINC000671302702 1052597615 /nfs/dbraw/zinc/59/76/15/1052597615.db2.gz RSCLLFPEEVXYND-ZDUSSCGKSA-N 2 0 349.931 4.283 20 0 EIADRP COc1cc([C@H](C)N[C@@H]2CC[N@H+](C)C(C)(C)C2)ccc1OC(C)C ZINC000623349596 1052630266 /nfs/dbraw/zinc/63/02/66/1052630266.db2.gz GFVBJKDFFPRKOM-DOTOQJQBSA-N 2 0 334.504 4.006 20 0 EIADRP C[N@@H+]1CC[C@@H]([NH2+]CCOc2ccccc2-c2ccccc2)CC1(C)C ZINC000623378450 1052641860 /nfs/dbraw/zinc/64/18/60/1052641860.db2.gz BERVJTMGFAHYNE-LJQANCHMSA-N 2 0 338.495 4.195 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC3c4ccccc4C2c2ccccc23)CC[N@@H+]1C ZINC000177839483 1052692015 /nfs/dbraw/zinc/69/20/15/1052692015.db2.gz HKSRUBZRQXHUFG-IDRARTPTSA-N 2 0 346.518 4.356 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1)CC2 ZINC000177977487 1052696046 /nfs/dbraw/zinc/69/60/46/1052696046.db2.gz ORMSKNVXGPHRJA-JOCHJYFZSA-N 2 0 338.495 4.313 20 0 EIADRP C[C@H]([NH2+]C1(c2ccccc2)CCC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000180347046 1052795518 /nfs/dbraw/zinc/79/55/18/1052795518.db2.gz LRJDQPQXBRAWDV-SFHVURJKSA-N 2 0 338.495 4.357 20 0 EIADRP Cc1csc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)n1 ZINC000623873260 1052827667 /nfs/dbraw/zinc/82/76/67/1052827667.db2.gz BWSPQSFBRHRILB-INIZCTEOSA-N 2 0 329.513 4.014 20 0 EIADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(F)cc1C(F)(F)F ZINC000623887881 1052833717 /nfs/dbraw/zinc/83/37/17/1052833717.db2.gz QFGZAUXIQNADDH-GFCCVEGCSA-N 2 0 332.385 4.227 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CCCc3cc(F)ccc32)ccc1F ZINC000182974251 1052958300 /nfs/dbraw/zinc/95/83/00/1052958300.db2.gz QMKQXUCPFDCCJZ-FQEVSTJZSA-N 2 0 330.422 4.194 20 0 EIADRP Cc1cc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(C)s1 ZINC000381862472 1053105680 /nfs/dbraw/zinc/10/56/80/1053105680.db2.gz JAUMRKJKSPTQCJ-LPHOPBHVSA-N 2 0 328.525 4.365 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(Cl)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000382069721 1053135496 /nfs/dbraw/zinc/13/54/96/1053135496.db2.gz RWYAIVIHTITHSO-QFBILLFUSA-N 2 0 328.887 4.340 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCCO3)c1 ZINC000850432238 1053204569 /nfs/dbraw/zinc/20/45/69/1053204569.db2.gz VGLIMPMFCIXDMP-KRWDZBQOSA-N 2 0 338.495 4.314 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)CCC2 ZINC000339066106 1053217898 /nfs/dbraw/zinc/21/78/98/1053217898.db2.gz BEZRDSBGBNZUQJ-OAQYLSRUSA-N 2 0 326.459 4.363 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)C1 ZINC000339070111 1053319495 /nfs/dbraw/zinc/31/94/95/1053319495.db2.gz WPWCKUPRTRSTIP-CUXKYVRBSA-N 2 0 344.543 4.112 20 0 EIADRP Fc1cccc2c1SCC[C@H]2[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000850582957 1053336220 /nfs/dbraw/zinc/33/62/20/1053336220.db2.gz IHPGYCPPEGFFAD-GOSISDBHSA-N 2 0 334.504 4.074 20 0 EIADRP Cc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000383428563 1053339506 /nfs/dbraw/zinc/33/95/06/1053339506.db2.gz BIUMWIXIEPRFTR-PXNSSMCTSA-N 2 0 326.459 4.134 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc2c(c1)CCO2 ZINC000764973532 1053396834 /nfs/dbraw/zinc/39/68/34/1053396834.db2.gz QSHIXLAIBUKJAC-KZNAEPCWSA-N 2 0 330.516 4.030 20 0 EIADRP CSCC1CCC([NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000385424948 1053523435 /nfs/dbraw/zinc/52/34/35/1053523435.db2.gz LCMVAGVBCYGMHR-MAKTXDPSSA-N 2 0 346.584 4.408 20 0 EIADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C1CCN(c2ccc(N(C)C)cc2)CC1 ZINC000765429526 1053548000 /nfs/dbraw/zinc/54/80/00/1053548000.db2.gz WGUPWLBIYYYQRG-QHCPKHFHSA-N 2 0 349.522 4.307 20 0 EIADRP FC(F)Sc1ccc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc1 ZINC000853093537 1053643331 /nfs/dbraw/zinc/64/33/31/1053643331.db2.gz MLOHDKVIAFFBGR-MRXNPFEDSA-N 2 0 340.483 4.213 20 0 EIADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@H](CCc2ccccc2)c2ccccn2)C1 ZINC000866372469 1053708818 /nfs/dbraw/zinc/70/88/18/1053708818.db2.gz GXFDBBBDCSNYRZ-RBBKRZOGSA-N 2 0 337.511 4.077 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CC[C@H]2CCCS2)C3)cc1 ZINC000866482265 1053746927 /nfs/dbraw/zinc/74/69/27/1053746927.db2.gz ZJEXLENRIZOXDD-YSTOQKLRSA-N 2 0 330.541 4.057 20 0 EIADRP C[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1cc2c(ccnc2Cl)o1 ZINC000866517797 1053765817 /nfs/dbraw/zinc/76/58/17/1053765817.db2.gz MXORFCJXTLDRBZ-ZVLZOBCMSA-N 2 0 335.879 4.395 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386797870 1053829185 /nfs/dbraw/zinc/82/91/85/1053829185.db2.gz MFGQFWZLYGCAFY-DBXWQHBBSA-N 2 0 340.486 4.257 20 0 EIADRP CC(C)C[N@H+](CCCc1c(F)cccc1F)CC1CC[NH+](C)CC1 ZINC001197193453 1053850125 /nfs/dbraw/zinc/85/01/25/1053850125.db2.gz BEKKMACDUPIBMH-UHFFFAOYSA-N 2 0 338.486 4.197 20 0 EIADRP CC(C)C[N@H+](CCc1c(F)cccc1Cl)CC1CC[NH+](C)CC1 ZINC001197194860 1053851528 /nfs/dbraw/zinc/85/15/28/1053851528.db2.gz VQGONIZTAOALSZ-UHFFFAOYSA-N 2 0 340.914 4.321 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccnc(Cl)c1 ZINC000123041955 1054085023 /nfs/dbraw/zinc/08/50/23/1054085023.db2.gz VDLHMUHDUAKBBF-OAHLLOKOSA-N 2 0 329.875 4.182 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCOC(C)(C)C)cc1C[NH+]1CCCCC1 ZINC000776891811 1054096324 /nfs/dbraw/zinc/09/63/24/1054096324.db2.gz YLTXKOKDCCTHKM-QGZVFWFLSA-N 2 0 348.531 4.147 20 0 EIADRP c1cc(C[NH+]2CCCCC2)cc(C[N@@H+]2CCCC[C@]23CCCOC3)c1 ZINC001198830685 1054266123 /nfs/dbraw/zinc/26/61/23/1054266123.db2.gz WMUPCVPQPHHTBK-JOCHJYFZSA-N 2 0 342.527 4.208 20 0 EIADRP Fc1ccccc1CSCC[NH2+]Cc1cc(-n2ccnc2)cs1 ZINC001198901166 1054294661 /nfs/dbraw/zinc/29/46/61/1054294661.db2.gz PYQMTMYOWXKZIE-UHFFFAOYSA-N 2 0 347.484 4.096 20 0 EIADRP Cc1ncccc1C[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC001199171191 1054356822 /nfs/dbraw/zinc/35/68/22/1054356822.db2.gz XTTXDLZGJSZQHU-UHFFFAOYSA-N 2 0 345.490 4.408 20 0 EIADRP COCC[N@H+](C)CCC[NH2+]Cc1ccccc1-c1ccc(C)cc1C ZINC001199238471 1054370478 /nfs/dbraw/zinc/37/04/78/1054370478.db2.gz PNQJVBKQOBBYFC-UHFFFAOYSA-N 2 0 340.511 4.028 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCOC(C)(C)C1 ZINC001199267676 1054376099 /nfs/dbraw/zinc/37/60/99/1054376099.db2.gz QJGWWHLOXFOBHG-PXNSSMCTSA-N 2 0 330.516 4.108 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2nccc3ccccc32)C1 ZINC001199319397 1054390225 /nfs/dbraw/zinc/39/02/25/1054390225.db2.gz AUOGENWNZUVIEQ-ROUUACIJSA-N 2 0 325.500 4.083 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@@H]2CCOC3(CCCCC3)C2)C1 ZINC001199319404 1054390748 /nfs/dbraw/zinc/39/07/48/1054390748.db2.gz AWWHHRCZKBFZIX-VAMGGRTRSA-N 2 0 336.564 4.216 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+][C@H]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC001199321082 1054391980 /nfs/dbraw/zinc/39/19/80/1054391980.db2.gz UYJZZTKBYDONBH-DIGZUXTDSA-N 2 0 344.543 4.210 20 0 EIADRP CC(C)COc1ccc(C[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC001199328726 1054392735 /nfs/dbraw/zinc/39/27/35/1054392735.db2.gz GAWUCGGKXIUIJD-UHFFFAOYSA-N 2 0 332.532 4.323 20 0 EIADRP CC(C)c1ccccc1C[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC001199384396 1054402756 /nfs/dbraw/zinc/40/27/56/1054402756.db2.gz PRMOQGNQTUWRHT-UHFFFAOYSA-N 2 0 326.484 4.040 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CC(C)(C)C[C@@H]3C)CC2)cc1 ZINC001199883385 1054491006 /nfs/dbraw/zinc/49/10/06/1054491006.db2.gz JATRSYMPUHYAAI-LAUBAEHRSA-N 2 0 344.543 4.322 20 0 EIADRP [NH3+][C@H](C[C@H]1CCC[N@H+](Cc2cnc(C3CC3)s2)C1)C1CCCC1 ZINC000873232529 1054509185 /nfs/dbraw/zinc/50/91/85/1054509185.db2.gz SDZZWXWQRPDLKB-RDTXWAMCSA-N 2 0 333.545 4.140 20 0 EIADRP [NH3+][C@H](C[C@H]1CCC[N@H+](Cc2scnc2C2CC2)C1)C1CCCC1 ZINC000873232494 1054510236 /nfs/dbraw/zinc/51/02/36/1054510236.db2.gz RPIAAMVDYVWVOG-RHSMWYFYSA-N 2 0 333.545 4.140 20 0 EIADRP CSc1cccc([C@@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)c2cc(F)ccc2F)c1 ZINC000873250187 1054514547 /nfs/dbraw/zinc/51/45/47/1054514547.db2.gz FJTVXWJUDIXGCC-XFHNUULXSA-N 2 0 348.462 4.103 20 0 EIADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H]2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000873254816 1054515401 /nfs/dbraw/zinc/51/54/01/1054515401.db2.gz BFYDZOASPCSQLG-BASLNEPJSA-N 2 0 326.406 4.059 20 0 EIADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)C1 ZINC000873256687 1054516441 /nfs/dbraw/zinc/51/64/41/1054516441.db2.gz OTVWISKPCACGMF-CQDKDKBSSA-N 2 0 347.915 4.168 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873268034 1054517466 /nfs/dbraw/zinc/51/74/66/1054517466.db2.gz PNNMOJAIHBCJRG-CABCVRRESA-N 2 0 343.540 4.081 20 0 EIADRP CSc1cccc([C@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)c2ccc(F)c(F)c2)c1 ZINC000873255543 1054518259 /nfs/dbraw/zinc/51/82/59/1054518259.db2.gz HJHGBUQJLZOKGB-ODYMNIRHSA-N 2 0 348.462 4.103 20 0 EIADRP CSc1ccc(CN[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)o1 ZINC001200880369 1054565032 /nfs/dbraw/zinc/56/50/32/1054565032.db2.gz SIMJNHSDFTZRMG-NVXWUHKLSA-N 2 0 330.497 4.144 20 0 EIADRP C[N@H+](CCC[NH2+]Cc1ccc(C(F)(F)F)cc1)Cc1ccccc1 ZINC000061556834 1054762037 /nfs/dbraw/zinc/76/20/37/1054762037.db2.gz ICELJFWHTRUOOZ-UHFFFAOYSA-N 2 0 336.401 4.317 20 0 EIADRP C[C@@H](c1ccncc1)N1CCC([NH2+]C2CCC(C(F)F)CC2)CC1 ZINC000282249287 1054775893 /nfs/dbraw/zinc/77/58/93/1054775893.db2.gz JLXSLFHGNOUEJF-OOHWJJMZSA-N 2 0 337.458 4.021 20 0 EIADRP C[N@H+](Cc1ccco1)[C@H]1CCC12CC[NH+](C[C@H]1CC=CCC1)CC2 ZINC001201408955 1054788581 /nfs/dbraw/zinc/78/85/81/1054788581.db2.gz MXIJBXUSFNRJPA-ICSRJNTNSA-N 2 0 328.500 4.312 20 0 EIADRP Cc1noc(C)c1C[N@@H+]1CCCC12CC[NH+](C[C@H]1CC=CCC1)CC2 ZINC001201412217 1054790242 /nfs/dbraw/zinc/79/02/42/1054790242.db2.gz VBWYCNHCACOQLZ-IBGZPJMESA-N 2 0 343.515 4.078 20 0 EIADRP c1csc(C[N@H+]2CCC3(C2)CC[NH+](C[C@H]2CC=CCC2)CC3)c1 ZINC001201410363 1054803278 /nfs/dbraw/zinc/80/32/78/1054803278.db2.gz JPGPYHYPAQMQPE-SFHVURJKSA-N 2 0 330.541 4.392 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2cc(F)ccc2F)C[N@@H+]1Cc1ccccc1 ZINC001201492026 1054819165 /nfs/dbraw/zinc/81/91/65/1054819165.db2.gz PANQHTNAIMUPLH-SJLPKXTDSA-N 2 0 344.449 4.355 20 0 EIADRP c1ccc(CCC[N@@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1 ZINC001201673812 1054872469 /nfs/dbraw/zinc/87/24/69/1054872469.db2.gz PTMLRQATNISFCL-QHCPKHFHSA-N 2 0 334.507 4.217 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cnn(-c3ccccc3)c2)c1 ZINC000765774531 1054896487 /nfs/dbraw/zinc/89/64/87/1054896487.db2.gz DVXGFPHUSDYIQV-GOSISDBHSA-N 2 0 348.494 4.175 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cc3c(ccnc3Cl)o2)CC1 ZINC000876625208 1054939496 /nfs/dbraw/zinc/93/94/96/1054939496.db2.gz RPQDPAFGNGFDJA-UHFFFAOYSA-N 2 0 335.879 4.033 20 0 EIADRP CC[N@H+]([C@@H]1CCOC1)C1CC[NH+](CC[C@H](C)CCC=C(C)C)CC1 ZINC001201981667 1054959727 /nfs/dbraw/zinc/95/97/27/1054959727.db2.gz QLDWCFNTVMZDNC-TZIWHRDSSA-N 2 0 336.564 4.334 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(-c2cccnc2)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001201946722 1054962695 /nfs/dbraw/zinc/96/26/95/1054962695.db2.gz KTXXNFWZQKJBLR-PGRDOPGGSA-N 2 0 349.522 4.491 20 0 EIADRP CCO[P@](C)(=O)CC[C@@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000877080458 1055014445 /nfs/dbraw/zinc/01/44/45/1055014445.db2.gz JELFOUXMNBLHJC-MWTRTKDXSA-N 2 0 344.480 4.096 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@H]2CCC(F)(F)C2)ccc1OC ZINC000777242765 1055043328 /nfs/dbraw/zinc/04/33/28/1055043328.db2.gz PUKMSKRYMGGYAY-YOEHRIQHSA-N 2 0 340.458 4.375 20 0 EIADRP Cc1c(C[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)ccnc1F ZINC000862276935 1055043502 /nfs/dbraw/zinc/04/35/02/1055043502.db2.gz JAUJGSWTLGIIPN-UHFFFAOYSA-N 2 0 341.474 4.051 20 0 EIADRP C[NH+]1CCC2(CCC[N@@H+]2Cc2cc3nc(Cl)ccc3s2)CC1 ZINC000877457847 1055054798 /nfs/dbraw/zinc/05/47/98/1055054798.db2.gz DHNOAJKFQBDDCM-UHFFFAOYSA-N 2 0 335.904 4.010 20 0 EIADRP C[C@@]1(C[NH2+]C/C=C\c2ccc(F)cc2)CC[N@H+](Cc2ccccc2)C1 ZINC001202221008 1055092954 /nfs/dbraw/zinc/09/29/54/1055092954.db2.gz XUTUWIFFHNUYMW-ZQAYIGKJSA-N 2 0 338.470 4.341 20 0 EIADRP c1ccc([C@@H]2C[C@H]([NH2+]CC[C@H]3CCSC3)CCN2C2CC2)cc1 ZINC000877661544 1055102244 /nfs/dbraw/zinc/10/22/44/1055102244.db2.gz DTLXRJAVMCMWGO-HQRMLTQVSA-N 2 0 330.541 4.087 20 0 EIADRP Cc1nc2c(s1)[C@@H]([NH2+]CCCCCCC[NH+]1CCCC1)CCC2 ZINC000765777751 1055272921 /nfs/dbraw/zinc/27/29/21/1055272921.db2.gz XTPHZDVUPVWXKG-KRWDZBQOSA-N 2 0 335.561 4.465 20 0 EIADRP Cc1cc(C[NH2+]C[C@H]2CCCC[N@@H+](C)C2)ccc1Oc1cccnc1 ZINC000623656530 1055526865 /nfs/dbraw/zinc/52/68/65/1055526865.db2.gz WFPBPVXGNAXWRB-LJQANCHMSA-N 2 0 339.483 4.004 20 0 EIADRP Cc1cc([C@H](C)[NH2+]C[C@H]2CCCC[N@H+](C)C2)sc1Br ZINC000623657314 1055533078 /nfs/dbraw/zinc/53/30/78/1055533078.db2.gz NKFOECRTFJJQEL-QWHCGFSZSA-N 2 0 345.350 4.202 20 0 EIADRP c1cc(OC2CCCCC2)ccc1C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000166420958 1055570889 /nfs/dbraw/zinc/57/08/89/1055570889.db2.gz BOSRNQNHHAITAX-RTBURBONSA-N 2 0 328.500 4.115 20 0 EIADRP Cc1cccc(O[C@H]2CCCC[C@H]2[NH2+]C2CC[NH+](C(C)C)CC2)c1 ZINC000542935090 1056804540 /nfs/dbraw/zinc/80/45/40/1056804540.db2.gz ASQFHJLIRJWLPS-RTWAWAEBSA-N 2 0 330.516 4.147 20 0 EIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](CC(C)(C)C)c2ccccc2)CC1 ZINC000181493888 1059464835 /nfs/dbraw/zinc/46/48/35/1059464835.db2.gz OMIOOJPGTGJECC-NRFANRHFSA-N 2 0 345.575 4.171 20 0 EIADRP c1ccc(C[NH+]2CCC(C[NH2+][C@H]3CCCNc4ccccc43)CC2)cc1 ZINC000192734460 1060212387 /nfs/dbraw/zinc/21/23/87/1060212387.db2.gz KGAKKPKJLKGMOU-QHCPKHFHSA-N 2 0 349.522 4.435 20 0 EIADRP Cc1nc(C)c([C@H](C)[NH2+]C[C@H]2CCCN(Cc3ccccc3)C2)s1 ZINC000383343406 1060248767 /nfs/dbraw/zinc/24/87/67/1060248767.db2.gz LNEFHQLOZUKONT-HNAYVOBHSA-N 2 0 343.540 4.323 20 0 EIADRP Cc1nc(C)c([C@@H](C)[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)s1 ZINC000379737956 1060259115 /nfs/dbraw/zinc/25/91/15/1060259115.db2.gz CRMVDNLARQSITM-QRWLVFNGSA-N 2 0 343.540 4.323 20 0 EIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]CCC(C)(C)C)CC1 ZINC001168812730 1060411504 /nfs/dbraw/zinc/41/15/04/1060411504.db2.gz NBXSRVWRUKDOPL-INIZCTEOSA-N 2 0 335.511 4.054 20 0 EIADRP COc1ccc(OC)c([C@@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)c1 ZINC000766510326 1060424492 /nfs/dbraw/zinc/42/44/92/1060424492.db2.gz GTJRVJALYHESFV-WWDZGPRUSA-N 2 0 346.515 4.152 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1ccc2c(c1)COC2 ZINC000766513037 1060483381 /nfs/dbraw/zinc/48/33/81/1060483381.db2.gz OJGMIJQJLCSGAW-YMTQGWHGSA-N 2 0 328.500 4.165 20 0 EIADRP Cc1ccc(CC[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)cc1 ZINC001168993195 1060568967 /nfs/dbraw/zinc/56/89/67/1060568967.db2.gz IRYYHKDZFJPNFV-WOJBJXKFSA-N 2 0 336.523 4.284 20 0 EIADRP CC(C)C[C@H](Cc1ccccc1)[NH2+]C1CC[NH+](CC2CCC2)CC1 ZINC001169067609 1060626205 /nfs/dbraw/zinc/62/62/05/1060626205.db2.gz IRMLIRFMECQORI-JOCHJYFZSA-N 2 0 328.544 4.498 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1c1ccc(N[C@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)nc1 ZINC001169141812 1060663312 /nfs/dbraw/zinc/66/33/12/1060663312.db2.gz KWSLKQMCLDDPLD-WAOWUJCRSA-N 2 0 344.547 4.194 20 0 EIADRP CC1(C)C[C@@H](Nc2ccc([C@@H]3CCC[NH2+]C3)cc2)C[C@](C)(C[NH3+])C1 ZINC001169145230 1060666368 /nfs/dbraw/zinc/66/63/68/1060666368.db2.gz DGPYIKWOCHAIDI-QFUCXCTJSA-N 2 0 329.532 4.109 20 0 EIADRP CC[NH+]1CCC([NH2+]CC(C)(C)Cc2ccccc2C(F)(F)F)CC1 ZINC001169240789 1060715601 /nfs/dbraw/zinc/71/56/01/1060715601.db2.gz DKHDAGLOIYNJAB-UHFFFAOYSA-N 2 0 342.449 4.348 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(C(C)(C)C)c2)[C@@H](C)C1 ZINC001169555157 1060854779 /nfs/dbraw/zinc/85/47/79/1060854779.db2.gz NQRBEKGDIJDOAC-GHTZIAJQSA-N 2 0 346.559 4.211 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H](C)C2)c(C)o1 ZINC000767363246 1061209991 /nfs/dbraw/zinc/20/99/91/1061209991.db2.gz VQCVRTWUJONELZ-MRXNPFEDSA-N 2 0 326.484 4.418 20 0 EIADRP Cc1cc(Nc2ccc(N3CC[NH+](C)CC3)cc2)c2ccccc2[nH+]1 ZINC000052961945 132185711 /nfs/dbraw/zinc/18/57/11/132185711.db2.gz MKIZKMFJTXEUHC-UHFFFAOYSA-N 2 0 332.451 4.039 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]CCCC[N@H+](C)C2CC2)sc1Br ZINC000453393798 1031959050 /nfs/dbraw/zinc/95/90/50/1031959050.db2.gz GKTRQBAVQALMPH-GFCCVEGCSA-N 2 0 345.350 4.344 20 0 EIADRP Cc1cc(C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)sc1Br ZINC000532213206 1032094039 /nfs/dbraw/zinc/09/40/39/1032094039.db2.gz NGFNDJMPFLXSOC-UHFFFAOYSA-N 2 0 345.350 4.218 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@H]3C)s2)cc1 ZINC000532249382 1032111547 /nfs/dbraw/zinc/11/15/47/1032111547.db2.gz WYXNNSZKMKCTEY-SPYBWZPUSA-N 2 0 344.524 4.242 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000509668913 1032272257 /nfs/dbraw/zinc/27/22/57/1032272257.db2.gz FGTXXFXLUJCMRI-QGOAFFKASA-N 2 0 338.495 4.088 20 0 EIADRP Cc1csc([C@H](C)N[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC000245707363 1032405088 /nfs/dbraw/zinc/40/50/88/1032405088.db2.gz MQXXGXRFTKJVJF-KANFNMMFSA-N 2 0 341.524 4.298 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)c1ccc(-n2ccnc2)cc1)COCc1ccccc1 ZINC000389899374 1032426855 /nfs/dbraw/zinc/42/68/55/1032426855.db2.gz ARXSPZCSYSOHDD-MOPGFXCFSA-N 2 0 349.478 4.376 20 0 EIADRP C[C@@H]([NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C)C1CC(F)(F)C1 ZINC000529547949 1032440149 /nfs/dbraw/zinc/44/01/49/1032440149.db2.gz ZHAGYXRYZAPTAB-BZUAXINKSA-N 2 0 336.470 4.166 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1cc(F)ccc1F ZINC000120873147 1032453514 /nfs/dbraw/zinc/45/35/14/1032453514.db2.gz OVBGSELKNJDWNX-LJQANCHMSA-N 2 0 336.401 4.406 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1cc(F)ccc1F ZINC000120872989 1032453887 /nfs/dbraw/zinc/45/38/87/1032453887.db2.gz OVBGSELKNJDWNX-IBGZPJMESA-N 2 0 336.401 4.406 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H]2CC(C)(C)Cc3occc32)ccc1F ZINC000120881734 1032454220 /nfs/dbraw/zinc/45/42/20/1032454220.db2.gz JKGWQNAFRWELPT-GOSISDBHSA-N 2 0 330.447 4.284 20 0 EIADRP CC[C@@H](C)Oc1cc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)ccc1OC ZINC000666755299 1032510403 /nfs/dbraw/zinc/51/04/03/1032510403.db2.gz KMCOEADNZASEOO-HZPDHXFCSA-N 2 0 342.483 4.182 20 0 EIADRP CCC1(C[NH2+]Cc2scnc2C)CC[NH+](Cc2ccccc2)CC1 ZINC000533124429 1032511789 /nfs/dbraw/zinc/51/17/89/1032511789.db2.gz IELMZNIIRVKSTO-UHFFFAOYSA-N 2 0 343.540 4.234 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccsc1 ZINC000177890461 1032524297 /nfs/dbraw/zinc/52/42/97/1032524297.db2.gz KCJAFKGVPRKVAG-BBWFWOEESA-N 2 0 344.524 4.208 20 0 EIADRP CCOc1ccc([C@H](CC)[NH2+]C2CC[NH+](C(C)C)CC2)cc1OCC ZINC000180405647 1032587950 /nfs/dbraw/zinc/58/79/50/1032587950.db2.gz HMSIDXAFZIOOOL-IBGZPJMESA-N 2 0 348.531 4.398 20 0 EIADRP COc1ccc(-c2ccccc2)cc1CNC[C@@H]1CC[N@@H+](C(C)C)C1 ZINC000579765410 1018872819 /nfs/dbraw/zinc/87/28/19/1018872819.db2.gz XUVIFFJWQLZYET-SFHVURJKSA-N 2 0 338.495 4.182 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000643548402 1018925451 /nfs/dbraw/zinc/92/54/51/1018925451.db2.gz OUUMYHPVBGWAPB-ZBFHGGJFSA-N 2 0 342.405 4.301 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH+]2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001208613706 1019461037 /nfs/dbraw/zinc/46/10/37/1019461037.db2.gz YMUBJSLFCPVHKF-UKRRQHHQSA-N 2 0 327.299 4.125 20 0 EIADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(C)c(Br)s2)C1 ZINC001345412333 1019789072 /nfs/dbraw/zinc/78/90/72/1019789072.db2.gz QBHJNYXOAXMQRZ-STQMWFEESA-N 2 0 345.350 4.202 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(CSC(F)F)o2)C1 ZINC000120621237 1019898571 /nfs/dbraw/zinc/89/85/71/1019898571.db2.gz FSBIYEHQFUWLFA-AWEZNQCLSA-N 2 0 346.487 4.337 20 0 EIADRP Fc1ccc([C@@H]([NH2+]CCCn2ccnc2)c2ccccc2Cl)cc1 ZINC000179963240 1019985498 /nfs/dbraw/zinc/98/54/98/1019985498.db2.gz JYIBUCFPGJNHNI-LJQANCHMSA-N 2 0 343.833 4.445 20 0 EIADRP CC(C)n1cc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cn1 ZINC000154877129 1020084062 /nfs/dbraw/zinc/08/40/62/1020084062.db2.gz GLCJEZNFXZTBCU-KRWDZBQOSA-N 2 0 328.504 4.155 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(Br)cc1 ZINC000037786357 1020267933 /nfs/dbraw/zinc/26/79/33/1020267933.db2.gz GKXYIHWWUWSOGE-CYBMUJFWSA-N 2 0 339.321 4.363 20 0 EIADRP COc1ccc2oc([C@@H](C)[NH2+][C@H](C)C3CC[NH+](C)CC3)c(C)c2c1 ZINC000153666290 1020363283 /nfs/dbraw/zinc/36/32/83/1020363283.db2.gz XFKXPXQTLQMDHJ-HUUCEWRRSA-N 2 0 330.472 4.131 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+]CC2CC[NH+](C)CC2)cc1OCCC ZINC000326793218 1020684777 /nfs/dbraw/zinc/68/47/77/1020684777.db2.gz QQEPWGIATWNATG-KRWDZBQOSA-N 2 0 348.531 4.257 20 0 EIADRP Cc1cccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1F ZINC000397487524 1020834375 /nfs/dbraw/zinc/83/43/75/1020834375.db2.gz DNSYGGWJNCLQBA-UHFFFAOYSA-N 2 0 326.459 4.136 20 0 EIADRP C([C@@H]1CCOC1)[NH+]1CCC([NH2+]C2CCC(C3CCCCC3)CC2)CC1 ZINC000683472581 1020849184 /nfs/dbraw/zinc/84/91/84/1020849184.db2.gz RKBHSYXJKIWLBL-PELRDEGISA-N 2 0 348.575 4.216 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc2cc(OC)ccc2c1 ZINC000655806669 1020972127 /nfs/dbraw/zinc/97/21/27/1020972127.db2.gz ZBSFHMFKRIEJAE-MFMILTCTSA-N 2 0 326.484 4.229 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)C1 ZINC000655804315 1020975343 /nfs/dbraw/zinc/97/53/43/1020975343.db2.gz UEZSNSDLUWALIT-JRGCBEDISA-N 2 0 326.459 4.039 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccncc1F ZINC000340473039 1021084985 /nfs/dbraw/zinc/08/49/85/1021084985.db2.gz GBQQKANGUIDLLL-MRXNPFEDSA-N 2 0 327.447 4.057 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCCCC[NH+]2CCCC2)cc1 ZINC000340473002 1021085377 /nfs/dbraw/zinc/08/53/77/1021085377.db2.gz JHCFBUZNEDBAOW-SFHVURJKSA-N 2 0 340.515 4.097 20 0 EIADRP c1ccc([C@@H](C[C@@H]2CCOC2)[NH2+]CCCCC[NH+]2CCCC2)cc1 ZINC000340479278 1021101628 /nfs/dbraw/zinc/10/16/28/1021101628.db2.gz LMFRNFMEDCPRGK-PZJWPPBQSA-N 2 0 330.516 4.010 20 0 EIADRP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000472468663 1021387299 /nfs/dbraw/zinc/38/72/99/1021387299.db2.gz UFXMFZNGXWYSNS-HOCLYGCPSA-N 2 0 340.433 4.430 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccc3cnccc3c2)c1 ZINC000683765940 1021388889 /nfs/dbraw/zinc/38/88/89/1021388889.db2.gz KYMXTFMQJPDFHR-UHFFFAOYSA-N 2 0 333.479 4.366 20 0 EIADRP C[C@H]1C[C@H]([NH2+]C[C@@H]2C[C@H]2c2ccccc2)CCN1Cc1ccccc1 ZINC000570425255 1021433168 /nfs/dbraw/zinc/43/31/68/1021433168.db2.gz OAXCISMVKFWALT-IITNATTFSA-N 2 0 334.507 4.433 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2ccc3cnccc3c2)CC1 ZINC000683772426 1021454504 /nfs/dbraw/zinc/45/45/04/1021454504.db2.gz ROUCGPLGNMGHDH-UHFFFAOYSA-N 2 0 325.500 4.083 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1nc(Br)cs1 ZINC000834487861 1021672840 /nfs/dbraw/zinc/67/28/40/1021672840.db2.gz PFHGUCBPLUQSGE-NEPJUHHUSA-N 2 0 348.354 4.067 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(Cn3ccnc3)cc2)c(C)c1 ZINC000414061123 1021763039 /nfs/dbraw/zinc/76/30/39/1021763039.db2.gz KCUCCBBRRJHNQO-KRWDZBQOSA-N 2 0 335.451 4.099 20 0 EIADRP C[C@@H](CSC(C)(C)C)[NH2+]C1CCN(CCc2ccccc2)CC1 ZINC000177969277 1021835151 /nfs/dbraw/zinc/83/51/51/1021835151.db2.gz NHZSCGVEQDWZIR-KRWDZBQOSA-N 2 0 334.573 4.203 20 0 EIADRP Clc1ccc([C@@H]2CCC[C@H]([NH2+][C@H]3CCn4ccnc4C3)C2)cc1 ZINC000414131996 1021902061 /nfs/dbraw/zinc/90/20/61/1021902061.db2.gz LRWRQGSCOZPAGS-NJAFHUGGSA-N 2 0 329.875 4.167 20 0 EIADRP c1[nH+]cn2cc(C[NH2+][C@@H]3CCCOc4cc5c(cc43)CCCC5)ccc12 ZINC000414162975 1022003197 /nfs/dbraw/zinc/00/31/97/1022003197.db2.gz FIFYHLODOMPJLO-OAQYLSRUSA-N 2 0 347.462 4.217 20 0 EIADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1csc(-c2ccccc2)n1 ZINC000414169522 1022017422 /nfs/dbraw/zinc/01/74/22/1022017422.db2.gz BGFOFIAVLFHPPW-CVEARBPZSA-N 2 0 329.513 4.193 20 0 EIADRP CCc1nc(C(C)C)ccc1C[NH+]1CCC(C[NH+](CC)CC)CC1 ZINC000549366056 1022080658 /nfs/dbraw/zinc/08/06/58/1022080658.db2.gz DBTRFBMEXLJPOK-UHFFFAOYSA-N 2 0 331.548 4.321 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(Cl)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000152900915 1022097490 /nfs/dbraw/zinc/09/74/90/1022097490.db2.gz OSIPUDAVPJUUBW-HNNXBMFYSA-N 2 0 332.875 4.131 20 0 EIADRP CCOc1cccc2cc([C@@H](C)[NH2+]CC[C@@H]3CCC[N@H+](C)C3)oc21 ZINC000414199446 1022105892 /nfs/dbraw/zinc/10/58/92/1022105892.db2.gz XBBOVPBWQIZPGU-CVEARBPZSA-N 2 0 330.472 4.214 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cccc(OC(C)C)c2)CC1 ZINC000613491072 1022156970 /nfs/dbraw/zinc/15/69/70/1022156970.db2.gz DHEJLJOOWKKRIV-UHFFFAOYSA-N 2 0 332.532 4.418 20 0 EIADRP FC(F)(F)c1cccc(C2([NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)CCC2)c1 ZINC000245925495 1033038890 /nfs/dbraw/zinc/03/88/90/1033038890.db2.gz SCHWLBLEPDEOJM-SJORKVTESA-N 2 0 338.417 4.301 20 0 EIADRP Cc1cc(F)ncc1C[NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000892570761 1022239411 /nfs/dbraw/zinc/23/94/11/1022239411.db2.gz NSFIOPSFCUIXSH-KRWDZBQOSA-N 2 0 341.474 4.193 20 0 EIADRP Cc1n[nH]cc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000245956791 1033041447 /nfs/dbraw/zinc/04/14/47/1033041447.db2.gz LZOGSTFYARKRAZ-ZACQAIPSSA-N 2 0 340.515 4.047 20 0 EIADRP Cc1cc(F)ncc1C[NH2+]Cc1ccccc1C[N@H+]1CCC[C@@H](C)C1 ZINC000892581020 1022311086 /nfs/dbraw/zinc/31/10/86/1022311086.db2.gz SDGPPBPBRAYFFD-MRXNPFEDSA-N 2 0 341.474 4.051 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](C[C@H]2CCCC23CCOCC3)C1 ZINC001167424092 1022316149 /nfs/dbraw/zinc/31/61/49/1022316149.db2.gz AXNRWPIMZJTFCO-NJDAHSKKSA-N 2 0 348.575 4.170 20 0 EIADRP CCc1ccc([C@H]([NH2+]CC2(SC)CC[NH+](C)CC2)C(C)C)cc1 ZINC000564434060 1022335109 /nfs/dbraw/zinc/33/51/09/1022335109.db2.gz MGKPLKLHHVCNQS-LJQANCHMSA-N 2 0 334.573 4.363 20 0 EIADRP Clc1ccc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c2ncccc12 ZINC000647543834 1022798093 /nfs/dbraw/zinc/79/80/93/1022798093.db2.gz SRFKPSBBSHAPRI-HOTGVXAUSA-N 2 0 343.902 4.100 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1c(Cl)cccc1Cl ZINC000647550814 1022816472 /nfs/dbraw/zinc/81/64/72/1022816472.db2.gz IUCWIMQEJMDGJG-ZOBORPQBSA-N 2 0 327.299 4.075 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cc(C3CC3)no2)CC1 ZINC000660006657 1022853239 /nfs/dbraw/zinc/85/32/39/1022853239.db2.gz RAMZUYLLDVTOFV-INIZCTEOSA-N 2 0 331.504 4.029 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000423372069 1022857711 /nfs/dbraw/zinc/85/77/11/1022857711.db2.gz QYWNXQAVZQTLGB-PQEBFOHHSA-N 2 0 326.406 4.201 20 0 EIADRP Clc1cccc2c1SCC[C@@H]2[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423388937 1022864506 /nfs/dbraw/zinc/86/45/06/1022864506.db2.gz NUUOMDNBIGTUTC-KRWDZBQOSA-N 2 0 330.884 4.270 20 0 EIADRP Cc1cc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc(C)c1O ZINC000311195078 1022877636 /nfs/dbraw/zinc/87/76/36/1022877636.db2.gz HOSNHISJYLNCSV-FQEVSTJZSA-N 2 0 338.495 4.011 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCCc3nc(C)sc32)cc1 ZINC000163572023 1022930903 /nfs/dbraw/zinc/93/09/03/1022930903.db2.gz DQNYRWDDBUQBNH-GOSISDBHSA-N 2 0 343.540 4.461 20 0 EIADRP C[C@H]([NH2+]CCSCCC(F)(F)F)c1cccc(C[NH+](C)C)c1 ZINC000926801191 1023008057 /nfs/dbraw/zinc/00/80/57/1023008057.db2.gz LZFPQGCRKNEEAZ-ZDUSSCGKSA-N 2 0 334.451 4.084 20 0 EIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccc([C@H](C)[NH3+])cc2)cc1)C(C)C ZINC000178219454 1023074763 /nfs/dbraw/zinc/07/47/63/1023074763.db2.gz HXTDAWJMBBPRCY-INIZCTEOSA-N 2 0 339.483 4.189 20 0 EIADRP Cc1ccccc1SC[C@@H](C)C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC001167457589 1023100716 /nfs/dbraw/zinc/10/07/16/1023100716.db2.gz FXWIEXUNKHSYHR-PKOBYXMFSA-N 2 0 332.557 4.141 20 0 EIADRP Cc1cc(C[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)ccc1Cl ZINC000581397618 1023107761 /nfs/dbraw/zinc/10/77/61/1023107761.db2.gz DTEXWEKBSDKFMK-MRXNPFEDSA-N 2 0 346.902 4.440 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)C1 ZINC000584819126 1023345758 /nfs/dbraw/zinc/34/57/58/1023345758.db2.gz DWIHZDUNRLXAJE-NQIIRXRSSA-N 2 0 326.459 4.041 20 0 EIADRP C[C@@H]([NH2+]CCc1nsc2ccccc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000660255323 1023389334 /nfs/dbraw/zinc/38/93/34/1023389334.db2.gz BAHHSGGXZQOSBJ-HZPDHXFCSA-N 2 0 343.540 4.081 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cccc(OCc2ccccc2F)c1 ZINC000415020749 1023392630 /nfs/dbraw/zinc/39/26/30/1023392630.db2.gz XKHFMNTZUOXSFF-MRXNPFEDSA-N 2 0 330.447 4.012 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000415021370 1023393175 /nfs/dbraw/zinc/39/31/75/1023393175.db2.gz YKIWPJUVZPITIQ-SNVBAGLBSA-N 2 0 342.327 4.331 20 0 EIADRP Cc1ccc(-c2nc(CN3CCCC[C@@H]3[C@H]3CC[NH2+]C3)cs2)cc1 ZINC000415034251 1023401898 /nfs/dbraw/zinc/40/18/98/1023401898.db2.gz CLTYFKNSNKWGIW-PKOBYXMFSA-N 2 0 341.524 4.083 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1csc(-c2cccs2)n1)c1ccccc1 ZINC000415052347 1023409786 /nfs/dbraw/zinc/40/97/86/1023409786.db2.gz KSKKQSGJNRYGAS-INIZCTEOSA-N 2 0 343.521 4.441 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1cnc(-c2ccsc2)s1)c1ccccc1 ZINC000415056729 1023410432 /nfs/dbraw/zinc/41/04/32/1023410432.db2.gz QMFOIOVMHDXVBF-KRWDZBQOSA-N 2 0 343.521 4.441 20 0 EIADRP COc1ccc(C[C@@H](C)C[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1F ZINC000415057568 1023410510 /nfs/dbraw/zinc/41/05/10/1023410510.db2.gz RQUQIJZXASCAKQ-UZLBHIALSA-N 2 0 344.474 4.083 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1cccc(Br)c1)c1ccccc1 ZINC000415069668 1023419419 /nfs/dbraw/zinc/41/94/19/1023419419.db2.gz SZQKCPBDKOBMLI-KRWDZBQOSA-N 2 0 333.273 4.019 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000415082775 1023431696 /nfs/dbraw/zinc/43/16/96/1023431696.db2.gz OVJHQYXCWCQMHB-HOCLYGCPSA-N 2 0 329.513 4.077 20 0 EIADRP c1ccc(OC2CCCC2)c(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)c1 ZINC000415095480 1023440529 /nfs/dbraw/zinc/44/05/29/1023440529.db2.gz ZXIBBDKWFLAVJV-VAMGGRTRSA-N 2 0 328.500 4.018 20 0 EIADRP c1ccc2c(c1)C1C[C@@H](C[NH2+][C@H]3CCC[NH2+]CC3)C2c2ccccc21 ZINC000415110156 1023449097 /nfs/dbraw/zinc/44/90/97/1023449097.db2.gz QDUXIUBJNUNLBT-PQJGELLGSA-N 2 0 332.491 4.015 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ccc2c(c1)OCCCO2 ZINC000119956686 1023458896 /nfs/dbraw/zinc/45/88/96/1023458896.db2.gz YEISMWNZOZUPGT-DLBZAZTESA-N 2 0 334.504 4.009 20 0 EIADRP CC[NH+](CC)C[C@H]1CC[N@H+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500077006 1023484215 /nfs/dbraw/zinc/48/42/15/1023484215.db2.gz VVPQDPXBAIKMFR-JKSUJKDBSA-N 2 0 342.449 4.473 20 0 EIADRP Cc1ccc(C)c(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c1 ZINC000341275238 1023491344 /nfs/dbraw/zinc/49/13/44/1023491344.db2.gz RAAMLMSZTIBDBP-UHFFFAOYSA-N 2 0 338.495 4.066 20 0 EIADRP C[C@@]1(C[NH2+]Cc2cccc3cc[nH]c32)CC[N@H+](Cc2ccccc2)C1 ZINC000310970411 1023494756 /nfs/dbraw/zinc/49/47/56/1023494756.db2.gz DERVVDQDYSFKTG-QFIPXVFZSA-N 2 0 333.479 4.170 20 0 EIADRP C[C@@H](C[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000500106262 1023505657 /nfs/dbraw/zinc/50/56/57/1023505657.db2.gz ZLIHJQSZQXBZLJ-HOTGVXAUSA-N 2 0 340.433 4.227 20 0 EIADRP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)C1 ZINC000684369840 1023539914 /nfs/dbraw/zinc/53/99/14/1023539914.db2.gz BYKOLPKQRJCXQU-IOMROCGXSA-N 2 0 330.516 4.108 20 0 EIADRP CSc1ccc(C[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000310079813 1023544071 /nfs/dbraw/zinc/54/40/71/1023544071.db2.gz IKJJDLZYSPYWFB-NRFANRHFSA-N 2 0 340.536 4.410 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+]Cc2ccc(C3CCC3)cc2)ccc1F ZINC000549755648 1033142195 /nfs/dbraw/zinc/14/21/95/1033142195.db2.gz FHPLDDRJSCSWFS-UHFFFAOYSA-N 2 0 326.459 4.445 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCCCC1(F)F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000394556596 1023607161 /nfs/dbraw/zinc/60/71/61/1023607161.db2.gz IXSPKLHYOKXVBD-WDSOQIARSA-N 2 0 336.470 4.312 20 0 EIADRP CC[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(OC)c(OC)c1 ZINC000120548370 1023626420 /nfs/dbraw/zinc/62/64/20/1023626420.db2.gz QHDSPDZUONDORA-MRXNPFEDSA-N 2 0 334.504 4.054 20 0 EIADRP Cc1ccc([C@H](C2CC2)[N@@H+](C)C2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000377650843 1023653796 /nfs/dbraw/zinc/65/37/96/1023653796.db2.gz NZLVYDRVOSWXDI-JOCHJYFZSA-N 2 0 342.527 4.021 20 0 EIADRP COc1cccc([C@H](C)[NH2+]C2CCN(Cc3ccsc3)CC2)c1 ZINC000364373193 1023690299 /nfs/dbraw/zinc/69/02/99/1023690299.db2.gz GCCXWFVACDCQNZ-HNNXBMFYSA-N 2 0 330.497 4.072 20 0 EIADRP Cc1cc(F)ccc1-c1ccc(CN[C@H]2CC[N@@H+]3CCC[C@@H]3C2)o1 ZINC000377750834 1023741149 /nfs/dbraw/zinc/74/11/49/1023741149.db2.gz WTCJWEDELPJKBG-DLBZAZTESA-N 2 0 328.431 4.111 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1cc(Br)cs1 ZINC000194069341 1023744264 /nfs/dbraw/zinc/74/42/64/1023744264.db2.gz DETRVVSPYMJRFH-UHTWSYAYSA-N 2 0 331.323 4.034 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@@H]3CCC[C@H](c4cccnc4)C3)C2)cc1 ZINC000500382545 1023769805 /nfs/dbraw/zinc/76/98/05/1023769805.db2.gz HQVZFYDPXTVPIL-FUPPJEDESA-N 2 0 349.522 4.220 20 0 EIADRP Cc1c(Br)cccc1C[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000925702620 1023868279 /nfs/dbraw/zinc/86/82/79/1023868279.db2.gz PIKUQPZGRVLPHK-SFHVURJKSA-N 2 0 347.300 4.327 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@H](C)c1cnn(C(C)C)c1C ZINC000468835724 1023924756 /nfs/dbraw/zinc/92/47/56/1023924756.db2.gz GIENQSFELPKZMI-KPFFTGBYSA-N 2 0 334.552 4.324 20 0 EIADRP Clc1ccc(-c2nc(C[NH+]3CCC4(CC[NH2+]C4)CC3)cs2)cc1 ZINC000430929128 1024239799 /nfs/dbraw/zinc/23/97/99/1024239799.db2.gz WHXLMAOORAJUPN-UHFFFAOYSA-N 2 0 347.915 4.039 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ccc(Br)cn1 ZINC000684549452 1024526046 /nfs/dbraw/zinc/52/60/46/1024526046.db2.gz ORYWBSRUJWMIRG-UONOGXRCSA-N 2 0 342.325 4.005 20 0 EIADRP C[C@H]([NH2+]C/C=C/c1ccc(F)c(F)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000511909475 1024745588 /nfs/dbraw/zinc/74/55/88/1024745588.db2.gz FRJMJEVRSDFNCZ-JRKQMZJPSA-N 2 0 334.454 4.221 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]CC2(C)CC[NH+](C)CC2)sc1Br ZINC000511937699 1024818459 /nfs/dbraw/zinc/81/84/59/1024818459.db2.gz JBBUNDONNFFZCP-GFCCVEGCSA-N 2 0 345.350 4.202 20 0 EIADRP COC1CCC(CC[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000548485644 1024839100 /nfs/dbraw/zinc/83/91/00/1024839100.db2.gz ASZZJZHNAJOVFY-JJZDCNPZSA-N 2 0 344.543 4.082 20 0 EIADRP Cc1nccn1CCC[NH+]1CCC(Oc2ccc(C(C)C)cc2)CC1 ZINC000535669627 1024879376 /nfs/dbraw/zinc/87/93/76/1024879376.db2.gz ZWXDLTFYTJYLOM-UHFFFAOYSA-N 2 0 341.499 4.248 20 0 EIADRP COC1(C[C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCC1 ZINC000277057131 1025015549 /nfs/dbraw/zinc/01/55/49/1025015549.db2.gz HQXKEJSVTSXRDZ-LBFURVHYSA-N 2 0 342.527 4.119 20 0 EIADRP c1sc(C2CCCC2)nc1C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662293742 1025044007 /nfs/dbraw/zinc/04/40/07/1025044007.db2.gz MURINDYQGGDRFJ-KRWDZBQOSA-N 2 0 333.545 4.012 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ncc(-c3ccc(Cl)cc3)o2)[C@@H]1CCC[NH3+] ZINC000662314136 1025068600 /nfs/dbraw/zinc/06/86/00/1025068600.db2.gz NBUFVKLZBWGHEU-RHSMWYFYSA-N 2 0 347.890 4.334 20 0 EIADRP CCC1(C[NH2+][C@@H](C)COC(C)C)CC[NH+](Cc2ccccc2)CC1 ZINC000500445243 1025333001 /nfs/dbraw/zinc/33/30/01/1025333001.db2.gz GKRXNLSJDHWQQP-IBGZPJMESA-N 2 0 332.532 4.082 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cc2ccncc2s1 ZINC000663463804 1025393367 /nfs/dbraw/zinc/39/33/67/1025393367.db2.gz BRZVAFHGHKPBGD-ZBFHGGJFSA-N 2 0 329.513 4.069 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)cc1Cl ZINC000663467356 1025397317 /nfs/dbraw/zinc/39/73/17/1025397317.db2.gz DZNBDXODMCLFLT-GOEBONIOSA-N 2 0 336.907 4.121 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cccc(OC(F)F)c1 ZINC000663468246 1025410047 /nfs/dbraw/zinc/41/00/47/1025410047.db2.gz KXTMEOYPHLOFCH-GDBMZVCRSA-N 2 0 338.442 4.061 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2occc2c1 ZINC000511995490 1025592645 /nfs/dbraw/zinc/59/26/45/1025592645.db2.gz ABNDZKZARBUYFV-DYESRHJHSA-N 2 0 334.463 4.433 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](Cc1ccccc1)C1CCOCC1 ZINC001167826582 1025623358 /nfs/dbraw/zinc/62/33/58/1025623358.db2.gz QRYDAXUKWXVBOP-LJQANCHMSA-N 2 0 332.532 4.178 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC2(CC(OCC3CC3)C2)CC1 ZINC001167826648 1025625449 /nfs/dbraw/zinc/62/54/49/1025625449.db2.gz PMXYRDDAWLUQBO-GOSISDBHSA-N 2 0 336.564 4.168 20 0 EIADRP C[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc2ccccc2c1OC(F)F ZINC000643521714 1025685271 /nfs/dbraw/zinc/68/52/71/1025685271.db2.gz YNOLBEOXENXYPK-HIFRSBDPSA-N 2 0 334.410 4.234 20 0 EIADRP c1cncc([C@H]2CCC[C@H]([NH2+]C3CC[NH+](CC4CCCC4)CC3)C2)c1 ZINC000500449341 1025695093 /nfs/dbraw/zinc/69/50/93/1025695093.db2.gz YXMRQDFBHAFWKO-UGKGYDQZSA-N 2 0 341.543 4.352 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000512022200 1025750509 /nfs/dbraw/zinc/75/05/09/1025750509.db2.gz FXSCHFIVVNDKQS-LFIBNONCSA-N 2 0 330.516 4.135 20 0 EIADRP CC[C@@H](c1ccccc1)[NH+]1CCN(C[C@@H]2CCCC[N@@H+]2C(C)C)CC1 ZINC001167508355 1025751597 /nfs/dbraw/zinc/75/15/97/1025751597.db2.gz GQPYXPHHLCLNTL-VXKWHMMOSA-N 2 0 343.559 4.018 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(c2ccccc2OC)CC1 ZINC001167839513 1025851918 /nfs/dbraw/zinc/85/19/18/1025851918.db2.gz YQRFQSCWODGAFV-GOSISDBHSA-N 2 0 332.532 4.385 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@H](Cc2ccc(OC)cc2)C1 ZINC001167839908 1025856067 /nfs/dbraw/zinc/85/60/67/1025856067.db2.gz COTPULONLFKIGA-TZIWHRDSSA-N 2 0 346.559 4.460 20 0 EIADRP C[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(OC(C)(C)C)cc1 ZINC000432409161 1025877863 /nfs/dbraw/zinc/87/78/63/1025877863.db2.gz FGQFWCAWVCEDBS-ZWKOTPCHSA-N 2 0 348.531 4.015 20 0 EIADRP CC(C)n1cc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cn1 ZINC000163945831 1025879765 /nfs/dbraw/zinc/87/97/65/1025879765.db2.gz SSYQNVQQBPUATK-GOSISDBHSA-N 2 0 340.515 4.301 20 0 EIADRP Cc1cc(N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)c2cc(Cl)cc(C)c2[nH+]1 ZINC000467023835 1025889181 /nfs/dbraw/zinc/88/91/81/1025889181.db2.gz MPKRXTPEDLBTRJ-CVEARBPZSA-N 2 0 329.875 4.178 20 0 EIADRP CCO[C@H]1C[C@H]([NH2+]Cc2ccc(Cn3ccnc3)cc2)C1(CC)CC ZINC000344033677 1025889429 /nfs/dbraw/zinc/88/94/29/1025889429.db2.gz LPXHNRVSHVIAFV-PMACEKPBSA-N 2 0 341.499 4.005 20 0 EIADRP COc1cccc([C@H]2C[C@H](C)C[N@@H+]2CCCCn2ccnc2C)c1 ZINC000344034476 1025890184 /nfs/dbraw/zinc/89/01/84/1025890184.db2.gz FASLQLGNNBFDKQ-OXJNMPFZSA-N 2 0 327.472 4.063 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000585814858 1025943645 /nfs/dbraw/zinc/94/36/45/1025943645.db2.gz VMHBCZQCIBKGAE-HNNXBMFYSA-N 2 0 332.488 4.374 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H](CC2CCC2)c2ccccc2)CC1 ZINC000344069403 1025947508 /nfs/dbraw/zinc/94/75/08/1025947508.db2.gz HXKRMHCBNAEXKE-OAQYLSRUSA-N 2 0 330.516 4.008 20 0 EIADRP c1cncc(-c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)cc2)c1 ZINC001167969364 1025993752 /nfs/dbraw/zinc/99/37/52/1025993752.db2.gz BMVZUGSFYAIJES-NOTZXAQLSA-N 2 0 347.506 4.244 20 0 EIADRP Clc1ccc2c(c1)C[C@@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3CC1CC1)CC2 ZINC001167969822 1026028907 /nfs/dbraw/zinc/02/89/07/1026028907.db2.gz FDJXMIGJBSBOMY-UDEWTMQYSA-N 2 0 344.930 4.192 20 0 EIADRP CCC1(C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)CCOCC1 ZINC000582091756 1026130213 /nfs/dbraw/zinc/13/02/13/1026130213.db2.gz ISXLCEUWOQUPCI-OAQYLSRUSA-N 2 0 344.543 4.085 20 0 EIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](Cc3cccc4cccnc43)C2)CC1 ZINC000512177110 1026234492 /nfs/dbraw/zinc/23/44/92/1026234492.db2.gz FBOXIQKXCAHMEX-LJQANCHMSA-N 2 0 337.511 4.179 20 0 EIADRP Fc1cccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C2CC2)c1 ZINC001167975358 1026251928 /nfs/dbraw/zinc/25/19/28/1026251928.db2.gz NULPOPBQMBSAJM-VTHDOGFWSA-N 2 0 328.475 4.272 20 0 EIADRP CCCCOc1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)cc1OCC ZINC000506851984 1026284146 /nfs/dbraw/zinc/28/41/46/1026284146.db2.gz SGTAVYMEELURMB-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3cc(Cl)cc4cccnc43)C2)CC1 ZINC000550200412 1026334226 /nfs/dbraw/zinc/33/42/26/1026334226.db2.gz IVKZSZDJVLZVCD-QGZVFWFLSA-N 2 0 343.902 4.052 20 0 EIADRP c1ccc(CC2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)cc1 ZINC001167982113 1026384514 /nfs/dbraw/zinc/38/45/14/1026384514.db2.gz XKTUJGDYKJDMOM-AIZNXBIQSA-N 2 0 338.539 4.347 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc2c(c1)CCC2 ZINC000512318488 1026687334 /nfs/dbraw/zinc/68/73/34/1026687334.db2.gz PSCVPWZULWJPBL-XGHQBKJUSA-N 2 0 326.528 4.479 20 0 EIADRP CCOc1cccc2cc([C@@H](C)[NH2+]CC3(C)CC[NH+](C)CC3)oc21 ZINC000507483460 1026812498 /nfs/dbraw/zinc/81/24/98/1026812498.db2.gz RQJHDJWYKIXZDP-OAHLLOKOSA-N 2 0 330.472 4.214 20 0 EIADRP CCCC1CCC(C[NH2+]CC2CC[NH+](C3CCOCC3)CC2)CC1 ZINC000657535159 1026990134 /nfs/dbraw/zinc/99/01/34/1026990134.db2.gz GWSCGQNPEJJKQB-UHFFFAOYSA-N 2 0 336.564 4.074 20 0 EIADRP FC(F)(F)c1cccc(CCCC[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000474470000 1027096975 /nfs/dbraw/zinc/09/69/75/1027096975.db2.gz CYJYJKDSTSAWOZ-QZTJIDSGSA-N 2 0 340.433 4.245 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000474481609 1027116667 /nfs/dbraw/zinc/11/66/67/1027116667.db2.gz YJTDCRICZLBETR-GUDVDZBRSA-N 2 0 332.532 4.289 20 0 EIADRP Cc1[nH+]c2ccccc2c(NC2CC[NH+](CCOC(C)C)CC2)c1C ZINC000302109390 1027221372 /nfs/dbraw/zinc/22/13/72/1027221372.db2.gz YYTDAQIBINAPDQ-UHFFFAOYSA-N 2 0 341.499 4.153 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)C3CCCC3)CC2)cc1 ZINC000474597612 1027261728 /nfs/dbraw/zinc/26/17/28/1027261728.db2.gz JQWWUSLHYBVNMJ-KRWDZBQOSA-N 2 0 330.516 4.076 20 0 EIADRP CC(C)[C@H]1CCC[C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C1 ZINC000657613478 1027291113 /nfs/dbraw/zinc/29/11/13/1027291113.db2.gz KZVIHCPSZJLCAF-LEWJYISDSA-N 2 0 329.532 4.098 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2cc(Cl)cc3cccnc32)CC1 ZINC000054337871 1027300875 /nfs/dbraw/zinc/30/08/75/1027300875.db2.gz WAUVUWBEKQSNMQ-UHFFFAOYSA-N 2 0 331.891 4.052 20 0 EIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]CCN(C)C2CCCCC2)cc1OC ZINC000474629206 1027336891 /nfs/dbraw/zinc/33/68/91/1027336891.db2.gz CSVUBWNXCXJIII-DLBZAZTESA-N 2 0 348.531 4.050 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cccc(Br)c1 ZINC000564989386 1027465321 /nfs/dbraw/zinc/46/53/21/1027465321.db2.gz YALZWUXJROUAMG-KRWDZBQOSA-N 2 0 333.273 4.149 20 0 EIADRP C[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)C1CCCC1 ZINC000474809252 1027517296 /nfs/dbraw/zinc/51/72/96/1027517296.db2.gz MMWCEALAXGBHKZ-IBGZPJMESA-N 2 0 344.543 4.226 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474814765 1027536740 /nfs/dbraw/zinc/53/67/40/1027536740.db2.gz DPGHMMAIHRQAML-SBJFKYEJSA-N 2 0 326.937 4.356 20 0 EIADRP CC(C)OC1CCC([NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)CC1 ZINC000090771516 1027593255 /nfs/dbraw/zinc/59/32/55/1027593255.db2.gz AHSNWPQVUIUGER-AXIYNFMDSA-N 2 0 336.564 4.355 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000154106974 1027728367 /nfs/dbraw/zinc/72/83/67/1027728367.db2.gz JRGNRMXETCOHGW-KGLIPLIRSA-N 2 0 344.421 4.009 20 0 EIADRP FC(F)(F)CCC(CCC(F)(F)F)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000657706268 1027759192 /nfs/dbraw/zinc/75/91/92/1027759192.db2.gz KYOPEPAYXVVQLE-CHWSQXEVSA-N 2 0 346.359 4.256 20 0 EIADRP C[C@H]([NH2+]C[C@H](C1CC1)N(C)Cc1ccccc1)C1CCSCC1 ZINC000474921567 1027802508 /nfs/dbraw/zinc/80/25/08/1027802508.db2.gz DAXZWKCQAKUHSH-OXJNMPFZSA-N 2 0 332.557 4.018 20 0 EIADRP C[C@H]([NH2+]C[C@]1(C)CCCN1Cc1ccccc1)C1CCSCC1 ZINC000474923255 1027803408 /nfs/dbraw/zinc/80/34/08/1027803408.db2.gz PIJRFVJUILHMQI-PXNSSMCTSA-N 2 0 332.557 4.162 20 0 EIADRP C[C@@H]([NH2+]C[C@]1(C)CCCN1Cc1ccccc1)C1CCSCC1 ZINC000474923258 1027803495 /nfs/dbraw/zinc/80/34/95/1027803495.db2.gz PIJRFVJUILHMQI-XLIONFOSSA-N 2 0 332.557 4.162 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CC[C@H](C)[NH+]2CCCCC2)cc1OC ZINC000474941546 1027809857 /nfs/dbraw/zinc/80/98/57/1027809857.db2.gz JLHHRLRTIZVMQR-KSZLIROESA-N 2 0 348.531 4.050 20 0 EIADRP C[C@H]1CC([N@H+]2C[C@H]3[C@H](CC3(F)F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168044897 1027886341 /nfs/dbraw/zinc/88/63/41/1027886341.db2.gz HLNMXZKLZJFLDL-BVYOLEPJSA-N 2 0 334.454 4.015 20 0 EIADRP c1cc(-c2ccc(C[N@H+]3CC[C@@H](C[NH+]4CCCC4)C3)cc2)cs1 ZINC000444650121 1027919594 /nfs/dbraw/zinc/91/95/94/1027919594.db2.gz CHXCNLDLOGDBCP-SFHVURJKSA-N 2 0 326.509 4.333 20 0 EIADRP Cc1cccc2nc(C3CC[NH+](CC[C@@H]4CCCC[N@H+]4C)CC3)oc21 ZINC000444780295 1028043162 /nfs/dbraw/zinc/04/31/62/1028043162.db2.gz FSVBBTLLUBEHLF-SFHVURJKSA-N 2 0 341.499 4.190 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(Cl)s1 ZINC000162548496 1028079235 /nfs/dbraw/zinc/07/92/35/1028079235.db2.gz VQJCJNAHOFDSBO-ZDUSSCGKSA-N 2 0 338.904 4.193 20 0 EIADRP Cc1ccc2cc(C[NH2+][C@H](C)[C@H]3CCC[N@@H+](C4CCC4)C3)ccc2n1 ZINC000189427189 1028134362 /nfs/dbraw/zinc/13/43/62/1028134362.db2.gz CAJGRTOOAQKREW-XLIONFOSSA-N 2 0 337.511 4.286 20 0 EIADRP CC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)Cc1cccc(Cl)c1 ZINC000346148197 1028283111 /nfs/dbraw/zinc/28/31/11/1028283111.db2.gz WLGLKOPXQSBYQY-UHFFFAOYSA-N 2 0 340.858 4.251 20 0 EIADRP CC[NH+]1CCC(C[NH2+]Cc2ccc(-c3ccc(F)cc3)s2)CC1 ZINC000583220916 1028283354 /nfs/dbraw/zinc/28/33/54/1028283354.db2.gz RQERELSNFXTGGI-UHFFFAOYSA-N 2 0 332.488 4.376 20 0 EIADRP Cc1cccc(C)c1OCCC[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000523654214 1028295556 /nfs/dbraw/zinc/29/55/56/1028295556.db2.gz ZSPCRDQJULOEAO-UHFFFAOYSA-N 2 0 332.532 4.125 20 0 EIADRP Cc1nc(C)c(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)s1 ZINC000281129899 1028403819 /nfs/dbraw/zinc/40/38/19/1028403819.db2.gz YFHMVTXQKAAGOA-UHFFFAOYSA-N 2 0 343.540 4.293 20 0 EIADRP CCc1nc(C)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)s1 ZINC000162901285 1028530083 /nfs/dbraw/zinc/53/00/83/1028530083.db2.gz HIDUUYLYVYRGQE-HNNXBMFYSA-N 2 0 343.540 4.461 20 0 EIADRP Clc1ccc2c(c1)[C@H]([NH2+]Cc1cccc3c1CC[NH2+]C3)CCS2 ZINC000635011127 1028818917 /nfs/dbraw/zinc/81/89/17/1028818917.db2.gz PDAIAWJSMRIBBF-GOSISDBHSA-N 2 0 344.911 4.312 20 0 EIADRP C[C@@H]([NH2+]CCSCc1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000192637944 1028861125 /nfs/dbraw/zinc/86/11/25/1028861125.db2.gz MMFSLYUYMOXJKV-IEBWSBKVSA-N 2 0 332.557 4.162 20 0 EIADRP C[C@@H]([NH2+]CCSCc1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000192637971 1028861227 /nfs/dbraw/zinc/86/12/27/1028861227.db2.gz MMFSLYUYMOXJKV-MJGOQNOKSA-N 2 0 332.557 4.162 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccc(F)c(Cl)c1Cl ZINC000650720691 1028888671 /nfs/dbraw/zinc/88/86/71/1028888671.db2.gz YUJVGRYQPRYFAA-UHFFFAOYSA-N 2 0 327.230 4.142 20 0 EIADRP CC[NH2+]CC1CC[NH+](Cc2ccc(Oc3cccnc3)c(C)c2)CC1 ZINC000347153482 1028894233 /nfs/dbraw/zinc/89/42/33/1028894233.db2.gz BJFCXSBGZMDEKV-UHFFFAOYSA-N 2 0 339.483 4.004 20 0 EIADRP C[C@@H]([NH3+])C1CC[NH+](Cc2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000347185987 1028909865 /nfs/dbraw/zinc/90/98/65/1028909865.db2.gz ZIKFCARCHDNTAB-GFCCVEGCSA-N 2 0 335.904 4.023 20 0 EIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+]C[C@@H](C)C[NH+]1CCCC1 ZINC000564416151 1028931621 /nfs/dbraw/zinc/93/16/21/1028931621.db2.gz ZOLJWVJKGGILEA-RBFDBLARSA-N 2 0 338.442 4.013 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](CC)c2ccccc2OC(F)F)C1 ZINC000151127571 1029121142 /nfs/dbraw/zinc/12/11/42/1029121142.db2.gz YVJHJHZGSCRUKS-ZBFHGGJFSA-N 2 0 326.431 4.061 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc(Cl)cc(Cl)c1 ZINC000650753467 1029153730 /nfs/dbraw/zinc/15/37/30/1029153730.db2.gz NTQXGIOYWRZJBU-JTQLQIEISA-N 2 0 327.230 4.442 20 0 EIADRP Cc1nc(F)ccc1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@@H]1C ZINC000278441984 1029228790 /nfs/dbraw/zinc/22/87/90/1029228790.db2.gz UTDHKWXRNOPOOX-INIZCTEOSA-N 2 0 341.474 4.193 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2ccc(C(F)F)c(F)c2)CC1 ZINC000896952233 1029236929 /nfs/dbraw/zinc/23/69/29/1029236929.db2.gz VJZUAYHCWHQTLO-UHFFFAOYSA-N 2 0 326.406 4.260 20 0 EIADRP CC(C)CC[NH+]1CCC([NH2+][C@H]2CCO[C@H](c3cccs3)C2)CC1 ZINC000926536926 1029328830 /nfs/dbraw/zinc/32/88/30/1029328830.db2.gz INYXHSYBUGPLMC-ROUUACIJSA-N 2 0 336.545 4.068 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H]1CCCc2occc21 ZINC000192682984 1029361918 /nfs/dbraw/zinc/36/19/18/1029361918.db2.gz JXAGIUWJKOGBJE-IBGZPJMESA-N 2 0 342.483 4.167 20 0 EIADRP COC1CCC(C)(C[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)CC1 ZINC000475211953 1029444828 /nfs/dbraw/zinc/44/48/28/1029444828.db2.gz CPAWARYNNYWMPT-GJHJYOIJSA-N 2 0 336.564 4.214 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)[C@H](C)c1nc2ccccc2s1 ZINC000475219544 1029452345 /nfs/dbraw/zinc/45/23/45/1029452345.db2.gz JQHFRWXYUAWFTH-HOTGVXAUSA-N 2 0 345.556 4.500 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@@H]3CCC[C@@H]3c3ccccc3)C2)cc1 ZINC000475274050 1029480207 /nfs/dbraw/zinc/48/02/07/1029480207.db2.gz HKAOSXPXPKMLRO-YMPZKCBVSA-N 2 0 334.507 4.434 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)cc1F ZINC000168509248 1029488248 /nfs/dbraw/zinc/48/82/48/1029488248.db2.gz LKQMIDIMABTCPU-DLBZAZTESA-N 2 0 344.474 4.486 20 0 EIADRP C[C@H](CCc1cccc(F)c1)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475272456 1029489976 /nfs/dbraw/zinc/48/99/76/1029489976.db2.gz BSHNFTOZHSPGPY-WIYYLYMNSA-N 2 0 340.486 4.259 20 0 EIADRP CC(C)[C@@H](COCc1ccccc1)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000446756402 1029561380 /nfs/dbraw/zinc/56/13/80/1029561380.db2.gz HZAKQOQWTSKGJO-JOCHJYFZSA-N 2 0 340.511 4.079 20 0 EIADRP CCO[C@H](C[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1)c1ccccc1 ZINC000446852782 1029604009 /nfs/dbraw/zinc/60/40/09/1029604009.db2.gz QWVCEESGFMOVEZ-YUXAGFNASA-N 2 0 344.543 4.397 20 0 EIADRP CC[C@H]([NH2+]CCCC[NH+](C)C)c1ccc(Br)cc1Cl ZINC000446842181 1029607243 /nfs/dbraw/zinc/60/72/43/1029607243.db2.gz UZUBOWUUYHFQTP-HNNXBMFYSA-N 2 0 347.728 4.485 20 0 EIADRP CC(C)CCOc1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446884453 1029630676 /nfs/dbraw/zinc/63/06/76/1029630676.db2.gz ONCMOQFNMHNUEU-UHFFFAOYSA-N 2 0 330.516 4.076 20 0 EIADRP CC[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000657834022 1029668023 /nfs/dbraw/zinc/66/80/23/1029668023.db2.gz IDFGTPBPGJVEKP-WBVHZDCISA-N 2 0 340.433 4.100 20 0 EIADRP C[C@H]1CC([NH+]2CCC(C(F)F)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168065798 1029711659 /nfs/dbraw/zinc/71/16/59/1029711659.db2.gz YGDUHVALNFCFQE-HOTGVXAUSA-N 2 0 336.470 4.405 20 0 EIADRP CC1CC[NH+](Cc2ccccc2C[NH2+]C2CC(CF)(CF)C2)CC1 ZINC000657838035 1029733301 /nfs/dbraw/zinc/73/33/01/1029733301.db2.gz MUJSQIGQYQJVSV-UHFFFAOYSA-N 2 0 336.470 4.096 20 0 EIADRP Cc1[nH+]c2ccc(Br)cc2c(NC2CC[NH+](C)CC2)c1C ZINC000301737071 1029801865 /nfs/dbraw/zinc/80/18/65/1029801865.db2.gz RRUSYNDAVXHJAS-UHFFFAOYSA-N 2 0 348.288 4.120 20 0 EIADRP C[C@H]([NH2+][C@@H]1c2ccccc2C[C@@H]1C)c1cccc(OCC[NH+](C)C)c1 ZINC000089613818 1029850971 /nfs/dbraw/zinc/85/09/71/1029850971.db2.gz LMCCYFPHDGVMMT-HOIFWPIMSA-N 2 0 338.495 4.211 20 0 EIADRP Fc1cccc(F)c1-c1ccc(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)o1 ZINC000092072186 1029899451 /nfs/dbraw/zinc/89/94/51/1029899451.db2.gz BMAQODBBWQSPEN-ZDUSSCGKSA-N 2 0 343.377 4.328 20 0 EIADRP Cc1cc(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)c(OC(F)F)cc1C ZINC000092073656 1029899690 /nfs/dbraw/zinc/89/96/90/1029899690.db2.gz WDZLPKXJLDKUBJ-AWEZNQCLSA-N 2 0 335.398 4.008 20 0 EIADRP COc1cc(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)ccc1Cl ZINC000450728075 1029931896 /nfs/dbraw/zinc/93/18/96/1029931896.db2.gz NYJVSADYNSVNNL-HOCLYGCPSA-N 2 0 336.907 4.091 20 0 EIADRP COc1cc(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)ccc1Cl ZINC000450728070 1029934038 /nfs/dbraw/zinc/93/40/38/1029934038.db2.gz NYJVSADYNSVNNL-GDBMZVCRSA-N 2 0 336.907 4.091 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1ccc(F)cn1 ZINC000092742987 1029936716 /nfs/dbraw/zinc/93/67/16/1029936716.db2.gz OOCHXOPASLXORV-KRWDZBQOSA-N 2 0 341.474 4.448 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(OC(F)F)cc1 ZINC000447569470 1030153553 /nfs/dbraw/zinc/15/35/53/1030153553.db2.gz PJAAPKLXGUJQJL-SFHVURJKSA-N 2 0 338.442 4.203 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CCCS2 ZINC000447569194 1030155256 /nfs/dbraw/zinc/15/52/56/1030155256.db2.gz BCRWADDXJDFKCE-IBGZPJMESA-N 2 0 346.540 4.086 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CC2(c3c(Cl)cccc3Cl)CCC2)CC[N@@H+]1C ZINC000447563834 1030172408 /nfs/dbraw/zinc/17/24/08/1030172408.db2.gz FWOBGAWISJEGNH-UONOGXRCSA-N 2 0 341.326 4.487 20 0 EIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CCCO2 ZINC000447575498 1030202389 /nfs/dbraw/zinc/20/23/89/1030202389.db2.gz YGJMDMXLCTZNFV-OAQYLSRUSA-N 2 0 342.527 4.488 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cscc1Br ZINC000302676842 1030247158 /nfs/dbraw/zinc/24/71/58/1030247158.db2.gz NVUSBYJQQMBYGW-LBPRGKRZSA-N 2 0 333.339 4.111 20 0 EIADRP CC[NH+](CC)CCOC1CC[NH+](CC[C@@H](C)c2ccccc2)CC1 ZINC000447729706 1030295812 /nfs/dbraw/zinc/29/58/12/1030295812.db2.gz PLDWOPUODBGNPQ-LJQANCHMSA-N 2 0 332.532 4.003 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCc2c(F)cccc2Cl)C[C@@H]1C ZINC000447723519 1030307778 /nfs/dbraw/zinc/30/77/78/1030307778.db2.gz PQHSWZYRNMKCGF-LSDHHAIUSA-N 2 0 326.887 4.216 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCc2c(F)cccc2Cl)C[C@@H]1C ZINC000447723517 1030309630 /nfs/dbraw/zinc/30/96/30/1030309630.db2.gz PQHSWZYRNMKCGF-GJZGRUSLSA-N 2 0 326.887 4.216 20 0 EIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccc(F)cc3C(F)(F)F)C2)CC1 ZINC000685462795 1030342742 /nfs/dbraw/zinc/34/27/42/1030342742.db2.gz FLHPLUOTMCXRFE-AWEZNQCLSA-N 2 0 344.396 4.008 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccnn2-c2ccccc2)cc1 ZINC000447931832 1030447408 /nfs/dbraw/zinc/44/74/08/1030447408.db2.gz QGRABKAFQFGHDT-UHFFFAOYSA-N 2 0 348.494 4.004 20 0 EIADRP c1csc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000170073576 1030456889 /nfs/dbraw/zinc/45/68/89/1030456889.db2.gz CFQKSPRNMVTUEI-YQQQUEKLSA-N 2 0 326.509 4.076 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1cc(F)cc(F)c1 ZINC000527074099 1030462345 /nfs/dbraw/zinc/46/23/45/1030462345.db2.gz PPWKBYIKZFZJGP-UHFFFAOYSA-N 2 0 345.437 4.098 20 0 EIADRP Cn1cncc1CC[NH2+][C@H](c1cccc(F)c1)c1cccc(Cl)c1 ZINC000530513191 1030504331 /nfs/dbraw/zinc/50/43/31/1030504331.db2.gz QKKRYHMNOZGWFE-IBGZPJMESA-N 2 0 343.833 4.134 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCOc2ccc3ccccc3c2)C[C@@H]1C ZINC000530662944 1030621164 /nfs/dbraw/zinc/62/11/64/1030621164.db2.gz RXDWRDXVDHATOU-PXNSSMCTSA-N 2 0 326.484 4.023 20 0 EIADRP C[C@@H]([NH2+]CCCCOc1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000527354937 1030663670 /nfs/dbraw/zinc/66/36/70/1030663670.db2.gz OAFPUEYSCGKFCQ-RTBURBONSA-N 2 0 330.516 4.088 20 0 EIADRP CC(C)[N@@H+]1CCCC[C@H]1CN1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000451896102 1030770842 /nfs/dbraw/zinc/77/08/42/1030770842.db2.gz BCSXOPDUHYCTQG-IBGZPJMESA-N 2 0 337.596 4.082 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)ccn1 ZINC000527643910 1030797543 /nfs/dbraw/zinc/79/75/43/1030797543.db2.gz YBQLHYLDIROWMS-UHFFFAOYSA-N 2 0 337.511 4.444 20 0 EIADRP C[C@H]1CCc2ccccc2[C@H]1[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658167702 1030864366 /nfs/dbraw/zinc/86/43/66/1030864366.db2.gz SZIMGQNHDXHXBD-MBSDFSHPSA-N 2 0 349.522 4.207 20 0 EIADRP CC(C)CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)C1CC1 ZINC000658166184 1030864382 /nfs/dbraw/zinc/86/43/82/1030864382.db2.gz MXPIGJBPADPPEN-OAQYLSRUSA-N 2 0 329.532 4.098 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)[C@@H](C)c1ccccc1 ZINC000658168733 1030864526 /nfs/dbraw/zinc/86/45/26/1030864526.db2.gz YDWAEYOPHZOHAT-MOPGFXCFSA-N 2 0 337.511 4.075 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)C1CCCCCC1 ZINC000658167556 1030865012 /nfs/dbraw/zinc/86/50/12/1030865012.db2.gz SSIDGNCMEVDILN-GOSISDBHSA-N 2 0 329.532 4.242 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)s1 ZINC000658168742 1030866305 /nfs/dbraw/zinc/86/63/05/1030866305.db2.gz YGVHGQVWWQPWAS-MRXNPFEDSA-N 2 0 329.513 4.014 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c2ccccc21 ZINC000658168410 1030866477 /nfs/dbraw/zinc/86/64/77/1030866477.db2.gz WVNFJHVNUUIYHA-JTSKRJEESA-N 2 0 335.495 4.132 20 0 EIADRP Cc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)o1 ZINC000237765484 1030869008 /nfs/dbraw/zinc/86/90/08/1030869008.db2.gz QRBVASJDWRKTQL-UHFFFAOYSA-N 2 0 332.875 4.243 20 0 EIADRP C[C@]1(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1(F)F ZINC000658223154 1030885644 /nfs/dbraw/zinc/88/56/44/1030885644.db2.gz SPHGYKJKOYLGLR-RDGPPVDQSA-N 2 0 334.454 4.207 20 0 EIADRP CC(C)(C)O[C@H]1C[C@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C12CCC2 ZINC000658255848 1030929929 /nfs/dbraw/zinc/92/99/29/1030929929.db2.gz WOSDQJHISCPTBZ-OALUTQOASA-N 2 0 334.548 4.109 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CC[C@H]2CCCOC2)ccc1OC ZINC000527930125 1030970849 /nfs/dbraw/zinc/97/08/49/1030970849.db2.gz PVHNLVVAKDDYHW-ZWKOTPCHSA-N 2 0 348.531 4.004 20 0 EIADRP C[C@@H](Cc1coc2ccccc12)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658352623 1031019872 /nfs/dbraw/zinc/01/98/72/1031019872.db2.gz HGGONILKYVXWEM-INIZCTEOSA-N 2 0 326.484 4.075 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](CCc2c(F)cccc2Cl)CC1 ZINC000531346183 1031121276 /nfs/dbraw/zinc/12/12/76/1031121276.db2.gz KHYJGWCTBKNBCX-UHFFFAOYSA-N 2 0 326.887 4.074 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000171126894 1031186556 /nfs/dbraw/zinc/18/65/56/1031186556.db2.gz ZOGLPBXZPBLDCH-MRXNPFEDSA-N 2 0 330.447 4.007 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(Sc2ccccc2)CCCC1 ZINC000532506784 1031227643 /nfs/dbraw/zinc/22/76/43/1031227643.db2.gz FXUMAODPFZMWOV-ZHALLVOQSA-N 2 0 332.557 4.410 20 0 EIADRP CCc1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)o1 ZINC000531602953 1031406169 /nfs/dbraw/zinc/40/61/69/1031406169.db2.gz PNCBHILCMLEUFH-KRWDZBQOSA-N 2 0 326.484 4.364 20 0 EIADRP COc1cccc2c(C[NH2+]C3CC[NH+](CC(C)C)CC3)cccc12 ZINC000449072061 1031426217 /nfs/dbraw/zinc/42/62/17/1031426217.db2.gz JCRPFXPDERJUTG-UHFFFAOYSA-N 2 0 326.484 4.058 20 0 EIADRP Clc1ccc(C2=CC[C@@H]([NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)CC2)cc1 ZINC000449074346 1031427114 /nfs/dbraw/zinc/42/71/14/1031427114.db2.gz KPBATSWRXUUFFB-DNVCBOLYSA-N 2 0 330.903 4.350 20 0 EIADRP c1c2cccnc2oc1C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000449103451 1031444283 /nfs/dbraw/zinc/44/42/83/1031444283.db2.gz AWMPWYXPSYVXPF-UHFFFAOYSA-N 2 0 349.478 4.494 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)c1 ZINC000449131135 1031467442 /nfs/dbraw/zinc/46/74/42/1031467442.db2.gz KHIGTBUXYXMVDT-QGZVFWFLSA-N 2 0 348.412 4.333 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)C1CCOCC1 ZINC000531682141 1031473398 /nfs/dbraw/zinc/47/33/98/1031473398.db2.gz HNOMNZUCSCQWCA-GCJKJVERSA-N 2 0 344.543 4.356 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)c1cccc(OC)c1 ZINC000123910944 1031493326 /nfs/dbraw/zinc/49/33/26/1031493326.db2.gz YNSPASMOJZOVDZ-OAQYLSRUSA-N 2 0 326.484 4.388 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@@H]2[C@@H]3CCO[C@H]3C2(C)C)CC1 ZINC000449163140 1031504727 /nfs/dbraw/zinc/50/47/27/1031504727.db2.gz LJGBCPYARCDWKK-RCCFBDPRSA-N 2 0 336.564 4.069 20 0 EIADRP CCO[C@@H](CC[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)C(C)C ZINC000449180795 1031520162 /nfs/dbraw/zinc/52/01/62/1031520162.db2.gz CCTVAUJPHYYWEH-UGKGYDQZSA-N 2 0 346.559 4.123 20 0 EIADRP C[C@@H](CCCc1cccnc1)[NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000453070103 1031535341 /nfs/dbraw/zinc/53/53/41/1031535341.db2.gz ZVUABRYSDLFWLO-ZCNNSNEGSA-N 2 0 331.548 4.141 20 0 EIADRP C[C@H]1CC[C@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)c2sccc21 ZINC000453094786 1031589835 /nfs/dbraw/zinc/58/98/35/1031589835.db2.gz SZDKZRZDUTVPIA-YJBOKZPZSA-N 2 0 344.524 4.417 20 0 EIADRP COCC[C@H]([NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)C(C)(C)C ZINC000449312758 1031628917 /nfs/dbraw/zinc/62/89/17/1031628917.db2.gz NFQQKNWSQVMAJP-RXVVDRJESA-N 2 0 346.559 4.123 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC2(C(F)(F)F)CC2)CC1 ZINC000449318370 1031631692 /nfs/dbraw/zinc/63/16/92/1031631692.db2.gz CUCFFHRRCXUTLS-HNNXBMFYSA-N 2 0 340.433 4.014 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C[C@@H]2CCCSC2)CC1 ZINC000449335052 1031652097 /nfs/dbraw/zinc/65/20/97/1031652097.db2.gz YKSARKVYTKGZFO-INIZCTEOSA-N 2 0 326.594 4.398 20 0 EIADRP c1ccc2c(c1)SC[C@H]2C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000449366933 1031660085 /nfs/dbraw/zinc/66/00/85/1031660085.db2.gz SZXGDHGISHSKSK-MRXNPFEDSA-N 2 0 330.541 4.263 20 0 EIADRP CC(C)OCCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000453194481 1031702361 /nfs/dbraw/zinc/70/23/61/1031702361.db2.gz NNTVXDIWILJMOG-BHDDXSALSA-N 2 0 344.543 4.224 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]C2CCN(c3cccc(C)n3)CC2)c(C)s1 ZINC000128088674 1031724976 /nfs/dbraw/zinc/72/49/76/1031724976.db2.gz AIRVXDGFLMGPBL-OAHLLOKOSA-N 2 0 329.513 4.388 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1ncc(-c2ccccc2)n1C ZINC000453231791 1031752781 /nfs/dbraw/zinc/75/27/81/1031752781.db2.gz UGDZRXOFIISVFW-SFHVURJKSA-N 2 0 340.515 4.004 20 0 EIADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccc(Sc2ccccn2)o1 ZINC000449526795 1031823220 /nfs/dbraw/zinc/82/32/20/1031823220.db2.gz FUCYHCXBTVSGTG-UHFFFAOYSA-N 2 0 333.501 4.036 20 0 EIADRP CC(C)CCOc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000453349728 1031876422 /nfs/dbraw/zinc/87/64/22/1031876422.db2.gz LWPZXBKNKPUGJH-OHSMVPPVSA-N 2 0 330.516 4.387 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000531958349 1031876799 /nfs/dbraw/zinc/87/67/99/1031876799.db2.gz NVBMEVIGRXDVQU-SJORKVTESA-N 2 0 344.474 4.220 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCN(C2CC[NH+](C(C)(C)C)CC2)CC1 ZINC000453383287 1031892525 /nfs/dbraw/zinc/89/25/25/1031892525.db2.gz SJGIWCNUFZDKQH-UHFFFAOYSA-N 2 0 337.596 4.082 20 0 EIADRP Cc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000453387503 1031896945 /nfs/dbraw/zinc/89/69/45/1031896945.db2.gz FGGQTRAFOPNNIL-QZTJIDSGSA-N 2 0 326.484 4.347 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C[C@H]2CCOC(C)(C)C2)CC1 ZINC000453404691 1031939723 /nfs/dbraw/zinc/93/97/23/1031939723.db2.gz DWKVYFZWBCSQFQ-KRWDZBQOSA-N 2 0 338.580 4.460 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(Br)s1 ZINC000453404705 1031939735 /nfs/dbraw/zinc/93/97/35/1031939735.db2.gz BPBUQMMDGBWDMP-NSHDSACASA-N 2 0 331.323 4.036 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)C1CCCCC1 ZINC000132824334 1031940000 /nfs/dbraw/zinc/94/00/00/1031940000.db2.gz MAROMKVJOXANRE-JOCHJYFZSA-N 2 0 344.543 4.092 20 0 EIADRP CN(C)Cc1cnc(C[NH2+]C[C@H]2CCCC[C@H]2c2ccccc2)s1 ZINC000449687744 1031942972 /nfs/dbraw/zinc/94/29/72/1031942972.db2.gz DKIZHJPMJYGJFC-MJGOQNOKSA-N 2 0 343.540 4.268 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1csc(-c2ccccc2F)n1 ZINC000453416385 1031951746 /nfs/dbraw/zinc/95/17/46/1031951746.db2.gz XMMUMLIGZXHUEB-AWEZNQCLSA-N 2 0 347.503 4.474 20 0 EIADRP Clc1ccc2c(c1Cl)CC[C@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000152482622 1031984120 /nfs/dbraw/zinc/98/41/20/1031984120.db2.gz VEJXYTHYOAXBBJ-BDJLRTHQSA-N 2 0 325.283 4.055 20 0 EIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@H]([NH2+]CC4CCSCC4)[C@@H]3C2)cc1 ZINC000512612344 1033492244 /nfs/dbraw/zinc/49/22/44/1033492244.db2.gz OMBCFARABUWQKZ-HBMCJLEFSA-N 2 0 344.568 4.020 20 0 EIADRP CC(C)[N@H+](Cc1cccc(C[NH+]2CCCCC2)c1)C1CCOCC1 ZINC000411384095 1033870921 /nfs/dbraw/zinc/87/09/21/1033870921.db2.gz HDHNWKSVHBCKEI-UHFFFAOYSA-N 2 0 330.516 4.062 20 0 EIADRP C[C@H]1C[C@H]([NH2+]Cc2cc3ccccc3[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000513053791 1034372625 /nfs/dbraw/zinc/37/26/25/1034372625.db2.gz YIPUERXUFQKWHR-FXAWDEMLSA-N 2 0 333.479 4.311 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CCC[C@@H](C)C2)cc1OC ZINC000513103974 1034583766 /nfs/dbraw/zinc/58/37/66/1034583766.db2.gz AVASVQSSPMNCFN-MJGOQNOKSA-N 2 0 348.531 4.084 20 0 EIADRP Cc1ccc([C@@H]2OCCC[C@@H]2[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1 ZINC000513341439 1034889141 /nfs/dbraw/zinc/88/91/41/1034889141.db2.gz VFNUQEBZCUELAX-PMACEKPBSA-N 2 0 330.516 4.068 20 0 EIADRP COc1ccccc1C[NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000513500033 1034999019 /nfs/dbraw/zinc/99/90/19/1034999019.db2.gz KMYKOPSBVDGDAS-QUCCMNQESA-N 2 0 338.495 4.086 20 0 EIADRP c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@@H]([NH2+]C4CCSCC4)[C@H]3C2)cc1 ZINC000513683638 1035099897 /nfs/dbraw/zinc/09/98/97/1035099897.db2.gz LUBPYKMVIWMFOB-SESVDKBCSA-N 2 0 344.568 4.162 20 0 EIADRP CC(C)[NH+]1CCN(CCC[NH2+][C@H](CC(C)(C)C)c2ccccc2)CC1 ZINC000501005035 1035343306 /nfs/dbraw/zinc/34/33/06/1035343306.db2.gz CTUBBFDHVKKOFB-OAQYLSRUSA-N 2 0 345.575 4.170 20 0 EIADRP C[N@@H+](Cc1cccc(Cl)c1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501030099 1035348233 /nfs/dbraw/zinc/34/82/33/1035348233.db2.gz KOWAXALREFVCOJ-UHFFFAOYSA-N 2 0 329.875 4.083 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]CCC1CC[NH+](C)CC1 ZINC000501420470 1035442153 /nfs/dbraw/zinc/44/21/53/1035442153.db2.gz MKWCBPITWFENJW-FYWRMAATSA-N 2 0 340.433 4.430 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000501423736 1035443189 /nfs/dbraw/zinc/44/31/89/1035443189.db2.gz OJDHFAZUHJSFJS-QZFKAFNDSA-N 2 0 340.433 4.430 20 0 EIADRP c1csc([C@@H]2c3ccsc3CC[N@H+]2CC[C@@H]2CCC[NH2+]C2)c1 ZINC000420320518 1035511826 /nfs/dbraw/zinc/51/18/26/1035511826.db2.gz QKXLOIGOHNMZMQ-KSSFIOAISA-N 2 0 332.538 4.147 20 0 EIADRP Brc1ccc([C@H]2CCC[N@@H+]2CC[C@H]2CCC[NH2+]C2)s1 ZINC000420372161 1035555365 /nfs/dbraw/zinc/55/53/65/1035555365.db2.gz LGSBFONKUOMVFO-CHWSQXEVSA-N 2 0 343.334 4.037 20 0 EIADRP Cc1sc([C@@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)nc1-c1ccc(Cl)cc1 ZINC000420402245 1035577174 /nfs/dbraw/zinc/57/71/74/1035577174.db2.gz JXTADDPLBLRPPL-OCCSQVGLSA-N 2 0 349.931 4.422 20 0 EIADRP C[C@H](COc1ccc(Cl)c(Cl)c1)[NH2+]CCCCn1ccnc1 ZINC000571254429 1036011847 /nfs/dbraw/zinc/01/18/47/1036011847.db2.gz JQIJAQDCWISIRX-CYBMUJFWSA-N 2 0 342.270 4.027 20 0 EIADRP FC(F)C1CCC([NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000669614284 1036242704 /nfs/dbraw/zinc/24/27/04/1036242704.db2.gz ZGNMGWXMSNSPFP-LMDPOFIKSA-N 2 0 336.470 4.312 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCCC(F)(F)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000502511878 1036271069 /nfs/dbraw/zinc/27/10/69/1036271069.db2.gz VAAXEDHSRBNMKX-CVEARBPZSA-N 2 0 340.458 4.103 20 0 EIADRP C[NH+](C)CCCC[NH2+]Cc1cnn(C2CCCC2)c1-c1ccccc1 ZINC000421328833 1036275987 /nfs/dbraw/zinc/27/59/87/1036275987.db2.gz UHBJALGYVOBTLQ-UHFFFAOYSA-N 2 0 340.515 4.097 20 0 EIADRP CC1([NH+]2CCCC2)CCC([NH2+]Cc2ccc(-c3cnco3)cc2)CC1 ZINC000906527187 1036317774 /nfs/dbraw/zinc/31/77/74/1036317774.db2.gz NCSPPIXZTRWWCM-UHFFFAOYSA-N 2 0 339.483 4.228 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C[C@H]2CC23CCSCC3)CC1 ZINC000421374818 1036321241 /nfs/dbraw/zinc/32/12/41/1036321241.db2.gz HLHMZNUQORXVSD-LMMKCTJWSA-N 2 0 336.589 4.152 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2ccc(F)cc2F)CCCC1 ZINC000486079825 1036466958 /nfs/dbraw/zinc/46/69/58/1036466958.db2.gz QGLMYQLUFRVJFR-CLCXKQKWSA-N 2 0 336.470 4.095 20 0 EIADRP c1nc(C2CCCCC2)sc1C[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000572243019 1036469749 /nfs/dbraw/zinc/46/97/49/1036469749.db2.gz HHUBFJPLNPPRPW-IAGOWNOFSA-N 2 0 333.545 4.012 20 0 EIADRP CSC1(C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)CC[NH+](C)CC1 ZINC000589325395 1036736906 /nfs/dbraw/zinc/73/69/06/1036736906.db2.gz HNAWKXMNFNFFAN-UHFFFAOYSA-N 2 0 348.487 4.003 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccncc1Cl ZINC000421831187 1036790288 /nfs/dbraw/zinc/79/02/88/1036790288.db2.gz DJKAUIZMBRFTIW-GTPINHCMSA-N 2 0 335.923 4.429 20 0 EIADRP CC[N@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)CC1(SC)CCC1 ZINC000589503842 1036805175 /nfs/dbraw/zinc/80/51/75/1036805175.db2.gz YBSNPHSYFPEUOM-IBGZPJMESA-N 2 0 332.557 4.116 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000572712715 1036811628 /nfs/dbraw/zinc/81/16/28/1036811628.db2.gz YJJHZLRJULOQAC-XCRHUMRWSA-N 2 0 343.902 4.489 20 0 EIADRP C[C@H]([NH2+]Cc1cc2ccc(F)cc2[nH]1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000486719640 1036825978 /nfs/dbraw/zinc/82/59/78/1036825978.db2.gz HMXVBOGXCOTLFH-HOCLYGCPSA-N 2 0 329.463 4.050 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(Oc2ccccc2)cn1 ZINC000421879650 1036830472 /nfs/dbraw/zinc/83/04/72/1036830472.db2.gz PISSYDBLUUSATP-AOCRQIFASA-N 2 0 339.483 4.397 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(Oc2ccccc2)cn1 ZINC000421879651 1036831279 /nfs/dbraw/zinc/83/12/79/1036831279.db2.gz PISSYDBLUUSATP-WWDZGPRUSA-N 2 0 339.483 4.397 20 0 EIADRP COc1ccc([C@H]2CCCC[C@@H]2[NH2+]C2CCC([NH+](C)C)CC2)cc1F ZINC000421887441 1036835938 /nfs/dbraw/zinc/83/59/38/1036835938.db2.gz VWQJYOPAKIMJNQ-ZZVGESKWSA-N 2 0 348.506 4.323 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2ccc3[nH]cnc3c2)C1 ZINC000589642041 1036858070 /nfs/dbraw/zinc/85/80/70/1036858070.db2.gz ZEUMBBCITINOLJ-KRWDZBQOSA-N 2 0 348.494 4.085 20 0 EIADRP c1ccc(CC2CC[NH+](CCCC[NH2+]C[C@@H]3CCSC3)CC2)cc1 ZINC000487280645 1037095132 /nfs/dbraw/zinc/09/51/32/1037095132.db2.gz RNVDIFYTCNYJAF-NRFANRHFSA-N 2 0 346.584 4.064 20 0 EIADRP CC(C)n1cc([C@H](C)[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cn1 ZINC000272298755 1037152307 /nfs/dbraw/zinc/15/23/07/1037152307.db2.gz GNLATBODLQRPQL-HBFSDRIKSA-N 2 0 340.515 4.025 20 0 EIADRP Fc1ccc(C2=CC[C@H]([NH2+]C3CC[NH+](C4CCC4)CC3)CC2)cc1 ZINC000272449217 1037193798 /nfs/dbraw/zinc/19/37/98/1037193798.db2.gz FTZWGEMEQFVWKG-IBGZPJMESA-N 2 0 328.475 4.368 20 0 EIADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000272625657 1037251242 /nfs/dbraw/zinc/25/12/42/1037251242.db2.gz ZGHKGNIQZYIPGX-LSDHHAIUSA-N 2 0 331.529 4.110 20 0 EIADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000272625651 1037253877 /nfs/dbraw/zinc/25/38/77/1037253877.db2.gz ZGHKGNIQZYIPGX-GJZGRUSLSA-N 2 0 331.529 4.110 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2nc(-c3cccs3)oc2C)CC1 ZINC000488282961 1037475091 /nfs/dbraw/zinc/47/50/91/1037475091.db2.gz RYWJYHJQVPZULM-UHFFFAOYSA-N 2 0 347.528 4.265 20 0 EIADRP CC(C)(C)[C@@H]1C[C@H]([NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)CS1 ZINC000488434575 1037593088 /nfs/dbraw/zinc/59/30/88/1037593088.db2.gz JEAZSXIEQXQFOE-AABGKKOBSA-N 2 0 346.584 4.061 20 0 EIADRP CSCCCCC[NH2+][C@@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC000592366606 1037774158 /nfs/dbraw/zinc/77/41/58/1037774158.db2.gz CCTQLDOBWLTQHF-LJQANCHMSA-N 2 0 332.557 4.307 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](c1ccc(F)cc1)C1CCC1 ZINC000422718237 1037813348 /nfs/dbraw/zinc/81/33/48/1037813348.db2.gz PMSBLRFWBQWYJS-XOBRGWDASA-N 2 0 327.447 4.180 20 0 EIADRP c1ccc2c(c1)cccc2CSCC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000592468519 1037818124 /nfs/dbraw/zinc/81/81/24/1037818124.db2.gz BCCNLYCVSSMECD-DFQSSKMNSA-N 2 0 340.536 4.051 20 0 EIADRP CCc1ccc([C@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422741918 1037821922 /nfs/dbraw/zinc/82/19/22/1037821922.db2.gz FPGMCERHCOVOBM-SAWYMBPVSA-N 2 0 336.479 4.156 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000422747403 1037824428 /nfs/dbraw/zinc/82/44/28/1037824428.db2.gz YLEUNGLZSPPJOR-XEZPLFJOSA-N 2 0 347.503 4.296 20 0 EIADRP CCC[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1 ZINC000422765898 1037834818 /nfs/dbraw/zinc/83/48/18/1037834818.db2.gz PRRYTCUECHCNKI-TUNNFDKTSA-N 2 0 336.479 4.373 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+]CCCCSc1ccccc1Br ZINC000422764186 1037834969 /nfs/dbraw/zinc/83/49/69/1037834969.db2.gz UUTYEWNKJSDGPF-ZDUSSCGKSA-N 2 0 345.350 4.038 20 0 EIADRP [NH3+][C@H]1C[C@H](NCc2cccc(C[NH+]3CCCCCC3)c2)c2ccccc21 ZINC000422823498 1037841404 /nfs/dbraw/zinc/84/14/04/1037841404.db2.gz DKRCEIXNCKDGRW-GOTSBHOMSA-N 2 0 349.522 4.297 20 0 EIADRP [NH3+][C@@H]1C[C@H](NCc2cccc(C[NH+]3CCCCCC3)c2)c2ccccc21 ZINC000422823499 1037842339 /nfs/dbraw/zinc/84/23/39/1037842339.db2.gz DKRCEIXNCKDGRW-PKTZIBPZSA-N 2 0 349.522 4.297 20 0 EIADRP Fc1cccc(C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)c2cccc(F)c2)c1 ZINC000422836044 1037843506 /nfs/dbraw/zinc/84/35/06/1037843506.db2.gz ZMUVCOGUERRKDA-JKWVGCSGSA-N 2 0 342.433 4.121 20 0 EIADRP CSCc1cc(F)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000422864245 1037848161 /nfs/dbraw/zinc/84/81/61/1037848161.db2.gz MMYZHNZFQPLRIA-GBESFXJTSA-N 2 0 336.520 4.089 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCCc2nc(-c3ccccc3)sc21)[C@H]1CCC[NH2+]C1 ZINC000422866001 1037849501 /nfs/dbraw/zinc/84/95/01/1037849501.db2.gz ZUHMHKNDQUGLHM-BHYGNILZSA-N 2 0 341.524 4.165 20 0 EIADRP COc1cc([C@@H](C)[NH2+]C2CCC(C[NH3+])CC2)ccc1OC1CCCC1 ZINC000422882532 1037851770 /nfs/dbraw/zinc/85/17/70/1037851770.db2.gz SMZMHINROZZPFB-KLHKWILBSA-N 2 0 346.515 4.185 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CN[C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422885707 1037853572 /nfs/dbraw/zinc/85/35/72/1037853572.db2.gz UZHWUEWLEJXHDK-ZQMYSKGWSA-N 2 0 349.522 4.295 20 0 EIADRP c1[nH]c2ccccc2c1CCC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000422884130 1037854251 /nfs/dbraw/zinc/85/42/51/1037854251.db2.gz DLAYZTFKSFRCIK-HMXCVIKNSA-N 2 0 325.500 4.001 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CN[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422885702 1037854863 /nfs/dbraw/zinc/85/48/63/1037854863.db2.gz UZHWUEWLEJXHDK-NLSFWIRASA-N 2 0 349.522 4.295 20 0 EIADRP CCC[C@H]([NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)c1ccc(F)cc1F ZINC000422874349 1037859062 /nfs/dbraw/zinc/85/90/62/1037859062.db2.gz NLLUISLSKMXBDD-DJJJIMSYSA-N 2 0 333.426 4.319 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1F ZINC000422873733 1037861257 /nfs/dbraw/zinc/86/12/57/1037861257.db2.gz LYCFIIBPQGFCAV-PAXLWEDBSA-N 2 0 340.442 4.041 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000422908733 1037863687 /nfs/dbraw/zinc/86/36/87/1037863687.db2.gz DSLWZXCLVYZEKB-YDHLFZDLSA-N 2 0 347.503 4.296 20 0 EIADRP c1ccc(OC2CCC2)c(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000422910826 1037865662 /nfs/dbraw/zinc/86/56/62/1037865662.db2.gz JMFIHXQXMFEYBW-SLFFLAALSA-N 2 0 328.500 4.018 20 0 EIADRP c1ccc2c(c1)cccc2C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422924192 1037871646 /nfs/dbraw/zinc/87/16/46/1037871646.db2.gz YCVQWZXZVBAFHM-JTHBVZDNSA-N 2 0 344.458 4.185 20 0 EIADRP COc1ccc([C@H]([NH2+][C@H](C)CCCC[NH3+])c2ccc(C)cc2)cc1 ZINC000422936413 1037872713 /nfs/dbraw/zinc/87/27/13/1037872713.db2.gz MIYMLEOQYBFSJV-DYESRHJHSA-N 2 0 326.484 4.200 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccccc1OCCC(C)C ZINC000422939434 1037875935 /nfs/dbraw/zinc/87/59/35/1037875935.db2.gz RMRPNZKXOHFHMZ-MRXNPFEDSA-N 2 0 341.499 4.124 20 0 EIADRP COc1cc([C@@H](C)[NH2+]C2CCC([NH3+])CC2)ccc1OCCC(C)C ZINC000422942944 1037878359 /nfs/dbraw/zinc/87/83/59/1037878359.db2.gz KZKKLVWRFGMWPE-FAEJEUNOSA-N 2 0 334.504 4.041 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC(C)(C)c1c(F)cccc1Cl ZINC000422917702 1037878998 /nfs/dbraw/zinc/87/89/98/1037878998.db2.gz FPTGOHCMEGEUTJ-GFCCVEGCSA-N 2 0 349.881 4.270 20 0 EIADRP Clc1cccc(CC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)c1Cl ZINC000422948273 1037884538 /nfs/dbraw/zinc/88/45/38/1037884538.db2.gz QZZAVQPQRLXNAH-IMJJTQAJSA-N 2 0 327.299 4.046 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCSc2ccc(Br)cc21 ZINC000422949540 1037884725 /nfs/dbraw/zinc/88/47/25/1037884725.db2.gz VODREJSFYBYJEC-RISCZKNCSA-N 2 0 343.334 4.093 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC000422986371 1037895425 /nfs/dbraw/zinc/89/54/25/1037895425.db2.gz CHNGZOJCUXJXRY-XQQGARBVSA-N 2 0 337.511 4.400 20 0 EIADRP Fc1ccc(Sc2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)cc2)cc1 ZINC000423011746 1037899724 /nfs/dbraw/zinc/89/97/24/1037899724.db2.gz BMIOWNARAVKJSG-JWTNVVGKSA-N 2 0 342.483 4.350 20 0 EIADRP Clc1ccc(C2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)CCC2)c(Cl)c1 ZINC000423013610 1037901161 /nfs/dbraw/zinc/90/11/61/1037901161.db2.gz GIYANLPXGTUQLC-YIONKMFJSA-N 2 0 339.310 4.288 20 0 EIADRP Cc1oc2ccccc2c1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423044934 1037925887 /nfs/dbraw/zinc/92/58/87/1037925887.db2.gz CHQWWVLWCQWXAJ-KNQAVFIVSA-N 2 0 348.446 4.087 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cc2ccccc2o1 ZINC000423060288 1037929277 /nfs/dbraw/zinc/92/92/77/1037929277.db2.gz NZUULJMBPZZYBU-QRFQSNJMSA-N 2 0 348.446 4.339 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000423057836 1037930194 /nfs/dbraw/zinc/93/01/94/1037930194.db2.gz AYOWQYPJSQOIPL-BZNIZROVSA-N 2 0 343.284 4.146 20 0 EIADRP CC(C)(C[NH2+]C1CCC(C[NH3+])CC1)c1ccc(C(F)(F)F)cc1 ZINC000423073891 1037932444 /nfs/dbraw/zinc/93/24/44/1037932444.db2.gz SMQOYYSJZZEXAS-UHFFFAOYSA-N 2 0 328.422 4.090 20 0 EIADRP c1ccc2c(c1)O[C@]1(CC[NH2+]C1)C[C@H]2[NH2+]Cc1ccc(C2CCC2)cc1 ZINC000423067839 1037933137 /nfs/dbraw/zinc/93/31/37/1037933137.db2.gz AGHPXJNQYUNESD-FYYLOGMGSA-N 2 0 348.490 4.300 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000423052579 1037937475 /nfs/dbraw/zinc/93/74/75/1037937475.db2.gz QURWDBVKJCCWAS-IUODEOHRSA-N 2 0 333.476 4.044 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1cc2cccc(F)c2o1 ZINC000423074978 1037938138 /nfs/dbraw/zinc/93/81/38/1037938138.db2.gz VVJBTQXSRMLKSK-DGCLKSJQSA-N 2 0 327.403 4.146 20 0 EIADRP C[C@@H]([NH2+]CC1CCC(F)(F)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000503859647 1037943568 /nfs/dbraw/zinc/94/35/68/1037943568.db2.gz NFBAAHVHOSTARO-OAHLLOKOSA-N 2 0 340.458 4.103 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(Cl)c1 ZINC000423082217 1037944424 /nfs/dbraw/zinc/94/44/24/1037944424.db2.gz WPUQIYRVBOMEOS-WNYOCNMUSA-N 2 0 342.870 4.247 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(Cl)c1 ZINC000423082214 1037945049 /nfs/dbraw/zinc/94/50/49/1037945049.db2.gz WPUQIYRVBOMEOS-DJKXOVBDSA-N 2 0 342.870 4.247 20 0 EIADRP [NH3+][C@H]1C[C@H]([NH2+]C2CC(F)(c3cccc(Cl)c3)C2)c2ccccc21 ZINC000423095217 1037953456 /nfs/dbraw/zinc/95/34/56/1037953456.db2.gz LQOVSEIZJIOQAA-MJGSYPLASA-N 2 0 330.834 4.402 20 0 EIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+][C@H](C)CCCC[NH3+])cc1 ZINC000423120410 1037969898 /nfs/dbraw/zinc/96/98/98/1037969898.db2.gz GKVYNDPLAPSDEA-UTKZUKDTSA-N 2 0 326.484 4.086 20 0 EIADRP C[C@H]([NH2+]C1CCC(C[NH3+])CC1)c1ccc(Oc2cccnc2)cc1 ZINC000423129965 1037978522 /nfs/dbraw/zinc/97/85/22/1037978522.db2.gz RMPXEAGUXWAGFL-HJOIGYKYSA-N 2 0 325.456 4.042 20 0 EIADRP C[C@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCC1)[C@@H]1CC[NH2+]C1 ZINC000423112410 1037987712 /nfs/dbraw/zinc/98/77/12/1037987712.db2.gz XNDUENAGSNDHIM-XGWLTEMNSA-N 2 0 326.406 4.134 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000423111464 1037988955 /nfs/dbraw/zinc/98/89/55/1037988955.db2.gz WAEPCVJJLNHABQ-BLLLJJGKSA-N 2 0 330.394 4.143 20 0 EIADRP CC[N@H+](Cc1ccc(Oc2cccnc2)c(C)c1)[C@H]1CCC[NH2+]CC1 ZINC000414720188 1038003881 /nfs/dbraw/zinc/00/38/81/1038003881.db2.gz XLLXKIFZYSJGIF-IBGZPJMESA-N 2 0 339.483 4.146 20 0 EIADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@H](Cc1ccccc1)c1nc2ccccc2s1 ZINC000423161423 1038018874 /nfs/dbraw/zinc/01/88/74/1038018874.db2.gz NUOPIZKFCWISOP-HDMKZQKVSA-N 2 0 339.508 4.296 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(Cl)cc1 ZINC000423170476 1038024953 /nfs/dbraw/zinc/02/49/53/1038024953.db2.gz MDZNLDSIVONFDC-DJKXOVBDSA-N 2 0 342.870 4.247 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000503940530 1038026616 /nfs/dbraw/zinc/02/66/16/1038026616.db2.gz ABVQAJAAEWPXAK-NTCAYCPXSA-N 2 0 340.433 4.382 20 0 EIADRP FC(F)(F)c1cccc(C2CCC([NH2+]C3CC[NH2+]CC3)CC2)c1 ZINC000423180126 1038033687 /nfs/dbraw/zinc/03/36/87/1038033687.db2.gz IECHHQCSMFDYLT-UHFFFAOYSA-N 2 0 326.406 4.073 20 0 EIADRP C[C@@H]([NH2+]CC1([NH3+])CCCCCC1)[C@@H](C)c1nc2ccccc2s1 ZINC000423200052 1038051111 /nfs/dbraw/zinc/05/11/11/1038051111.db2.gz LNUVJOQKRRCOJX-HUUCEWRRSA-N 2 0 331.529 4.430 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cccs1 ZINC000423239198 1038059603 /nfs/dbraw/zinc/05/96/03/1038059603.db2.gz AYGGPYARCQLOIK-RHSMWYFYSA-N 2 0 334.916 4.275 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1ccc(SCC(F)F)cc1 ZINC000423262851 1038073625 /nfs/dbraw/zinc/07/36/25/1038073625.db2.gz WHSYHDCPENRJCJ-UONOGXRCSA-N 2 0 328.472 4.084 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000503992137 1038077508 /nfs/dbraw/zinc/07/75/08/1038077508.db2.gz ILIKHWVGPXXKOZ-CQSZACIVSA-N 2 0 328.422 4.430 20 0 EIADRP Fc1ccc([C@@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2ccccc2Cl)cc1 ZINC000423248550 1038080341 /nfs/dbraw/zinc/08/03/41/1038080341.db2.gz NIDLYUCAVUZDIU-AUUYWEPGSA-N 2 0 332.850 4.158 20 0 EIADRP c1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC[C@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423256479 1038084956 /nfs/dbraw/zinc/08/49/56/1038084956.db2.gz FGIMGAWRSIZOSB-WBVHZDCISA-N 2 0 341.524 4.167 20 0 EIADRP COc1cc(OC)c([C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1Cl ZINC000423288953 1038092332 /nfs/dbraw/zinc/09/23/32/1038092332.db2.gz ACVUHPDJRKGZCL-CHWSQXEVSA-N 2 0 348.874 4.228 20 0 EIADRP CC[C@H]([NH2+]CCc1ccc(OCC[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000606467597 1038092353 /nfs/dbraw/zinc/09/23/53/1038092353.db2.gz WBPFHAHJBSYVAO-NRFANRHFSA-N 2 0 344.474 4.050 20 0 EIADRP Cc1cc(Cl)c2c(c1)[C@H]([NH2+]CCC1CC[NH+](C)CC1)CCCO2 ZINC000489514336 1038094433 /nfs/dbraw/zinc/09/44/33/1038094433.db2.gz HGWPFFWCXMZSNB-GOSISDBHSA-N 2 0 336.907 4.184 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+][C@@H]3CCCC[C@@H]3C[NH3+])cs2)cs1 ZINC000423273773 1038099619 /nfs/dbraw/zinc/09/96/19/1038099619.db2.gz JIVDAJPVLUZTRN-NJZAAPMLSA-N 2 0 335.542 4.348 20 0 EIADRP CSC[C@@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1 ZINC000423317580 1038114204 /nfs/dbraw/zinc/11/42/04/1038114204.db2.gz BUVWVFZJIZGCTO-OAHLLOKOSA-N 2 0 346.462 4.089 20 0 EIADRP C[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(SCC(F)F)cc1 ZINC000423318575 1038116219 /nfs/dbraw/zinc/11/62/19/1038116219.db2.gz CMTJQJBQKJWSAP-ZDUSSCGKSA-N 2 0 328.472 4.084 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@H]2CCCc3cc(N)ccc32)cc1 ZINC000423344725 1038136715 /nfs/dbraw/zinc/13/67/15/1038136715.db2.gz FMNZFCLQCZPLAZ-NYHFZMIOSA-N 2 0 346.478 4.491 20 0 EIADRP CC1(C[NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC[NH2+]CC1 ZINC000423325365 1038139751 /nfs/dbraw/zinc/13/97/51/1038139751.db2.gz JOAINQIHQNTFRI-DOTOQJQBSA-N 2 0 340.433 4.321 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423327693 1038141405 /nfs/dbraw/zinc/14/14/05/1038141405.db2.gz LPAJFQHBNIZFTF-MGPUTAFESA-N 2 0 343.540 4.083 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]CC3(C)CC[NH2+]CC3)cs2)cs1 ZINC000423335418 1038149610 /nfs/dbraw/zinc/14/96/10/1038149610.db2.gz RWFOPZQGNZXUPT-LBPRGKRZSA-N 2 0 335.542 4.220 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CCCC[C@@H]2[NH2+]CC2=CC[NH2+]CC2)cc1 ZINC000423349638 1038164707 /nfs/dbraw/zinc/16/47/07/1038164707.db2.gz XGPCEGGAXONKMC-ROUUACIJSA-N 2 0 338.417 4.241 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC(NCc2ccc3c(c2)C[NH2+]C3)CC1 ZINC000423364415 1038176739 /nfs/dbraw/zinc/17/67/39/1038176739.db2.gz APTNSZFUDYWHDY-UHFFFAOYSA-N 2 0 343.559 4.059 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+][C@H](C)C2)cc1OCCC ZINC000423363548 1038178147 /nfs/dbraw/zinc/17/81/47/1038178147.db2.gz AOKZDUYVNAJPGT-RYRKJORJSA-N 2 0 334.504 4.055 20 0 EIADRP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)c1 ZINC000423368416 1038181766 /nfs/dbraw/zinc/18/17/66/1038181766.db2.gz ZUGSKMJOWMXQJM-CYBMUJFWSA-N 2 0 332.394 4.050 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000423368243 1038186378 /nfs/dbraw/zinc/18/63/78/1038186378.db2.gz DYOHCUVTYQIWKP-KEYYUXOJSA-N 2 0 329.513 4.218 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000423385167 1038195135 /nfs/dbraw/zinc/19/51/35/1038195135.db2.gz GKVVXRQQHWAWPX-KEYYUXOJSA-N 2 0 329.513 4.076 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(SCC(F)F)cc1 ZINC000423395186 1038201942 /nfs/dbraw/zinc/20/19/42/1038201942.db2.gz RUCWGOWXVUXIEG-ZDUSSCGKSA-N 2 0 348.462 4.498 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccc2c1CCCN2 ZINC000423422167 1038210909 /nfs/dbraw/zinc/21/09/09/1038210909.db2.gz YKFWFZVBRHMVBX-XMSQKQJNSA-N 2 0 349.522 4.045 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423423280 1038211104 /nfs/dbraw/zinc/21/11/04/1038211104.db2.gz BXQLANFQDMIYAO-JEBQAFNWSA-N 2 0 340.433 4.004 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000423405603 1038215119 /nfs/dbraw/zinc/21/51/19/1038215119.db2.gz YCYKHMIYOMEPSR-KNXALSJPSA-N 2 0 333.476 4.178 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)c2ccccc12 ZINC000423403648 1038215261 /nfs/dbraw/zinc/21/52/61/1038215261.db2.gz XCGPFPJJMIHTHH-HNNXBMFYSA-N 2 0 332.447 4.302 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000423405605 1038216134 /nfs/dbraw/zinc/21/61/34/1038216134.db2.gz YCYKHMIYOMEPSR-XZJROXQQSA-N 2 0 333.476 4.178 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H](c1ccc(F)cc1)c1cnc2ccccc2c1 ZINC000423443823 1038225601 /nfs/dbraw/zinc/22/56/01/1038225601.db2.gz AQMSDGMOGFMQEK-QVKFZJNVSA-N 2 0 337.442 4.180 20 0 EIADRP Cc1ccccc1COc1ccc([C@H](C)[NH2+][C@H](C)CCC[NH3+])cc1 ZINC000423450516 1038230730 /nfs/dbraw/zinc/23/07/30/1038230730.db2.gz HJSSKROCIVEUQC-MSOLQXFVSA-N 2 0 326.484 4.352 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccc(SCC(F)F)cc1 ZINC000423438817 1038235095 /nfs/dbraw/zinc/23/50/95/1038235095.db2.gz NLYVAPQHRRCZCA-AFAVFJNCSA-N 2 0 340.483 4.083 20 0 EIADRP Cc1c([C@@H](C)[NH2+][C@@H](C)CCCC[NH3+])cnn1-c1cccc(Cl)c1 ZINC000423434513 1038235788 /nfs/dbraw/zinc/23/57/88/1038235788.db2.gz OBTWOTKAMDBYCR-UONOGXRCSA-N 2 0 334.895 4.002 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](c1ccc(Br)cc1)C1CC1 ZINC000423440467 1038238262 /nfs/dbraw/zinc/23/82/62/1038238262.db2.gz TUGBULSQAPJBLL-LRDDRELGSA-N 2 0 325.294 4.007 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000423439603 1038239338 /nfs/dbraw/zinc/23/93/38/1038239338.db2.gz SLXCRQYEXIYHNE-CZUORRHYSA-N 2 0 347.503 4.434 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(Br)cc1 ZINC000423461241 1038241088 /nfs/dbraw/zinc/24/10/88/1038241088.db2.gz NSXZHZZKTCDMHI-WQVCFCJDSA-N 2 0 325.294 4.007 20 0 EIADRP Clc1cccc([C@H](Cc2cccnc2)[NH2+]CCC[C@H]2CCC[NH2+]2)c1 ZINC000423469091 1038244311 /nfs/dbraw/zinc/24/43/11/1038244311.db2.gz CHLJRHVTOPDTFC-UXHICEINSA-N 2 0 343.902 4.141 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1csc(-c2ccccc2F)n1 ZINC000423468191 1038244470 /nfs/dbraw/zinc/24/44/70/1038244470.db2.gz JOGMSOGZHRKHGX-BFHYXJOUSA-N 2 0 333.476 4.117 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000423467490 1038245696 /nfs/dbraw/zinc/24/56/96/1038245696.db2.gz JBSWICPTIYOCIV-OXXUSNJHSA-N 2 0 340.433 4.449 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)c2cccc(Br)c21 ZINC000423469712 1038245732 /nfs/dbraw/zinc/24/57/32/1038245732.db2.gz VPAQAOGINBUYOS-IATRGZMQSA-N 2 0 337.305 4.105 20 0 EIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)CCC3)cc1 ZINC000423467171 1038245755 /nfs/dbraw/zinc/24/57/55/1038245755.db2.gz BGMGZQPPNOUEBR-DLBZAZTESA-N 2 0 341.524 4.309 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)c(C)o1 ZINC000423472270 1038246208 /nfs/dbraw/zinc/24/62/08/1038246208.db2.gz NDKNZJRFSCOKAB-DKSSEZFCSA-N 2 0 330.447 4.079 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000423478567 1038250172 /nfs/dbraw/zinc/25/01/72/1038250172.db2.gz TYBNDJBLPOVVMF-JLZZUVOBSA-N 2 0 326.406 4.264 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423479715 1038251024 /nfs/dbraw/zinc/25/10/24/1038251024.db2.gz MOJRHFMIZZTCHS-DYVFJYSZSA-N 2 0 347.503 4.440 20 0 EIADRP Cc1cc([C@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cs1 ZINC000423482452 1038251386 /nfs/dbraw/zinc/25/13/86/1038251386.db2.gz XSXJVGBZEOYDQW-UCLAIMLFSA-N 2 0 332.488 4.240 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423479714 1038252673 /nfs/dbraw/zinc/25/26/73/1038252673.db2.gz MOJRHFMIZZTCHS-CXAGYDPISA-N 2 0 347.503 4.440 20 0 EIADRP CC[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cccc(Br)c1 ZINC000423488765 1038261077 /nfs/dbraw/zinc/26/10/77/1038261077.db2.gz VRIQQEVUVFQXJS-CVEARBPZSA-N 2 0 325.294 4.022 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1ccc2ccccc2c1OC(F)F ZINC000423487192 1038261520 /nfs/dbraw/zinc/26/15/20/1038261520.db2.gz CFFVPISSUASICE-YDHLFZDLSA-N 2 0 334.410 4.219 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])C2)cc1OCCC ZINC000423492311 1038263646 /nfs/dbraw/zinc/26/36/46/1038263646.db2.gz MNIPSTQKDDDWIW-BQFCYCMXSA-N 2 0 334.504 4.042 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423492249 1038263967 /nfs/dbraw/zinc/26/39/67/1038263967.db2.gz MIQVJLMHJZBEMH-YQQAZPJKSA-N 2 0 328.431 4.396 20 0 EIADRP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])C2)cc1 ZINC000423494485 1038265355 /nfs/dbraw/zinc/26/53/55/1038265355.db2.gz SFTBPWLBOASJFI-IHPCNDPISA-N 2 0 330.516 4.070 20 0 EIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cnc2ccsc2c1 ZINC000423497697 1038267986 /nfs/dbraw/zinc/26/79/86/1038267986.db2.gz HHPFODQPAWOQHJ-YOEHRIQHSA-N 2 0 325.481 4.427 20 0 EIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1N(C)C ZINC000423513984 1038271126 /nfs/dbraw/zinc/27/11/26/1038271126.db2.gz WCAYHBXRBMDFFY-HNAYVOBHSA-N 2 0 329.463 4.023 20 0 EIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000423511486 1038272394 /nfs/dbraw/zinc/27/23/94/1038272394.db2.gz TUXXUHHSYFHMJU-UTKZUKDTSA-N 2 0 334.467 4.003 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H](c2ccc(F)cc2)c2ccccc2Cl)C1 ZINC000423519996 1038273867 /nfs/dbraw/zinc/27/38/67/1038273867.db2.gz VTUJVVITMJSKSM-ACWOFJMJSA-N 2 0 332.850 4.286 20 0 EIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cc(-c2ccccc2)nn1C ZINC000423521356 1038274973 /nfs/dbraw/zinc/27/49/73/1038274973.db2.gz SSFHYYXITKZPPY-PXNSSMCTSA-N 2 0 348.494 4.218 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423523108 1038277768 /nfs/dbraw/zinc/27/77/68/1038277768.db2.gz VMTPESQOIQEGPW-SFTDATJTSA-N 2 0 338.495 4.487 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000423522051 1038278684 /nfs/dbraw/zinc/27/86/84/1038278684.db2.gz XGKUXKFRJJIAGG-UPRAQXHNSA-N 2 0 332.850 4.286 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000423522052 1038279572 /nfs/dbraw/zinc/27/95/72/1038279572.db2.gz XGKUXKFRJJIAGG-VMDGZTHMSA-N 2 0 332.850 4.286 20 0 EIADRP Clc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@@H]3C[NH2+]C[C@@H]3C1)CCCS2 ZINC000423539073 1038286169 /nfs/dbraw/zinc/28/61/69/1038286169.db2.gz HRDQISNFXJKPPG-IARIHHJXSA-N 2 0 336.932 4.245 20 0 EIADRP Cc1cccc([C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)c2cccc(F)c2)c1 ZINC000423548852 1038291539 /nfs/dbraw/zinc/29/15/39/1038291539.db2.gz MYNQAIGNCXJWNG-MPJJRAAHSA-N 2 0 338.470 4.201 20 0 EIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423554953 1038294718 /nfs/dbraw/zinc/29/47/18/1038294718.db2.gz XKWCCRROCRRATC-WCIQWLHISA-N 2 0 340.536 4.318 20 0 EIADRP C[C@@H]1CCC[C@@H](C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C1 ZINC000574553055 1038302933 /nfs/dbraw/zinc/30/29/33/1038302933.db2.gz YRSHWDOPZLGQIJ-IEBWSBKVSA-N 2 0 330.516 4.076 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000574749289 1038323470 /nfs/dbraw/zinc/32/34/70/1038323470.db2.gz HLTMUAQBEJPSRX-YSGRDPCXSA-N 2 0 343.902 4.126 20 0 EIADRP CCCc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000539064144 1038794741 /nfs/dbraw/zinc/79/47/41/1038794741.db2.gz FTRFMCDBQVNANY-WTOYTKOKSA-N 2 0 344.543 4.058 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H](CC2CCOCC2)c2ccccc2F)CC1 ZINC001168312281 1038796853 /nfs/dbraw/zinc/79/68/53/1038796853.db2.gz OEMSWEJEUQMKOW-NGICGMGXSA-N 2 0 348.506 4.146 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cccc(OC(F)F)c2)C1 ZINC000539050701 1038797176 /nfs/dbraw/zinc/79/71/76/1038797176.db2.gz QBZXBNXLVIXRNG-HZPDHXFCSA-N 2 0 340.458 4.307 20 0 EIADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1 ZINC000480763525 1038803981 /nfs/dbraw/zinc/80/39/81/1038803981.db2.gz WQDIHPYEQDJFEE-HZEGPAAWSA-N 2 0 336.564 4.213 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12 ZINC000539062198 1038808087 /nfs/dbraw/zinc/80/80/87/1038808087.db2.gz UAVTUBRMVJENGW-PFHNCQMRSA-N 2 0 346.518 4.073 20 0 EIADRP CSC1(C[NH2+][C@H](c2ccc(F)c(F)c2)C(C)C)CC[NH+](C)CC1 ZINC000554999713 1038822815 /nfs/dbraw/zinc/82/28/15/1038822815.db2.gz GJOQOKNHRHANKS-KRWDZBQOSA-N 2 0 342.499 4.079 20 0 EIADRP Brc1cccc(C2([NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)CCC2)c1 ZINC000252734255 1038860132 /nfs/dbraw/zinc/86/01/32/1038860132.db2.gz GLCNSMUQVVOPGN-IRXDYDNUSA-N 2 0 349.316 4.045 20 0 EIADRP COc1cc([C@@H](C)[NH2+]C[C@H](C)C[NH+]2CCCCC2)ccc1SC ZINC000480909940 1038866321 /nfs/dbraw/zinc/86/63/21/1038866321.db2.gz LFLOYWVLXWQJFF-JKSUJKDBSA-N 2 0 336.545 4.190 20 0 EIADRP COc1cc([C@H](C)[NH2+]C[C@@H](C)C[NH+]2CCCCC2)ccc1SC ZINC000480909937 1038866336 /nfs/dbraw/zinc/86/63/36/1038866336.db2.gz LFLOYWVLXWQJFF-CVEARBPZSA-N 2 0 336.545 4.190 20 0 EIADRP C[NH+](C)C1CCC([NH+]2CCC(C(=O)c3ccc(Cl)cc3)CC2)CC1 ZINC001168324772 1038875027 /nfs/dbraw/zinc/87/50/27/1038875027.db2.gz XBENDDWGWUGVTC-UHFFFAOYSA-N 2 0 348.918 4.108 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000539201326 1038878102 /nfs/dbraw/zinc/87/81/02/1038878102.db2.gz WTWIIUSWZHCSHY-KBXCAEBGSA-N 2 0 340.433 4.478 20 0 EIADRP C[N@H+](Cc1cccc2[nH]ccc21)C1CCN(Cc2ccccc2)CC1 ZINC000119332681 1038886806 /nfs/dbraw/zinc/88/68/06/1038886806.db2.gz KXPUVJKOIUMWSA-UHFFFAOYSA-N 2 0 333.479 4.264 20 0 EIADRP C[NH+](C)C1CCC([N@@H+]2CCSC[C@H]2c2cccc(Cl)c2)CC1 ZINC001168327561 1038897997 /nfs/dbraw/zinc/89/79/97/1038897997.db2.gz OQZBDRJLLGDFBC-ABHNRTSZSA-N 2 0 338.948 4.303 20 0 EIADRP C[NH+](C)C1CCC(n2cc(C3CC[NH2+]CC3)c3ccc(F)cc32)CC1 ZINC001168329576 1038950942 /nfs/dbraw/zinc/95/09/42/1038950942.db2.gz YCMMPFMTTSHYAW-UHFFFAOYSA-N 2 0 343.490 4.293 20 0 EIADRP CCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc3cc(OC)ccc3c2)C1 ZINC000537620567 1038954010 /nfs/dbraw/zinc/95/40/10/1038954010.db2.gz YZBVTCGVENBGLC-GOSISDBHSA-N 2 0 326.484 4.012 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](CC)c2ccc(Br)cc2)C1 ZINC000481027708 1038969475 /nfs/dbraw/zinc/96/94/75/1038969475.db2.gz WRTCKLVHDILORN-PBHICJAKSA-N 2 0 339.321 4.222 20 0 EIADRP Cc1nc(C[NH+]2CCC(C[N@@H+](C)Cc3ccccc3)CC2)sc1C ZINC000088594449 1038976630 /nfs/dbraw/zinc/97/66/30/1038976630.db2.gz WKNQSUDYMFLBOQ-UHFFFAOYSA-N 2 0 343.540 4.104 20 0 EIADRP CCCCOc1ccc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1OC ZINC000414806762 1039018810 /nfs/dbraw/zinc/01/88/10/1039018810.db2.gz ICSKWBAFDWSSDU-MRXNPFEDSA-N 2 0 342.483 4.184 20 0 EIADRP CC[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(OC)cc1 ZINC000089214794 1039022608 /nfs/dbraw/zinc/02/26/08/1039022608.db2.gz AWJIYAJPRQZGDB-NRFANRHFSA-N 2 0 339.483 4.048 20 0 EIADRP C[N@H+](CCCN[C@H](c1ncc[nH]1)C1CCCCC1)C1CCCCC1 ZINC000552040779 1039060447 /nfs/dbraw/zinc/06/04/47/1039060447.db2.gz XIKHMNHXINUWIO-IBGZPJMESA-N 2 0 332.536 4.275 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCCCC[NH+]2CCCCC2)c(C)c1OC ZINC000552047536 1039070246 /nfs/dbraw/zinc/07/02/46/1039070246.db2.gz PSTXOAYUIGNVIM-SFHVURJKSA-N 2 0 348.531 4.319 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(-c3ccco3)cc2F)[C@@H]2CCC[C@H]21 ZINC000552057361 1039075674 /nfs/dbraw/zinc/07/56/74/1039075674.db2.gz QDNPBNQPRRABEN-YTQUADARSA-N 2 0 328.431 4.048 20 0 EIADRP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1cccc(OC(F)F)c1 ZINC000120546710 1039153042 /nfs/dbraw/zinc/15/30/42/1039153042.db2.gz DSVRXSYYOJYNPI-LBPRGKRZSA-N 2 0 326.431 4.248 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000414822946 1039184039 /nfs/dbraw/zinc/18/40/39/1039184039.db2.gz NMQCTTKSLYKUFK-YCPHGPKFSA-N 2 0 328.422 4.004 20 0 EIADRP C[C@H](NCC(C)(C)C[NH+]1CCCC1)c1ccc(Br)s1 ZINC000477931948 1039220712 /nfs/dbraw/zinc/22/07/12/1039220712.db2.gz DKVLTWPILGXHMS-LBPRGKRZSA-N 2 0 345.350 4.283 20 0 EIADRP CCC[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccccc1 ZINC000481305074 1039252307 /nfs/dbraw/zinc/25/23/07/1039252307.db2.gz KAUYWXOSOSBEAU-OAQYLSRUSA-N 2 0 326.484 4.258 20 0 EIADRP CCC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1cccc(C(F)(F)F)c1 ZINC000481325249 1039293352 /nfs/dbraw/zinc/29/33/52/1039293352.db2.gz VBJJTDJWJMBBMT-YOEHRIQHSA-N 2 0 328.422 4.478 20 0 EIADRP CC(C)n1cc([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cn1 ZINC000090775442 1039295965 /nfs/dbraw/zinc/29/59/65/1039295965.db2.gz DAAFHAAPIUESIF-QHGAOEGBSA-N 2 0 332.536 4.158 20 0 EIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H]3CCCC34CCCC4)cc2)CC1 ZINC000550797117 1039308693 /nfs/dbraw/zinc/30/86/93/1039308693.db2.gz LOIXDAMCSMBVAT-NRFANRHFSA-N 2 0 342.527 4.362 20 0 EIADRP COC(C)(C)C[C@@H](C)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000552244438 1039310025 /nfs/dbraw/zinc/31/00/25/1039310025.db2.gz AHHRXHYIHVNDAN-QHGAOEGBSA-N 2 0 332.532 4.223 20 0 EIADRP C[C@@H]1C[C@H](N(C)Cc2ccc(Cl)o2)CC[N@@H+]1Cc1ccccc1 ZINC000552256656 1039318103 /nfs/dbraw/zinc/31/81/03/1039318103.db2.gz WJTLDRFBMCGRFR-NVXWUHKLSA-N 2 0 332.875 4.418 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)c1c(C)noc1C ZINC000090886815 1039319198 /nfs/dbraw/zinc/31/91/98/1039319198.db2.gz WAYLEPBLWRAWKC-LIRRHRJNSA-N 2 0 345.487 4.034 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC000121796808 1039490594 /nfs/dbraw/zinc/49/05/94/1039490594.db2.gz JYVJPIWUYZDIAC-AWEZNQCLSA-N 2 0 326.431 4.061 20 0 EIADRP CC[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1F ZINC000092856896 1039598277 /nfs/dbraw/zinc/59/82/77/1039598277.db2.gz CAOBHTZHRFFWRV-FQEVSTJZSA-N 2 0 345.437 4.317 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CC2(c3cccc(C(F)(F)F)c3)CCC2)CC[N@@H+]1C ZINC000122161484 1039604728 /nfs/dbraw/zinc/60/47/28/1039604728.db2.gz QHKXXMRBHYNJQP-YOEHRIQHSA-N 2 0 340.433 4.199 20 0 EIADRP C[C@@H]1C[C@@H](Nc2cc[nH+]c3cc(OC(F)(F)F)ccc23)CC[N@@H+]1C ZINC000899874946 1039757759 /nfs/dbraw/zinc/75/77/59/1039757759.db2.gz QKHDSSPNTCLBMC-NEPJUHHUSA-N 2 0 339.361 4.028 20 0 EIADRP FC(F)(F)[C@H](CC[NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1 ZINC000550858124 1039787459 /nfs/dbraw/zinc/78/74/59/1039787459.db2.gz KJOAIMXDNQNZQS-GOSISDBHSA-N 2 0 340.433 4.187 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CCCCc2ccccc21 ZINC000481742491 1039804968 /nfs/dbraw/zinc/80/49/68/1039804968.db2.gz LMJQBHPKOKOOKR-NRFANRHFSA-N 2 0 338.495 4.184 20 0 EIADRP COc1ccc2cc(C[N@@H+]3CC[C@H](C[NH+](C)CC4CC4)C3)ccc2c1 ZINC000537647429 1039805644 /nfs/dbraw/zinc/80/56/44/1039805644.db2.gz QEGSYDFFWRBRFI-LJQANCHMSA-N 2 0 338.495 4.012 20 0 EIADRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc3cc(OC)ccc3c2)C1 ZINC000537647469 1039808697 /nfs/dbraw/zinc/80/86/97/1039808697.db2.gz OGEZZRWBZKTVDE-GOSISDBHSA-N 2 0 326.484 4.012 20 0 EIADRP CCCC[NH+]1CCC(N[C@@H](C)c2cccc(OC(F)F)c2)CC1 ZINC000122964918 1039836852 /nfs/dbraw/zinc/83/68/52/1039836852.db2.gz QWAPDUASXBYUJB-AWEZNQCLSA-N 2 0 326.431 4.203 20 0 EIADRP Cc1nc([C@H](C)[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cs1 ZINC000552920142 1039868085 /nfs/dbraw/zinc/86/80/85/1039868085.db2.gz SSSAPUUFJWJSTJ-GJYPPUQNSA-N 2 0 343.540 4.403 20 0 EIADRP Fc1ccc(-c2ccccc2C[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC001168354089 1039878583 /nfs/dbraw/zinc/87/85/83/1039878583.db2.gz YQVKJXJUZFUISB-UHFFFAOYSA-N 2 0 338.470 4.457 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccc(SCC(F)(F)F)cc1 ZINC000481944213 1039898850 /nfs/dbraw/zinc/89/88/50/1039898850.db2.gz HJMNUCDAGDIAMV-ZDUSSCGKSA-N 2 0 334.451 4.333 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)Cc2ccccc2C(F)(F)F)C1 ZINC000481925958 1039902287 /nfs/dbraw/zinc/90/22/87/1039902287.db2.gz NPJTUSBBKCEGNF-CVEARBPZSA-N 2 0 342.449 4.346 20 0 EIADRP C[C@@H](Cc1cccc(F)c1)[NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000311066153 1040014661 /nfs/dbraw/zinc/01/46/61/1040014661.db2.gz YDGHYKQIIYHNNI-AVRDEDQJSA-N 2 0 340.486 4.259 20 0 EIADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000482350873 1040188224 /nfs/dbraw/zinc/18/82/24/1040188224.db2.gz WDJXAFBENABCLX-CQSZACIVSA-N 2 0 344.421 4.010 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](CN[C@H](C)c2ccccc2Br)C1 ZINC000482362197 1040202579 /nfs/dbraw/zinc/20/25/79/1040202579.db2.gz VSZBVVZWTSTGKC-CABCVRRESA-N 2 0 339.321 4.220 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc3ccccc3)C1)CC2 ZINC000482436776 1040245583 /nfs/dbraw/zinc/24/55/83/1040245583.db2.gz JKFZVVXQHNJRHN-OFNKIYASSA-N 2 0 334.507 4.137 20 0 EIADRP Cc1cccnc1C(C)(C)C[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1 ZINC000514820435 1040267741 /nfs/dbraw/zinc/26/77/41/1040267741.db2.gz MMJJLVIZNWDSHU-PXNSSMCTSA-N 2 0 343.559 4.300 20 0 EIADRP CC(C)([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(C(F)(F)F)cc1 ZINC001168356026 1040300717 /nfs/dbraw/zinc/30/07/17/1040300717.db2.gz JBKMQVNPUGNZSW-UHFFFAOYSA-N 2 0 340.433 4.405 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](CC)c2ccccc2OC(F)F)CC1 ZINC000482506925 1040306258 /nfs/dbraw/zinc/30/62/58/1040306258.db2.gz HSSXBLJKNNRVPI-KRWDZBQOSA-N 2 0 340.458 4.451 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@@H]1CCc2c1cc(Cl)cc2Br ZINC000535508888 1040312522 /nfs/dbraw/zinc/31/25/22/1040312522.db2.gz WMVRCQHXZRAARI-OAHLLOKOSA-N 2 0 345.712 4.021 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](CC)c2ccc(OC(F)F)cc2)CC1 ZINC000482516608 1040312495 /nfs/dbraw/zinc/31/24/95/1040312495.db2.gz BDQVRXQJLHSYTM-GOSISDBHSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC3(CCCC3)O2)CCN1Cc1ccccc1 ZINC000379655497 1040317609 /nfs/dbraw/zinc/31/76/09/1040317609.db2.gz MBXNYHLZRZDSLD-GIVPXCGWSA-N 2 0 342.527 4.121 20 0 EIADRP CCC[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000482554412 1040356038 /nfs/dbraw/zinc/35/60/38/1040356038.db2.gz WEJHFYDQJGRRIR-QGZVFWFLSA-N 2 0 328.422 4.478 20 0 EIADRP Fc1ccccc1-c1ccc(C[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)s1 ZINC000666998331 1040420729 /nfs/dbraw/zinc/42/07/29/1040420729.db2.gz NYHFJPTXVDVFEO-AWEZNQCLSA-N 2 0 330.472 4.319 20 0 EIADRP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1cc(-n2ccnc2)cs1 ZINC000479598929 1040498572 /nfs/dbraw/zinc/49/85/72/1040498572.db2.gz DFADGVLJTLBFGR-UHFFFAOYSA-N 2 0 346.544 4.068 20 0 EIADRP CCC[NH+]1CCC(N(C)Cc2ccc(-c3scnc3C)cc2)CC1 ZINC000667534132 1040563868 /nfs/dbraw/zinc/56/38/68/1040563868.db2.gz NWWQZVWSYTWCLV-UHFFFAOYSA-N 2 0 343.540 4.425 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCC[N@@H+]2C2CCCCC2)C1 ZINC000435742448 1040596284 /nfs/dbraw/zinc/59/62/84/1040596284.db2.gz NMMVJGFXELBHPM-INMHGKMJSA-N 2 0 332.454 4.494 20 0 EIADRP CC(C)[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551811866 1040623305 /nfs/dbraw/zinc/62/33/05/1040623305.db2.gz IHMORPFLQLZPOW-LEWJYISDSA-N 2 0 330.516 4.074 20 0 EIADRP CCOCc1ccc(C[NH2+][C@@H](C)c2cccc(C[NH+](C)C)c2)cc1 ZINC000924638447 1040630652 /nfs/dbraw/zinc/63/06/52/1040630652.db2.gz JSPFPIYCTPSZBS-KRWDZBQOSA-N 2 0 326.484 4.136 20 0 EIADRP CSC1(C[NH2+][C@@H]2CCC[C@H]2CCc2ccccc2)CC[NH+](C)CC1 ZINC000515353218 1040674120 /nfs/dbraw/zinc/67/41/20/1040674120.db2.gz GNIBTGBYRPKXKY-VQTJNVASSA-N 2 0 346.584 4.205 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1c2ccccc2CCC[C@H]1C ZINC000462540689 1040713024 /nfs/dbraw/zinc/71/30/24/1040713024.db2.gz UOGZTSJPLRPYJA-ZHRRBRCNSA-N 2 0 346.478 4.379 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cccc(C)c2C)[C@@H](C)C1 ZINC000483124214 1040718443 /nfs/dbraw/zinc/71/84/43/1040718443.db2.gz GJCOTELRKQFGFP-CUWPLCDZSA-N 2 0 332.532 4.091 20 0 EIADRP C[C@H]([NH2+][C@@H]1CSc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000483157367 1040743743 /nfs/dbraw/zinc/74/37/43/1040743743.db2.gz RNYDWRSXSDZQCV-HNAYVOBHSA-N 2 0 342.508 4.125 20 0 EIADRP CN1CCC([NH+]2CCC(CC[N@H+](C)CCC3CCCCC3)CC2)CC1 ZINC000483267029 1040797507 /nfs/dbraw/zinc/79/75/07/1040797507.db2.gz LIOOYYQHSSVUGO-UHFFFAOYSA-N 2 0 349.607 4.085 20 0 EIADRP C[C@@H](c1cccc(Br)c1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000483404593 1040837744 /nfs/dbraw/zinc/83/77/44/1040837744.db2.gz JNRBUVFOZYMOAQ-AWEZNQCLSA-N 2 0 339.321 4.174 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2cccc(-c3ccccn3)c2)CC1 ZINC000539851515 1040839901 /nfs/dbraw/zinc/83/99/01/1040839901.db2.gz LGVWWSDQOOTYRE-UHFFFAOYSA-N 2 0 337.511 4.302 20 0 EIADRP Cc1cn2c(n1)[C@@H](C[NH2+][C@@H]1C[C@H](C)Sc3sccc31)CCC2 ZINC000483432580 1040856255 /nfs/dbraw/zinc/85/62/55/1040856255.db2.gz JDTUDKMXKHTMEV-GZBFAFLISA-N 2 0 333.526 4.346 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](CCCOc3cccc4ccccc43)CC[C@@H]21 ZINC000483485335 1040875175 /nfs/dbraw/zinc/87/51/75/1040875175.db2.gz RQPXRQZARCKAHI-CTNGQTDRSA-N 2 0 338.495 4.025 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1cncc(F)c1 ZINC000537939339 1040903972 /nfs/dbraw/zinc/90/39/72/1040903972.db2.gz MBVYCCPJRSHGJZ-JENIJYKNSA-N 2 0 341.474 4.172 20 0 EIADRP CCC1(C[NH2+]C2CCSCC2)CC[NH+](Cc2ccccc2)CC1 ZINC000537941968 1040907497 /nfs/dbraw/zinc/90/74/97/1040907497.db2.gz KEUFAHQOFOBBIL-UHFFFAOYSA-N 2 0 332.557 4.164 20 0 EIADRP Cc1ccc(CC[C@@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)o1 ZINC000483660543 1040939386 /nfs/dbraw/zinc/93/93/86/1040939386.db2.gz MDEVBPUJCLPZNV-AEFFLSMTSA-N 2 0 344.499 4.200 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000462793863 1040945092 /nfs/dbraw/zinc/94/50/92/1040945092.db2.gz SLRAWFINJPZSQV-BHDDXSALSA-N 2 0 344.543 4.213 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000462796984 1040950002 /nfs/dbraw/zinc/95/00/02/1040950002.db2.gz ALEGNUVKWCEITL-STZQEDGTSA-N 2 0 344.543 4.212 20 0 EIADRP Cc1ccc(CC[C@@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)o1 ZINC000483654650 1040950962 /nfs/dbraw/zinc/95/09/62/1040950962.db2.gz OJXVVOZISDNUCT-AEFFLSMTSA-N 2 0 344.499 4.200 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCCc3c(O)cccc32)CC1 ZINC000462803673 1040970047 /nfs/dbraw/zinc/97/00/47/1040970047.db2.gz CBBFOHAIEOMYAZ-HXUWFJFHSA-N 2 0 330.516 4.117 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)CC1 ZINC000483753634 1041000912 /nfs/dbraw/zinc/00/09/12/1041000912.db2.gz ZWLULCBYCRTKGG-CQSZACIVSA-N 2 0 328.422 4.478 20 0 EIADRP CC[C@@H]([NH2+]CCC1CC[NH+](CC)CC1)c1ccccc1OC(F)F ZINC000483752121 1041001251 /nfs/dbraw/zinc/00/12/51/1041001251.db2.gz XIJJKBDACNUMEG-QGZVFWFLSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCC2CC2)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000480273623 1041146938 /nfs/dbraw/zinc/14/69/38/1041146938.db2.gz IVBDNFBHXZIEMG-YLJYHZDGSA-N 2 0 342.527 4.218 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@@H]3C)cc2)cs1 ZINC000480272829 1041151641 /nfs/dbraw/zinc/15/16/41/1041151641.db2.gz DYRDXGVCGBITEV-XMDUPGNXSA-N 2 0 343.540 4.498 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000484280791 1041184028 /nfs/dbraw/zinc/18/40/28/1041184028.db2.gz TXDAZEMWWUPJOA-OCCSQVGLSA-N 2 0 333.303 4.001 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000484305281 1041190470 /nfs/dbraw/zinc/19/04/70/1041190470.db2.gz VFIIDBSKJHHGPW-JSGCOSHPSA-N 2 0 333.303 4.001 20 0 EIADRP CCc1nc2c(s1)[C@H]([NH2+]CC1CC[NH+](CCC(C)C)CC1)CCC2 ZINC000484304048 1041193653 /nfs/dbraw/zinc/19/36/53/1041193653.db2.gz UADJWPIGEPYKFE-QGZVFWFLSA-N 2 0 349.588 4.431 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)c(OC)c1 ZINC000484297503 1041198979 /nfs/dbraw/zinc/19/89/79/1041198979.db2.gz IKJSXBYARDXWKM-KRWDZBQOSA-N 2 0 348.531 4.113 20 0 EIADRP Cc1ccc(SC2(C[NH2+][C@H]3CC[N@@H+](C)C[C@@H]3C)CCCC2)cc1 ZINC000484308111 1041205309 /nfs/dbraw/zinc/20/53/09/1041205309.db2.gz LYLMDENCGWLWEA-HKUYNNGSSA-N 2 0 332.557 4.330 20 0 EIADRP Cc1ccc(SC2(C[NH2+][C@@H]3CC[N@@H+](C)C[C@H]3C)CCCC2)cc1 ZINC000484308112 1041205803 /nfs/dbraw/zinc/20/58/03/1041205803.db2.gz LYLMDENCGWLWEA-IEBWSBKVSA-N 2 0 332.557 4.330 20 0 EIADRP C[C@H]1CC([NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)C[C@H](C)C1 ZINC000538297610 1041249265 /nfs/dbraw/zinc/24/92/65/1041249265.db2.gz WWTGKOCALYLKSG-MBOZVWFJSA-N 2 0 342.527 4.389 20 0 EIADRP CSc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000194873935 1041249306 /nfs/dbraw/zinc/24/93/06/1041249306.db2.gz QSFZRNKOSZWJJE-MRXNPFEDSA-N 2 0 344.524 4.200 20 0 EIADRP CSc1ccccc1[C@H](C)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000194919120 1041316477 /nfs/dbraw/zinc/31/64/77/1041316477.db2.gz TUCPPNJVOCPNGA-INIZCTEOSA-N 2 0 341.524 4.371 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)cc1 ZINC000566230095 1041402545 /nfs/dbraw/zinc/40/25/45/1041402545.db2.gz GSDBTRHPQPXRNF-UHFFFAOYSA-N 2 0 328.765 4.107 20 0 EIADRP C[C@H](Nc1ccc(N2CC[C@@H]([NH+](C)C)C2)cn1)c1ccc(Cl)cc1 ZINC000538557760 1041420557 /nfs/dbraw/zinc/42/05/57/1041420557.db2.gz LWMGAINMYIUUOW-KBXCAEBGSA-N 2 0 344.890 4.048 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cc(F)c(F)c(F)c1 ZINC000480606330 1041431250 /nfs/dbraw/zinc/43/12/50/1041431250.db2.gz DDHUWCMPJAZXFO-KGLIPLIRSA-N 2 0 328.422 4.267 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cccc(OC(F)F)c1 ZINC000480622501 1041437452 /nfs/dbraw/zinc/43/74/52/1041437452.db2.gz YNWFIJDBFSTDKB-CVEARBPZSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@H]([NH2+]CC1(C[NH2+][C@@H](C)C2CCCCC2)COC1)C1CCCCC1 ZINC000554842244 1041442478 /nfs/dbraw/zinc/44/24/78/1041442478.db2.gz KFOZMRBJVRSQOC-ROUUACIJSA-N 2 0 336.564 4.120 20 0 EIADRP COCCC[C@H](C)[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000480693543 1041475850 /nfs/dbraw/zinc/47/58/50/1041475850.db2.gz CMYZSRXIODLASE-QRVBRYPASA-N 2 0 332.532 4.069 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)c(F)c1 ZINC000195135327 1041486918 /nfs/dbraw/zinc/48/69/18/1041486918.db2.gz VLLZXWUJLQVAST-RDJZCZTQSA-N 2 0 330.422 4.138 20 0 EIADRP COCCC[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000480723741 1041491035 /nfs/dbraw/zinc/49/10/35/1041491035.db2.gz FCPDDIBIHIVNBU-FHWLQOOXSA-N 2 0 332.532 4.069 20 0 EIADRP COc1ccc([C@H](CCC(C)C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000480749108 1041505442 /nfs/dbraw/zinc/50/54/42/1041505442.db2.gz ZWJARYOOIGBSRA-UWJYYQICSA-N 2 0 330.516 4.246 20 0 EIADRP Cc1cccc(COc2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H](C)C3)cc2)c1 ZINC000480753977 1041510188 /nfs/dbraw/zinc/51/01/88/1041510188.db2.gz CPLQXMMXWSEYHZ-GHTZIAJQSA-N 2 0 338.495 4.146 20 0 EIADRP COc1ccc(C[N@@H+]2CC[C@H](C[NH+](C)CC3CC3)C2)c2ccccc12 ZINC000538751049 1041526707 /nfs/dbraw/zinc/52/67/07/1041526707.db2.gz MZVVMGCGSREMSA-GOSISDBHSA-N 2 0 338.495 4.012 20 0 EIADRP CCCOc1cc(C[NH+]2CCC(CCC[NH+](C)C)CC2)ccc1OC ZINC000538751026 1041528615 /nfs/dbraw/zinc/52/86/15/1041528615.db2.gz LDYQUGWVLHEGAA-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1oc2ccccc2c1CC ZINC000540595269 1041550739 /nfs/dbraw/zinc/55/07/39/1041550739.db2.gz SAUOLNWKDYNQBO-JKSUJKDBSA-N 2 0 332.488 4.003 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCC[C@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000540607284 1041559521 /nfs/dbraw/zinc/55/95/21/1041559521.db2.gz MCPBMULMMGNOMV-MAUKXSAKSA-N 2 0 339.310 4.481 20 0 EIADRP c1ccc(CC[C@H](Cc2ccccc2)[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000461799873 1041592648 /nfs/dbraw/zinc/59/26/48/1041592648.db2.gz XEAKXVZMZKISIX-WXFUMESZSA-N 2 0 348.534 4.447 20 0 EIADRP COc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(C)c1 ZINC000540962866 1041753717 /nfs/dbraw/zinc/75/37/17/1041753717.db2.gz XRCHRDRUYPJUDB-WIYYLYMNSA-N 2 0 338.495 4.004 20 0 EIADRP CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000540982947 1041765697 /nfs/dbraw/zinc/76/56/97/1041765697.db2.gz YAYHQXBRKVPSPY-IERDGZPVSA-N 2 0 348.506 4.288 20 0 EIADRP CO[C@@H](c1ccc(F)cc1)[C@@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000540982948 1041765843 /nfs/dbraw/zinc/76/58/43/1041765843.db2.gz YAYHQXBRKVPSPY-IIBYNOLFSA-N 2 0 348.506 4.288 20 0 EIADRP C[C@@H](Cc1ccsc1)[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000541234371 1041859698 /nfs/dbraw/zinc/85/96/98/1041859698.db2.gz DXGODMGBKMCXES-PXNSSMCTSA-N 2 0 328.525 4.133 20 0 EIADRP CCN1CCC[C@@H]1C[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000425936780 1041985189 /nfs/dbraw/zinc/98/51/89/1041985189.db2.gz JPVZDYSRRQHCGK-WOJBJXKFSA-N 2 0 343.902 4.093 20 0 EIADRP C[N@H+](CCOC1CCCCCC1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464831476 1042188784 /nfs/dbraw/zinc/18/87/84/1042188784.db2.gz AINANSGXTQPSSA-NRFANRHFSA-N 2 0 344.543 4.180 20 0 EIADRP OC[C@H]1CCC[N@@H+]1CCCC[NH2+][C@H](c1ccccc1)C1CCCCC1 ZINC000542084065 1042270598 /nfs/dbraw/zinc/27/05/98/1042270598.db2.gz AJFCAXCQVRZOPK-FGZHOGPDSA-N 2 0 344.543 4.135 20 0 EIADRP Fc1cccc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)s2)c1 ZINC000509573139 1042385092 /nfs/dbraw/zinc/38/50/92/1042385092.db2.gz ZAKVTVPFASGJLJ-IAGOWNOFSA-N 2 0 330.472 4.271 20 0 EIADRP CC(C)CCOc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000518274381 1042447268 /nfs/dbraw/zinc/44/72/68/1042447268.db2.gz ZAZLMROLWQWQCW-HXUWFJFHSA-N 2 0 332.532 4.322 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1CCc2cc(F)ccc2C1 ZINC001168442473 1042505920 /nfs/dbraw/zinc/50/59/20/1042505920.db2.gz VMGFSJAHRAAOKM-HBMCJLEFSA-N 2 0 330.491 4.022 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+]CCC[C@H]2CCC[NH2+]2)cc1 ZINC000414983636 1042520833 /nfs/dbraw/zinc/52/08/33/1042520833.db2.gz ZYVOKCPXLPIKNY-GIVPXCGWSA-N 2 0 330.516 4.232 20 0 EIADRP C/C(=C/c1ccccc1)C[N@@H+](C)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000426391110 1042637416 /nfs/dbraw/zinc/63/74/16/1042637416.db2.gz OCPUZOCUSHAOJD-LGMDPLHJSA-N 2 0 332.451 4.111 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCC[NH2+]Cc2cccc(-c3ccncc3)c2)C1 ZINC000439479478 1042656824 /nfs/dbraw/zinc/65/68/24/1042656824.db2.gz UHZVQLYGCWMGFC-RTBURBONSA-N 2 0 337.511 4.206 20 0 EIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000439789397 1042768754 /nfs/dbraw/zinc/76/87/54/1042768754.db2.gz PKXGRTPVRGANEF-OAQYLSRUSA-N 2 0 344.543 4.036 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000415006328 1042803821 /nfs/dbraw/zinc/80/38/21/1042803821.db2.gz QIFKHLKIHBFUAY-UNEWFSDZSA-N 2 0 328.422 4.134 20 0 EIADRP CCc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000309707880 1042819615 /nfs/dbraw/zinc/81/96/15/1042819615.db2.gz IMPNKUCFLQEITC-WMZOPIPTSA-N 2 0 328.525 4.311 20 0 EIADRP C[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311145898 1042853871 /nfs/dbraw/zinc/85/38/71/1042853871.db2.gz ZLARZIMBKPEGNL-BPXKWBHBSA-N 2 0 338.470 4.313 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H]2CCc3[nH]c4ccc(C)cc4c3C2)CC1 ZINC000493275765 1042891273 /nfs/dbraw/zinc/89/12/73/1042891273.db2.gz BVJNMFLVASQPHS-SFHVURJKSA-N 2 0 339.527 4.045 20 0 EIADRP CC[C@@H]1C[C@@H](C[N@H+](CC)C[C@@H]2CC[NH+](Cc3ccccc3)C2)CCO1 ZINC000507784521 1042928576 /nfs/dbraw/zinc/92/85/76/1042928576.db2.gz RNPZIUSHFZEVPR-FDFHNCONSA-N 2 0 344.543 4.036 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[NH2+]CC1CC[NH+](C2CCCCC2)CC1 ZINC001168459652 1042957103 /nfs/dbraw/zinc/95/71/03/1042957103.db2.gz NNIPQOPKPUEYRH-QGZVFWFLSA-N 2 0 332.507 4.391 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2cc(Br)cs2)CC1 ZINC000493967185 1042995938 /nfs/dbraw/zinc/99/59/38/1042995938.db2.gz FMAIERUABYBGRG-LBPRGKRZSA-N 2 0 345.350 4.283 20 0 EIADRP CCCC[N@H+](CC)CCNC1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168008114 1043031905 /nfs/dbraw/zinc/03/19/05/1043031905.db2.gz CNYGBKDWAUXVMB-WOJBJXKFSA-N 2 0 345.575 4.140 20 0 EIADRP Cc1nc2ccc(C[NH2+][C@@H](C)[C@H]3CCC[N@@H+](C4CCC4)C3)cc2s1 ZINC000494196804 1043032219 /nfs/dbraw/zinc/03/22/19/1043032219.db2.gz ZQWZDBXORQQKLX-YOEHRIQHSA-N 2 0 343.540 4.347 20 0 EIADRP Cc1nc2ccc(C[NH2+][C@H](C)[C@H]3CCC[N@@H+](C4CCC4)C3)cc2s1 ZINC000494196801 1043032856 /nfs/dbraw/zinc/03/28/56/1043032856.db2.gz ZQWZDBXORQQKLX-PBHICJAKSA-N 2 0 343.540 4.347 20 0 EIADRP C[C@H]1CC([NH2+]CCC2(O)CCCCC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168008560 1043072335 /nfs/dbraw/zinc/07/23/35/1043072335.db2.gz FMBLGEWCNWKJBB-OALUTQOASA-N 2 0 344.543 4.103 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3cc(O)cc(F)c3)cc2)C1 ZINC000185467212 1043187534 /nfs/dbraw/zinc/18/75/34/1043187534.db2.gz NRZRYQXBKZAWJY-MRXNPFEDSA-N 2 0 342.458 4.053 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cnc3ccccc3c2)cc1 ZINC000727465442 1043225834 /nfs/dbraw/zinc/22/58/34/1043225834.db2.gz HIUPNBAQDVBYET-UHFFFAOYSA-N 2 0 333.479 4.366 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+]CC2(CCOCc3ccccc3)CC2)CC1 ZINC000186374516 1043273768 /nfs/dbraw/zinc/27/37/68/1043273768.db2.gz AELHVNQOAYSJJH-UHFFFAOYSA-N 2 0 344.543 4.226 20 0 EIADRP CCC[N@H+](C)C[C@@H]1CC[NH+](CCCc2ccc(C(F)(F)F)cc2)C1 ZINC000674007999 1043285638 /nfs/dbraw/zinc/28/56/38/1043285638.db2.gz VODYWMWFEQKFOG-KRWDZBQOSA-N 2 0 342.449 4.302 20 0 EIADRP COC1(C[NH2+][C@@H](C)C2CC[NH+](C)CC2)CCC(c2ccccc2)CC1 ZINC000672614327 1043303664 /nfs/dbraw/zinc/30/36/64/1043303664.db2.gz JWIQFOUXKYTRKK-XTWGIRIWSA-N 2 0 344.543 4.049 20 0 EIADRP c1ccc(C[C@H](C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000166784786 1043315546 /nfs/dbraw/zinc/31/55/46/1043315546.db2.gz XCNKJBJGAVRUTF-XPWALMASSA-N 2 0 334.507 4.229 20 0 EIADRP COCC(C)(C)CCC[NH2+][C@@H]1CCN(C2CC2)[C@H](c2ccccc2)C1 ZINC000639181384 1043329745 /nfs/dbraw/zinc/32/97/45/1043329745.db2.gz RUSCYKPNZQWFQT-CTNGQTDRSA-N 2 0 344.543 4.397 20 0 EIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CCSCC1 ZINC000187191530 1043333751 /nfs/dbraw/zinc/33/37/51/1043333751.db2.gz WQNYIXPVFPSBAI-BRIRTLKKSA-N 2 0 344.568 4.303 20 0 EIADRP C[C@@H]1C[C@@H](n2ccc3cc(C[NH3+])cnc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168012451 1043423994 /nfs/dbraw/zinc/42/39/94/1043423994.db2.gz AKJUIMFAVGGERF-UPHUGPLXSA-N 2 0 348.494 4.109 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccnn1-c1ccccc1 ZINC000467363817 1043578633 /nfs/dbraw/zinc/57/86/33/1043578633.db2.gz GBQFDCAWLNURDZ-MOPGFXCFSA-N 2 0 340.515 4.035 20 0 EIADRP CC[C@@H]1C[N@H+](CCCCn2ccnc2C)CC[C@@H]1c1ccccc1 ZINC000442394517 1043670372 /nfs/dbraw/zinc/67/03/72/1043670372.db2.gz SHOSLCGPXOTZGE-CTNGQTDRSA-N 2 0 325.500 4.487 20 0 EIADRP CCc1ccc([C@@H](CC)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658067384 1043723964 /nfs/dbraw/zinc/72/39/64/1043723964.db2.gz MZRLCMRUEAGYEV-JOCHJYFZSA-N 2 0 344.543 4.181 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1Cc2[nH]c3ccccc3c2C1 ZINC000442637831 1043778344 /nfs/dbraw/zinc/77/83/44/1043778344.db2.gz QCGPDLQSAQMFJK-LJQANCHMSA-N 2 0 347.506 4.267 20 0 EIADRP COCCC[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000442660223 1043790654 /nfs/dbraw/zinc/79/06/54/1043790654.db2.gz YOWDLCQKDGNSHI-OAQYLSRUSA-N 2 0 344.474 4.145 20 0 EIADRP CC(C)[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1ccc2[nH]c(=O)oc2c1 ZINC000542487824 1043796561 /nfs/dbraw/zinc/79/65/61/1043796561.db2.gz HPTICCGNSLVHSQ-HNAYVOBHSA-N 2 0 345.487 4.085 20 0 EIADRP CCC[NH+]1CCC(C[NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)CC1 ZINC000731679110 1043815909 /nfs/dbraw/zinc/81/59/09/1043815909.db2.gz WGEOEXQPASMNLP-UHFFFAOYSA-N 2 0 330.516 4.002 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2occc2c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000658119596 1043837042 /nfs/dbraw/zinc/83/70/42/1043837042.db2.gz MUEJQYHSNQRYSY-MRXNPFEDSA-N 2 0 338.451 4.224 20 0 EIADRP Cc1ccncc1CC[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000658124402 1043839347 /nfs/dbraw/zinc/83/93/47/1043839347.db2.gz RLXCAHCAEVGEFP-UHFFFAOYSA-N 2 0 331.548 4.201 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1cccc(O)c1 ZINC000442872457 1043873100 /nfs/dbraw/zinc/87/31/00/1043873100.db2.gz JNRWJFQWJJIIHR-WSTZPKSXSA-N 2 0 338.495 4.344 20 0 EIADRP Cc1cc2c(c(C)c1)[C@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CC2 ZINC000658168174 1043952262 /nfs/dbraw/zinc/95/22/62/1043952262.db2.gz ZWKNEMTZGKHLHU-JOCHJYFZSA-N 2 0 349.522 4.188 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2cnc(-c3ccco3)s2)C1 ZINC000193007346 1043992988 /nfs/dbraw/zinc/99/29/88/1043992988.db2.gz JQPAICRKGJTQBL-HZPDHXFCSA-N 2 0 347.528 4.251 20 0 EIADRP Clc1csc(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)c1 ZINC000193083145 1043998441 /nfs/dbraw/zinc/99/84/41/1043998441.db2.gz SYDAGSFTPDZDSG-MRXNPFEDSA-N 2 0 334.916 4.056 20 0 EIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000193973941 1044226794 /nfs/dbraw/zinc/22/67/94/1044226794.db2.gz SYSNDIKJARECGP-HOCLYGCPSA-N 2 0 340.433 4.100 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](COC)c2ccc(Cl)cc2)c1 ZINC000194027298 1044243713 /nfs/dbraw/zinc/24/37/13/1044243713.db2.gz FLSOMWIQRYKOFG-HXUWFJFHSA-N 2 0 346.902 4.269 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCCC[C@@H]1c1ccccc1 ZINC000358274946 1044261177 /nfs/dbraw/zinc/26/11/77/1044261177.db2.gz FLAWXESQKMFYAV-OAQYLSRUSA-N 2 0 332.451 4.303 20 0 EIADRP C[C@H]([NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1)c1ccc(O)cc1 ZINC001168017928 1044318783 /nfs/dbraw/zinc/31/87/83/1044318783.db2.gz YDQIVCCCRXXXNK-BZSNNMDCSA-N 2 0 338.495 4.484 20 0 EIADRP COCC[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1 ZINC000347930240 1044330327 /nfs/dbraw/zinc/33/03/27/1044330327.db2.gz KOMGPTOIUAIAAY-CUWPLCDZSA-N 2 0 330.516 4.007 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)CC1 ZINC000326984276 1044348594 /nfs/dbraw/zinc/34/85/94/1044348594.db2.gz QWNJBCFMUBSONU-FQEVSTJZSA-N 2 0 326.459 4.237 20 0 EIADRP C[C@@H](C[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)Cc1ccccc1 ZINC000542518625 1044451197 /nfs/dbraw/zinc/45/11/97/1044451197.db2.gz YAQCJYSMFXEDPK-NFBKMPQASA-N 2 0 336.523 4.019 20 0 EIADRP C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000675801089 1044504822 /nfs/dbraw/zinc/50/48/22/1044504822.db2.gz UTSPSUZQINMYEE-OLZOCXBDSA-N 2 0 329.315 4.244 20 0 EIADRP CCC[C@H]([NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccccn1 ZINC000675817976 1044513763 /nfs/dbraw/zinc/51/37/63/1044513763.db2.gz ZHIYONBCPOHGQS-UTKZUKDTSA-N 2 0 341.499 4.214 20 0 EIADRP CCC[C@H]([NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccccn1 ZINC000675815275 1044514736 /nfs/dbraw/zinc/51/47/36/1044514736.db2.gz AOJGPKRKCJBZFQ-UTKZUKDTSA-N 2 0 341.499 4.214 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000494967771 1044564750 /nfs/dbraw/zinc/56/47/50/1044564750.db2.gz IVXJYVSJIXJWSD-FQEVSTJZSA-N 2 0 344.861 4.420 20 0 EIADRP C[C@@H]([NH2+]Cc1ccncc1OCC[NH+](C)C)c1cccc2ccccc21 ZINC000676052755 1044619021 /nfs/dbraw/zinc/61/90/21/1044619021.db2.gz PZRJRHKQFJXQBG-QGZVFWFLSA-N 2 0 349.478 4.026 20 0 EIADRP Cc1ccccc1[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)C1CCCC1 ZINC000495081001 1044651317 /nfs/dbraw/zinc/65/13/17/1044651317.db2.gz FLTKWKNGFHJEMQ-IFMALSPDSA-N 2 0 344.543 4.053 20 0 EIADRP CC1([NH+]2CCCC2)CCC([NH2+]Cc2ccnc(Cl)c2Cl)CC1 ZINC000922506415 1044791211 /nfs/dbraw/zinc/79/12/11/1044791211.db2.gz ZOBJYWZDCQPMRY-UHFFFAOYSA-N 2 0 342.314 4.275 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(C(F)(F)F)s2)C1 ZINC000428874632 1044801747 /nfs/dbraw/zinc/80/17/47/1044801747.db2.gz ADXXFIMPOVGKBN-ZDUSSCGKSA-N 2 0 334.451 4.369 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CCN(C2CC2)[C@H](c2ccccc2)C1)[C@H]1CCCOC1 ZINC000895663397 1044842516 /nfs/dbraw/zinc/84/25/16/1044842516.db2.gz KPSUGSYYLBWXJN-MXNKGDRCSA-N 2 0 342.527 4.149 20 0 EIADRP CC(C)[NH+]1CCC([NH+]2CCC(Cc3ccc(F)c(F)c3)CC2)CC1 ZINC000469810405 1044877294 /nfs/dbraw/zinc/87/72/94/1044877294.db2.gz WYQCCORHCZQLPX-UHFFFAOYSA-N 2 0 336.470 4.092 20 0 EIADRP CCC1(C[NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CCOCC1 ZINC001168033988 1044907707 /nfs/dbraw/zinc/90/77/07/1044907707.db2.gz NWDXGNVTQIETQG-CEQLMSFQSA-N 2 0 344.543 4.224 20 0 EIADRP CCC(C)(C)c1ccc(C[N@@H+]2CCO[C@@H]3C[C@H]([NH+](C)C)CC[C@H]32)cc1 ZINC000509022457 1044943670 /nfs/dbraw/zinc/94/36/70/1044943670.db2.gz PUPVVBJVJQUNND-NJDAHSKKSA-N 2 0 344.543 4.058 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2ccc3ccc(F)c(F)c3n2)CC1 ZINC000922845362 1044997245 /nfs/dbraw/zinc/99/72/45/1044997245.db2.gz OYKJCVSSILDIAO-UHFFFAOYSA-N 2 0 345.437 4.010 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]Cc3ccc(C(C)(C)O)cc3)CC2)C1 ZINC000186605551 1045034065 /nfs/dbraw/zinc/03/40/65/1045034065.db2.gz DJWKGFPYVUETEO-DYESRHJHSA-N 2 0 344.543 4.047 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@@H]2CCCNc3ccccc32)C1 ZINC000347919691 1045097428 /nfs/dbraw/zinc/09/74/28/1045097428.db2.gz KIPXHLLYKJFQPS-DBXWQHBBSA-N 2 0 329.532 4.281 20 0 EIADRP COC1(C[C@H](C)[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CCC1 ZINC000429443347 1045143192 /nfs/dbraw/zinc/14/31/92/1045143192.db2.gz CQKFREACEJJMMX-ZVDOUQERSA-N 2 0 344.543 4.224 20 0 EIADRP FC(F)(F)CC1C[C@H]2CC[C@@H](C1)[N@H+]2CCC1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000923526909 1045150305 /nfs/dbraw/zinc/15/03/05/1045150305.db2.gz VQLNAZYMEYGNDT-DBPPKFAGSA-N 2 0 330.438 4.103 20 0 EIADRP CCCCc1noc([C@H](C)N(CC)Cc2ccc(C[NH+](C)C)cc2)n1 ZINC000626062259 1045165199 /nfs/dbraw/zinc/16/51/99/1045165199.db2.gz MXYXMYUQCJVJQE-INIZCTEOSA-N 2 0 344.503 4.057 20 0 EIADRP O[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2CCC3(CCCCC3)CC2)CC1 ZINC000466747147 1045180216 /nfs/dbraw/zinc/18/02/16/1045180216.db2.gz FDMUNLGCCXLHFB-NHCUHLMSSA-N 2 0 348.575 4.237 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1sc2nc(C)nc(C)c2c1C ZINC000915225910 1045196791 /nfs/dbraw/zinc/19/67/91/1045196791.db2.gz FZHMRGISHANQCM-ZDUSSCGKSA-N 2 0 348.560 4.217 20 0 EIADRP CCCCCCOc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000915681644 1045447294 /nfs/dbraw/zinc/44/72/94/1045447294.db2.gz FMOHFPITTWQQBT-VQTJNVASSA-N 2 0 330.516 4.362 20 0 EIADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC(c2nc(C(C)(C)C)cs2)CC1 ZINC000767384196 1045524143 /nfs/dbraw/zinc/52/41/43/1045524143.db2.gz TYTIKTLSAGVVKA-INIZCTEOSA-N 2 0 335.561 4.104 20 0 EIADRP CC(C)(C)C[N@@H+](C1CC(C)(C)N(O)C(C)(C)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001169984330 1045724706 /nfs/dbraw/zinc/72/47/06/1045724706.db2.gz JJPKLCUJMGESRO-WKILWMFISA-N 2 0 339.568 4.015 20 0 EIADRP C[C@H]([NH2+][C@H]1CCSc2ccccc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248407255 1045871759 /nfs/dbraw/zinc/87/17/59/1045871759.db2.gz UDTWLPJFSYPALN-FCEWJHQRSA-N 2 0 330.541 4.466 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CCC[C@H]2CCCCO2)C3)cc1 ZINC000248887158 1045887886 /nfs/dbraw/zinc/88/78/86/1045887886.db2.gz MKPOAEWZMZTNDP-YUMYIRISSA-N 2 0 342.527 4.121 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CCCCCCOc2ccc(Cl)cc2)CC[N@@H+]1C ZINC000769418079 1045956949 /nfs/dbraw/zinc/95/69/49/1045956949.db2.gz TXKYLQFKIWMIBN-FUHWJXTLSA-N 2 0 338.923 4.352 20 0 EIADRP C[C@@H](Cc1ccccc1Cl)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001170250347 1045972357 /nfs/dbraw/zinc/97/23/57/1045972357.db2.gz KPKKZEFUQFTTAJ-HKUYNNGSSA-N 2 0 342.914 4.383 20 0 EIADRP C[C@H](Cc1ccccc1Cl)[NH2+]CCc1ccc(C[NH+](C)C)cc1 ZINC001170255816 1045975002 /nfs/dbraw/zinc/97/50/02/1045975002.db2.gz ZQKYPYFOQONCID-MRXNPFEDSA-N 2 0 330.903 4.165 20 0 EIADRP CC(C)Oc1cccc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)c1 ZINC000769536615 1046011996 /nfs/dbraw/zinc/01/19/96/1046011996.db2.gz BXYRFZYOSUIWPE-UHFFFAOYSA-N 2 0 326.484 4.167 20 0 EIADRP C[C@@H]([NH3+])[C@H]1CCC[N@H+](CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000261658762 1046131288 /nfs/dbraw/zinc/13/12/88/1046131288.db2.gz BLLDDEIDVFBFJL-QAPCUYQASA-N 2 0 344.449 4.156 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[N@H+](C)CC2CC[NH2+]CC2)cc1 ZINC000261738887 1046139382 /nfs/dbraw/zinc/13/93/82/1046139382.db2.gz MMROLPSXEYMKCW-KRWDZBQOSA-N 2 0 338.495 4.355 20 0 EIADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(SCC(F)F)cc1 ZINC000125293362 1046296290 /nfs/dbraw/zinc/29/62/90/1046296290.db2.gz MOYLMQURDLGAGI-CQSZACIVSA-N 2 0 342.499 4.426 20 0 EIADRP COCCC1(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CCCC1 ZINC000508699885 1046325869 /nfs/dbraw/zinc/32/58/69/1046325869.db2.gz OYYMIPPBIMEFEE-FPOVZHCZSA-N 2 0 344.543 4.084 20 0 EIADRP c1ccc(C(C[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)c2ccccc2)cc1 ZINC000508708705 1046351263 /nfs/dbraw/zinc/35/12/63/1046351263.db2.gz DSXVBAMNPLDKQP-HXUWFJFHSA-N 2 0 334.507 4.236 20 0 EIADRP C[C@@H]([NH2+]CCc1cccc(F)c1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508710050 1046366353 /nfs/dbraw/zinc/36/63/53/1046366353.db2.gz KVEZBTYQWLFUND-APWZRJJASA-N 2 0 344.449 4.008 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)c1 ZINC000162588606 1046368310 /nfs/dbraw/zinc/36/83/10/1046368310.db2.gz RHCPNDSSZKGVDI-HXUWFJFHSA-N 2 0 344.886 4.058 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]CC1CC[NH2+]CC1 ZINC000455633292 1046385488 /nfs/dbraw/zinc/38/54/88/1046385488.db2.gz CJGQMJFAKFYWLX-LBPRGKRZSA-N 2 0 349.931 4.422 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000126343868 1046476494 /nfs/dbraw/zinc/47/64/94/1046476494.db2.gz NMJRMSCXRLGLOB-CQSZACIVSA-N 2 0 329.513 4.111 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cc(C)c(Br)s2)C[C@H]1C ZINC000536662000 1046632769 /nfs/dbraw/zinc/63/27/69/1046632769.db2.gz JXYWTJNXUBXDQY-CHWSQXEVSA-N 2 0 345.350 4.124 20 0 EIADRP CC(C)[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1F ZINC000459440639 1046668001 /nfs/dbraw/zinc/66/80/01/1046668001.db2.gz NYMDOQMPGBHWSQ-FQEVSTJZSA-N 2 0 345.437 4.316 20 0 EIADRP FC(F)(F)[C@@H]1CCCC[C@H]1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459433670 1046669885 /nfs/dbraw/zinc/66/98/85/1046669885.db2.gz HFUDTFDPYDCCAK-WMLDXEAASA-N 2 0 341.421 4.009 20 0 EIADRP C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1cc2cccc(F)c2o1 ZINC000459497305 1046726147 /nfs/dbraw/zinc/72/61/47/1046726147.db2.gz RTGQUSIEWHYDQN-AWEZNQCLSA-N 2 0 339.414 4.287 20 0 EIADRP Clc1cc2c(s1)CC[C@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459558020 1046776729 /nfs/dbraw/zinc/77/67/29/1046776729.db2.gz FYQPGUXOFAEAAV-OAHLLOKOSA-N 2 0 333.888 4.042 20 0 EIADRP Clc1cc2c(s1)CCC[C@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459566893 1046788482 /nfs/dbraw/zinc/78/84/82/1046788482.db2.gz ZFDOTLLEFWTUGK-MRXNPFEDSA-N 2 0 347.915 4.433 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc2ccccc2c1 ZINC000536859338 1046826550 /nfs/dbraw/zinc/82/65/50/1046826550.db2.gz RZNWUVUMFNCUKQ-CEXWTWQISA-N 2 0 340.511 4.380 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC(C)(C)c1c(Cl)cccc1Cl ZINC000536865813 1046831474 /nfs/dbraw/zinc/83/14/74/1046831474.db2.gz XXYXFRFIGLYFAS-DOMZBBRYSA-N 2 0 329.315 4.201 20 0 EIADRP FC(F)(F)c1ccc(C2CC([NH2+]Cc3ccc4c[nH+]cn4c3)C2)cc1 ZINC000459662678 1046845493 /nfs/dbraw/zinc/84/54/93/1046845493.db2.gz UWSMVGWIHZMCQV-UHFFFAOYSA-N 2 0 345.368 4.389 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](c2ccccc2OC)C2CCCC2)C1 ZINC000536959183 1046870158 /nfs/dbraw/zinc/87/01/58/1046870158.db2.gz KUXJAFHGOMGCCV-DYESRHJHSA-N 2 0 330.516 4.248 20 0 EIADRP Cc1cccc(O[C@H]2CCCC[C@H]2[NH2+]C2CC[NH+](CC3CC3)CC2)c1 ZINC000537095020 1046945073 /nfs/dbraw/zinc/94/50/73/1046945073.db2.gz GRGOZWXPHOGJSD-YADHBBJMSA-N 2 0 342.527 4.149 20 0 EIADRP Cc1nccn1CCCC[NH2+][C@@H](COc1ccccc1)c1ccccc1 ZINC000537116025 1046964135 /nfs/dbraw/zinc/96/41/35/1046964135.db2.gz DOGUHPFWWKSYNQ-QFIPXVFZSA-N 2 0 349.478 4.382 20 0 EIADRP COc1ccccc1CC1([NH3+])CC[NH+]([C@H](C)CCCC(C)C)CC1 ZINC001170071689 1046973672 /nfs/dbraw/zinc/97/36/72/1046973672.db2.gz SGEPUSXLRQQRJE-GOSISDBHSA-N 2 0 332.532 4.246 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000537304174 1047084343 /nfs/dbraw/zinc/08/43/43/1047084343.db2.gz ONCJFIBCMAMQBO-NRFANRHFSA-N 2 0 342.433 4.100 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000497839061 1047115625 /nfs/dbraw/zinc/11/56/25/1047115625.db2.gz FTLPMRFFWXGHGJ-LAUBAEHRSA-N 2 0 330.491 4.472 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCc3nc(Cl)ccc32)c1 ZINC000806131012 1047155589 /nfs/dbraw/zinc/15/55/89/1047155589.db2.gz GJCXVVCPACYAER-SFHVURJKSA-N 2 0 343.902 4.354 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CCO1 ZINC000537406723 1047200246 /nfs/dbraw/zinc/20/02/46/1047200246.db2.gz IAAGTFBSTJYNCM-PDGJWGCVSA-N 2 0 344.543 4.080 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCc2ccc(Cl)nc21 ZINC000788502880 1047207848 /nfs/dbraw/zinc/20/78/48/1047207848.db2.gz AVUWSXISLUZARS-GOSISDBHSA-N 2 0 343.902 4.354 20 0 EIADRP Clc1ccc2c(n1)[C@H]([NH2+]CCCCCCC[NH+]1CCCC1)CC2 ZINC000788594123 1047240362 /nfs/dbraw/zinc/24/03/62/1047240362.db2.gz LPEDWBNPQJYHEI-QGZVFWFLSA-N 2 0 335.923 4.358 20 0 EIADRP C(CCC[NH2+][C@@H]1CCCC[C@H]1[C@H]1CCOC1)CCC[NH+]1CCCC1 ZINC000788988566 1047342924 /nfs/dbraw/zinc/34/29/24/1047342924.db2.gz SAOZNISVIULIRL-PCCBWWKXSA-N 2 0 336.564 4.218 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)C[C@H](C)O1 ZINC000556155044 1047499124 /nfs/dbraw/zinc/49/91/24/1047499124.db2.gz QLBQZJBMKKFWHH-LXGFNABISA-N 2 0 330.516 4.107 20 0 EIADRP C[C@H]([NH2+][C@H]1CCN(C2CC2)[C@@H](c2ccccc2)C1)c1cncs1 ZINC000897931037 1047501795 /nfs/dbraw/zinc/50/17/95/1047501795.db2.gz VABOCWNQNJKYNJ-QILLFSRXSA-N 2 0 327.497 4.162 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)C1CCOCC1 ZINC000129873107 1047521117 /nfs/dbraw/zinc/52/11/17/1047521117.db2.gz AHDQUUPDXITJRV-SFHVURJKSA-N 2 0 344.543 4.356 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)C1CC1 ZINC000556177616 1047540128 /nfs/dbraw/zinc/54/01/28/1047540128.db2.gz DZJIEXWOOOMPFB-HXUWFJFHSA-N 2 0 332.919 4.125 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1cccc(OCC[NH+](C)C)c1 ZINC000556240702 1047606018 /nfs/dbraw/zinc/60/60/18/1047606018.db2.gz YYNADXLTBNJJOK-XJABCFGWSA-N 2 0 338.495 4.081 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H](c3ccncc3)C3CC3)CC2)C1 ZINC000898322243 1047613704 /nfs/dbraw/zinc/61/37/04/1047613704.db2.gz IGTZEOQTCPNHHE-TYCQWZJGSA-N 2 0 327.516 4.165 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC000556260183 1047632715 /nfs/dbraw/zinc/63/27/15/1047632715.db2.gz KORQZFRFUVFYEZ-VIQWUECVSA-N 2 0 336.470 4.455 20 0 EIADRP C[NH+](C)C1CCC([NH2+]CCSCc2ccccc2Cl)CC1 ZINC001168297512 1047676073 /nfs/dbraw/zinc/67/60/73/1047676073.db2.gz AEPMJYQCJYMOBS-UHFFFAOYSA-N 2 0 326.937 4.036 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@]2(c3ccccc3Cl)CCCCC2=O)CC1 ZINC001168300329 1047712355 /nfs/dbraw/zinc/71/23/55/1047712355.db2.gz UJXSFQJNAZCFDL-PMTKGXAQSA-N 2 0 348.918 4.141 20 0 EIADRP Cc1ccccc1[C@@H](O)C[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000763435123 1047792074 /nfs/dbraw/zinc/79/20/74/1047792074.db2.gz ZJBLMAGGRXMRJD-UGKGYDQZSA-N 2 0 344.543 4.005 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1 ZINC000556589269 1047830288 /nfs/dbraw/zinc/83/02/88/1047830288.db2.gz RJBPYXRDYQOIQS-KNXBSLHKSA-N 2 0 338.495 4.039 20 0 EIADRP COc1ncc([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1Cl ZINC000556591828 1047835703 /nfs/dbraw/zinc/83/57/03/1047835703.db2.gz NEAROMYZHHBQKU-CABCVRRESA-N 2 0 339.911 4.049 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000131271419 1047852087 /nfs/dbraw/zinc/85/20/87/1047852087.db2.gz ZGFFCWDEUZLLAV-JKSUJKDBSA-N 2 0 345.531 4.077 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171063620 1047911438 /nfs/dbraw/zinc/91/14/38/1047911438.db2.gz NBOYKXWLAUAYCU-MRXNPFEDSA-N 2 0 341.326 4.172 20 0 EIADRP C[NH+](C)CCC(C)(C)[NH2+][C@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171066485 1047946609 /nfs/dbraw/zinc/94/66/09/1047946609.db2.gz OAEHFUWYYBXDFN-AWEZNQCLSA-N 2 0 329.315 4.171 20 0 EIADRP C[NH+](C)[C@H]1CC[C@H]([NH2+][C@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171071822 1047983251 /nfs/dbraw/zinc/98/32/51/1047983251.db2.gz GCPPFZDAVBWWOB-JYJNAYRXSA-N 2 0 341.326 4.313 20 0 EIADRP Cc1ccc2c(C[NH+]3CCCC[C@H]3C[C@@H]3CCC[N@H+]3C)c[nH]c2c1 ZINC001136974962 1048005558 /nfs/dbraw/zinc/00/55/58/1048005558.db2.gz UODJLYRFOATTPF-OALUTQOASA-N 2 0 325.500 4.315 20 0 EIADRP [NH3+]CCC1CCC([NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171074125 1048037547 /nfs/dbraw/zinc/03/75/47/1048037547.db2.gz ZJEKCVNFSLCHDU-VDSRIPIWSA-N 2 0 341.326 4.348 20 0 EIADRP C[N@@H+](Cc1cncc(Cl)c1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001136996420 1048048361 /nfs/dbraw/zinc/04/83/61/1048048361.db2.gz HQIWNUOFMUMHMH-UHFFFAOYSA-N 2 0 343.902 4.079 20 0 EIADRP CC[NH+]1CCC(CC2CC[NH+](Cc3cncc(Cl)c3)CC2)CC1 ZINC001136997639 1048049742 /nfs/dbraw/zinc/04/97/42/1048049742.db2.gz IHYOPEWGKNVVJX-UHFFFAOYSA-N 2 0 335.923 4.069 20 0 EIADRP CC1(C)[C@@H]2C[C@H]([NH+]3CCC4(CC[N@H+](Cc5cccs5)C4)CC3)C[C@@H]21 ZINC001170751432 1048057200 /nfs/dbraw/zinc/05/72/00/1048057200.db2.gz DMCRUDZQDWSGTP-GGPHIMKMSA-N 2 0 344.568 4.471 20 0 EIADRP C[N@H+](Cc1ccco1)[C@H]1CCC12CC[NH+]([C@H]1C[C@@H]3[C@H](C1)C3(C)C)CC2 ZINC001170752380 1048065326 /nfs/dbraw/zinc/06/53/26/1048065326.db2.gz IMINEGUHDLPFIH-RNQOJCNYSA-N 2 0 342.527 4.391 20 0 EIADRP [NH3+]C1(c2ccccc2)CC[NH+]([C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171110270 1048221867 /nfs/dbraw/zinc/22/18/67/1048221867.db2.gz BTIBMCQCWJKIBD-FQEVSTJZSA-N 2 0 340.898 4.147 20 0 EIADRP CCC(CC)[NH+]1CCC([NH2+][C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171113058 1048249758 /nfs/dbraw/zinc/24/97/58/1048249758.db2.gz ZKCBHWKJZVSIDO-IBGZPJMESA-N 2 0 334.935 4.440 20 0 EIADRP CC(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cc(Cl)ccc2C1 ZINC001171113684 1048251526 /nfs/dbraw/zinc/25/15/26/1048251526.db2.gz VAQRJGBVGCJNMK-VAMGGRTRSA-N 2 0 334.935 4.425 20 0 EIADRP C(=C\c1ccccc1)\C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499136339 1048330163 /nfs/dbraw/zinc/33/01/63/1048330163.db2.gz QMSQLGKQPZZYMG-ZMZCSGRZSA-N 2 0 332.491 4.485 20 0 EIADRP c1csc(-c2nc(C[NH2+]CCCCC[NH+]3CCCC3)cs2)c1 ZINC000557038250 1048425666 /nfs/dbraw/zinc/42/56/66/1048425666.db2.gz HQOBUPWZELGWAU-UHFFFAOYSA-N 2 0 335.542 4.227 20 0 EIADRP Clc1cc2c(cc1Cl)C[C@@H]([NH2+]CCCC[NH+]1CCCC1)CC2 ZINC001171139685 1048427751 /nfs/dbraw/zinc/42/77/51/1048427751.db2.gz POCQOYNCSIXSGM-INIZCTEOSA-N 2 0 341.326 4.316 20 0 EIADRP Cc1ccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499219593 1048430898 /nfs/dbraw/zinc/43/08/98/1048430898.db2.gz QTHXSNCNKODMHD-WBDAEOGXSA-N 2 0 334.507 4.323 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CC2Cc4ccccc4C2)C3)cc1 ZINC000499224972 1048455972 /nfs/dbraw/zinc/45/59/72/1048455972.db2.gz YVOUHUFZVLWVOZ-BKFWDETESA-N 2 0 346.518 4.187 20 0 EIADRP [NH3+]CCC1CCC([NH2+][C@@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171146262 1048457132 /nfs/dbraw/zinc/45/71/32/1048457132.db2.gz ALOHRMATWQFZRW-VDSRIPIWSA-N 2 0 341.326 4.348 20 0 EIADRP CCCCc1ccc([C@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1 ZINC000132796951 1048498681 /nfs/dbraw/zinc/49/86/81/1048498681.db2.gz MAFKPMIZKIMRNM-ICSRJNTNSA-N 2 0 344.543 4.181 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+][C@@H]3CCCOCC3)[C@@H](C)C2)CC[C@H]1[NH3+] ZINC001170793289 1048520541 /nfs/dbraw/zinc/52/05/41/1048520541.db2.gz XZMUMOWOUKDTHA-FGKHCZQVSA-N 2 0 336.564 4.104 20 0 EIADRP c1ccc([C@H]([NH2+]CCCCC[NH+]2CCCC2)C2CCOCC2)cc1 ZINC000815646791 1048569422 /nfs/dbraw/zinc/56/94/22/1048569422.db2.gz SCTRXDNGNAPXFR-NRFANRHFSA-N 2 0 330.516 4.010 20 0 EIADRP CC[N@H+](C1CCN(C)CC1)[C@@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171160513 1048594445 /nfs/dbraw/zinc/59/44/45/1048594445.db2.gz BUBBKHXZQIIIBM-MRXNPFEDSA-N 2 0 341.326 4.267 20 0 EIADRP CC[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(OC)c(C[NH+](CC)CC)c2)CCO1 ZINC000817586689 1049018632 /nfs/dbraw/zinc/01/86/32/1049018632.db2.gz QCCWXQRRBTVELF-NSISKUIASA-N 2 0 348.531 4.145 20 0 EIADRP Cc1ccc(C)c([C@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000817894614 1049054266 /nfs/dbraw/zinc/05/42/66/1049054266.db2.gz NLLVCODARRYFIL-RBDMOPTHSA-N 2 0 336.479 4.210 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccc(Br)cc1 ZINC000817946626 1049061272 /nfs/dbraw/zinc/06/12/72/1049061272.db2.gz BQKMSOHCZAEBCV-GOSISDBHSA-N 2 0 347.300 4.191 20 0 EIADRP Clc1ccc(OCCCCCC[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000817925615 1049062019 /nfs/dbraw/zinc/06/20/19/1049062019.db2.gz ZYUOVDKTVXYKEJ-JWTNVVGKSA-N 2 0 336.907 4.152 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)[C@H](C)c1nc2ccccc2s1 ZINC000817949544 1049063627 /nfs/dbraw/zinc/06/36/27/1049063627.db2.gz RAWABMYBUQWWNN-GJZGRUSLSA-N 2 0 339.508 4.079 20 0 EIADRP COc1c(C)cc([C@H](C)[NH2+]Cc2ccc(CC[NH3+])cc2)cc1Cl ZINC000817948801 1049065329 /nfs/dbraw/zinc/06/53/29/1049065329.db2.gz LNYQRFVBFVOJRG-AWEZNQCLSA-N 2 0 332.875 4.009 20 0 EIADRP Cc1c([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cnn1-c1ccccc1 ZINC000817981780 1049076579 /nfs/dbraw/zinc/07/65/79/1049076579.db2.gz NPORQOQAJFWIML-VGOFRKELSA-N 2 0 348.494 4.312 20 0 EIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cnn(-c2ccccc2)c1 ZINC000817982286 1049077530 /nfs/dbraw/zinc/07/75/30/1049077530.db2.gz QWRZERFNXDURNX-UTKZUKDTSA-N 2 0 334.467 4.003 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H]2CCc3cccc(Cl)c3C2)c1 ZINC001170894933 1049139211 /nfs/dbraw/zinc/13/92/11/1049139211.db2.gz BMCXCOZBVWKDDR-SFHVURJKSA-N 2 0 328.887 4.049 20 0 EIADRP CC(C)C[NH+]1CCC(C[NH2+][C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170910654 1049181949 /nfs/dbraw/zinc/18/19/49/1049181949.db2.gz MDKXGKXIKJERLO-GOSISDBHSA-N 2 0 334.935 4.155 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCCNc3ccccc32)CC1 ZINC000348094077 1049423611 /nfs/dbraw/zinc/42/36/11/1049423611.db2.gz FFDDOOAFNCSDOV-OAQYLSRUSA-N 2 0 329.532 4.281 20 0 EIADRP CC(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2c(F)cc(F)cc2C1 ZINC001171357027 1049510562 /nfs/dbraw/zinc/51/05/62/1049510562.db2.gz GEMIGECWVKKYID-KZNAEPCWSA-N 2 0 336.470 4.050 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@H]2CCc3c(F)cc(F)cc3C2)CC1 ZINC001171359582 1049510713 /nfs/dbraw/zinc/51/07/13/1049510713.db2.gz FCVAHWPHBHCKKD-OKZBNKHCSA-N 2 0 336.470 4.065 20 0 EIADRP C[C@H](C[C@@H](O)c1ccc(F)cc1)[NH2+][C@@H](C)c1cccc(C[NH+](C)C)c1 ZINC000820814878 1049556707 /nfs/dbraw/zinc/55/67/07/1049556707.db2.gz NVZYKBIDAKEEHV-VWKPWSFCSA-N 2 0 344.474 4.050 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1cccc(C[NH+](C)C)c1 ZINC000820823170 1049558378 /nfs/dbraw/zinc/55/83/78/1049558378.db2.gz LZRMGYLOEKIMBY-FXAWDEMLSA-N 2 0 330.516 4.281 20 0 EIADRP CCC1(C[NH2+][C@@H](C)C[C@@H]2CCOC2)CC[NH+](Cc2ccccc2)CC1 ZINC000773105039 1049583836 /nfs/dbraw/zinc/58/38/36/1049583836.db2.gz HHJNZRJZMNZCKT-FPOVZHCZSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H]3CCc4ccccc4OC3)CC2)C1 ZINC000511008213 1049620603 /nfs/dbraw/zinc/62/06/03/1049620603.db2.gz AGORKKOLRAOQTB-QMMLZNLJSA-N 2 0 342.527 4.013 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)[C@H]2CCc3cccc(F)c3C2)CC1 ZINC001170968046 1049658978 /nfs/dbraw/zinc/65/89/78/1049658978.db2.gz BDNSHDTWTGEAAV-UFYCRDLUSA-N 2 0 344.518 4.445 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1OC ZINC000245419589 1049714388 /nfs/dbraw/zinc/71/43/88/1049714388.db2.gz BQCANOFDKOKIMO-IAGOWNOFSA-N 2 0 334.504 4.009 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H]1CCc2cc(F)c(F)c(F)c2C1 ZINC001171505597 1049739410 /nfs/dbraw/zinc/73/94/10/1049739410.db2.gz KHDFLCBSIDPHLF-HIFRSBDPSA-N 2 0 342.449 4.061 20 0 EIADRP Cc1cccc2c1CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC001171551553 1049754225 /nfs/dbraw/zinc/75/42/25/1049754225.db2.gz QEMPQVNZFGECDU-FYYLOGMGSA-N 2 0 348.534 4.354 20 0 EIADRP CSc1ccccc1OCC[NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171625705 1049767833 /nfs/dbraw/zinc/76/78/33/1049767833.db2.gz MTOYEMBSXWZXDU-UHFFFAOYSA-N 2 0 336.545 4.028 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc3c(c2)CC(C)(C)O3)CC1(C)C ZINC001171623382 1049768316 /nfs/dbraw/zinc/76/83/16/1049768316.db2.gz WLKYYLLCRYGVKP-UHFFFAOYSA-N 2 0 330.516 4.141 20 0 EIADRP COc1ccc(CC(C)(C)[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1 ZINC001171627020 1049769922 /nfs/dbraw/zinc/76/99/22/1049769922.db2.gz IZQOZLNTPTVPNI-UHFFFAOYSA-N 2 0 332.532 4.257 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH2+]CC2CC[NH+](CC3CCC3)CC2)cc1 ZINC001171666915 1049773074 /nfs/dbraw/zinc/77/30/74/1049773074.db2.gz SAPNSTYOXSIYHP-IBGZPJMESA-N 2 0 328.544 4.418 20 0 EIADRP COc1cccc([C@H]2CC[N@@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)C2)c1 ZINC001171641329 1049778960 /nfs/dbraw/zinc/77/89/60/1049778960.db2.gz OVMQNEQJSJFDNV-KRWDZBQOSA-N 2 0 330.516 4.136 20 0 EIADRP C[NH+]1C(C)(C)CC(n2c3ccc(F)cc3c3c2C[NH2+]CC3)CC1(C)C ZINC001171641003 1049779191 /nfs/dbraw/zinc/77/91/91/1049779191.db2.gz LRTQULCUEMKQPY-UHFFFAOYSA-N 2 0 343.490 4.250 20 0 EIADRP C[C@@H]([NH3+])Cc1cn([C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171733306 1049787223 /nfs/dbraw/zinc/78/72/23/1049787223.db2.gz QEARQCZLYKTWFO-LQWHRVPQSA-N 2 0 347.506 4.367 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CCc2cccs2)CC[N@@H+]1Cc1ccccc1 ZINC001171963625 1049825514 /nfs/dbraw/zinc/82/55/14/1049825514.db2.gz IICPWFNMWWCHSN-SFHVURJKSA-N 2 0 328.525 4.323 20 0 EIADRP COc1cccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)c1 ZINC001171962425 1049825624 /nfs/dbraw/zinc/82/56/24/1049825624.db2.gz CYOVIGXDNZBAFR-FQEVSTJZSA-N 2 0 338.495 4.228 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCC1CC[NH+](C)CC1 ZINC001171964987 1049826397 /nfs/dbraw/zinc/82/63/97/1049826397.db2.gz PJLDODMBABGDOK-HNNXBMFYSA-N 2 0 342.449 4.348 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[N@@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001171966409 1049826927 /nfs/dbraw/zinc/82/69/27/1049826927.db2.gz VBEFQJBELLSBHQ-NVXWUHKLSA-N 2 0 342.449 4.477 20 0 EIADRP C[C@H](NC1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccnc1 ZINC000813881834 1049830656 /nfs/dbraw/zinc/83/06/56/1049830656.db2.gz VTHZOJRCJNEBRA-IRFPFTSISA-N 2 0 335.495 4.318 20 0 EIADRP CC1(C)C[C@H]([NH+]2CCC[C@H](C(F)F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171988796 1049832207 /nfs/dbraw/zinc/83/22/07/1049832207.db2.gz VRFUJMDJBBDNMD-ZWKOTPCHSA-N 2 0 336.470 4.407 20 0 EIADRP CCN(Cc1ccncc1)[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171977619 1049836744 /nfs/dbraw/zinc/83/67/44/1049836744.db2.gz SHISKEFPNWJLNH-OAQYLSRUSA-N 2 0 337.511 4.347 20 0 EIADRP CC1(C)C[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C(C)(C)O1 ZINC000245720024 1049838628 /nfs/dbraw/zinc/83/86/28/1049838628.db2.gz OOQTYJZGAFMGEI-IYWMVGAKSA-N 2 0 342.527 4.118 20 0 EIADRP Cc1cccc(C(=[NH2+])N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172077735 1049846347 /nfs/dbraw/zinc/84/63/47/1049846347.db2.gz VVLVNVBRLOIYFQ-KOUNCHBCSA-N 2 0 347.506 4.496 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2CCc3c(Cl)cccc3C2)cc1 ZINC001171017806 1049846447 /nfs/dbraw/zinc/84/64/47/1049846447.db2.gz LKGBOHPKNHXGQJ-SFHVURJKSA-N 2 0 328.887 4.049 20 0 EIADRP Cc1cccc(C(=[NH2+])N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172077734 1049846796 /nfs/dbraw/zinc/84/67/96/1049846796.db2.gz VVLVNVBRLOIYFQ-DKUWSORSSA-N 2 0 347.506 4.496 20 0 EIADRP CC(C)O[C@H]1CC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172082430 1049847287 /nfs/dbraw/zinc/84/72/87/1049847287.db2.gz JWBQXKNRWMHQCY-CBPXPLCBSA-N 2 0 342.527 4.071 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H](N2CCc4cccnc4C2)C3)cc1 ZINC001172081924 1049847658 /nfs/dbraw/zinc/84/76/58/1049847658.db2.gz IGKDWSOKAXALES-ZBYYUNFXSA-N 2 0 347.506 4.025 20 0 EIADRP CC(C)(C)OCCC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172067891 1049851020 /nfs/dbraw/zinc/85/10/20/1049851020.db2.gz HPBDIYFXNXGZDA-MZADTFQBSA-N 2 0 344.543 4.367 20 0 EIADRP C[C@@H]1CCN([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C[C@H]1F ZINC001172067547 1049851413 /nfs/dbraw/zinc/85/14/13/1049851413.db2.gz CVYQMUQQDIDUCZ-BVJIBDCISA-N 2 0 330.491 4.252 20 0 EIADRP F[C@@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172066825 1049851731 /nfs/dbraw/zinc/85/17/31/1049851731.db2.gz KJYDCJVWQXLQOM-ONUIULTDSA-N 2 0 330.491 4.442 20 0 EIADRP F[C@H]1CC[C@@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172069821 1049852960 /nfs/dbraw/zinc/85/29/60/1049852960.db2.gz XVPIOUWFWIHORO-UZFIKNKDSA-N 2 0 330.491 4.442 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](n1c3ccccc3nc1[C@H]1CCCC[NH2+]1)C2 ZINC001172127731 1049853820 /nfs/dbraw/zinc/85/38/20/1049853820.db2.gz LFFHMQPUOPSZTD-SFNKJDCFSA-N 2 0 338.499 4.039 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC1c3ccccc3-c3ccccc31)C2 ZINC001172112054 1049858329 /nfs/dbraw/zinc/85/83/29/1049858329.db2.gz ZUUZKOADQZRZLS-NNZMDNLPSA-N 2 0 332.491 4.404 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1CSc2ccccc2C1 ZINC001172206331 1049864356 /nfs/dbraw/zinc/86/43/56/1049864356.db2.gz ONPOOHUOZSJKIU-IPMKNSEASA-N 2 0 330.541 4.042 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171022836 1049865888 /nfs/dbraw/zinc/86/58/88/1049865888.db2.gz QHVQDLHSGPDJCW-LXPRWKDFSA-N 2 0 334.935 4.440 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171022835 1049866116 /nfs/dbraw/zinc/86/61/16/1049866116.db2.gz QHVQDLHSGPDJCW-ADKAHSJRSA-N 2 0 334.935 4.440 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H](CC2CCC2)c2ccc(F)cc2)CC1 ZINC001172248842 1049871933 /nfs/dbraw/zinc/87/19/33/1049871933.db2.gz QDIQQMDHZOQXAE-NRFANRHFSA-N 2 0 348.506 4.148 20 0 EIADRP Clc1cccc2c1CC[C@H]([NH2+]CC1CC[NH+](C3CCC3)CC1)C2 ZINC001171031224 1049876257 /nfs/dbraw/zinc/87/62/57/1049876257.db2.gz UCEGSOANAHVMJD-KRWDZBQOSA-N 2 0 332.919 4.051 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)c1ccccn1 ZINC000246068733 1049901455 /nfs/dbraw/zinc/90/14/55/1049901455.db2.gz ZDBXKPMCAWAMNK-GUDVDZBRSA-N 2 0 337.511 4.410 20 0 EIADRP CC(C)OCC[C@H](C)[NH2+]CCC1CC[NH+](Cc2ccccc2)CC1 ZINC001172430381 1049902190 /nfs/dbraw/zinc/90/21/90/1049902190.db2.gz FROQUTSYGVCGFY-IBGZPJMESA-N 2 0 332.532 4.082 20 0 EIADRP CC[N@H+](Cc1ccccc1)C1CC[NH+]([C@H](C)CCOCC(C)C)CC1 ZINC001172467484 1049919866 /nfs/dbraw/zinc/91/98/66/1049919866.db2.gz GXIJKOSJVFWSGZ-HXUWFJFHSA-N 2 0 346.559 4.424 20 0 EIADRP CC[N@H+](Cc1ccccc1)C1CC[NH+]([C@@H](C)CCOCC(C)C)CC1 ZINC001172467483 1049920038 /nfs/dbraw/zinc/92/00/38/1049920038.db2.gz GXIJKOSJVFWSGZ-FQEVSTJZSA-N 2 0 346.559 4.424 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccncc2)[C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172555415 1049930976 /nfs/dbraw/zinc/93/09/76/1049930976.db2.gz ICGRZNQMERYDGF-SSGKUCQKSA-N 2 0 349.522 4.490 20 0 EIADRP FC1CC[NH+](C2CC[NH+]([C@H]3CC[C@@H](c4ccccc4)C3)CC2)CC1 ZINC001172565125 1049936009 /nfs/dbraw/zinc/93/60/09/1049936009.db2.gz RMQVGTWXXGCUSB-NQIIRXRSSA-N 2 0 330.491 4.221 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]C1CCC([NH+](C)C)CC1 ZINC001172575340 1049941947 /nfs/dbraw/zinc/94/19/47/1049941947.db2.gz HHNQRBFTWKGRRX-GRTSSRMGSA-N 2 0 344.877 4.402 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCOCC2)C2CCC3(CCCC3)CC2)CC1 ZINC001172729267 1049969006 /nfs/dbraw/zinc/96/90/06/1049969006.db2.gz UOZLRYQNRDHURM-IYARVYRRSA-N 2 0 334.548 4.240 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccccc1 ZINC000246584632 1049989668 /nfs/dbraw/zinc/98/96/68/1049989668.db2.gz BGJQTYQIEDKSJL-CEXWTWQISA-N 2 0 338.495 4.147 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc2c(c1)OCCCO2 ZINC000246856069 1050002763 /nfs/dbraw/zinc/00/27/63/1050002763.db2.gz CTIPVIOBBJWKRF-ZWKOTPCHSA-N 2 0 346.515 4.011 20 0 EIADRP Cc1cncc([C@@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)c1 ZINC000248754474 1050076105 /nfs/dbraw/zinc/07/61/05/1050076105.db2.gz UWRVKOANJQPJJY-IEBWSBKVSA-N 2 0 337.511 4.473 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)CCO1 ZINC001177213749 1050162458 /nfs/dbraw/zinc/16/24/58/1050162458.db2.gz HBLWHYUJLPDJPY-UWJYYQICSA-N 2 0 338.495 4.072 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([NH2+]CC1CC[NH+](C3CCCCC3)CC1)CC2 ZINC001172837218 1050171736 /nfs/dbraw/zinc/17/17/36/1050171736.db2.gz YZVXFCPOBCPVOV-QFIPXVFZSA-N 2 0 340.555 4.487 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([NH2+]C1CC[NH+](C[C@@H]3CC=CCC3)CC1)CC2 ZINC001172840140 1050179985 /nfs/dbraw/zinc/17/99/85/1050179985.db2.gz ZRTDEOJAJVJMON-XXBNENTESA-N 2 0 338.539 4.263 20 0 EIADRP CCN(CC[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccc1C ZINC001177303378 1050180938 /nfs/dbraw/zinc/18/09/38/1050180938.db2.gz MAOWFNIDEXOUAH-UHFFFAOYSA-N 2 0 343.559 4.208 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)[NH2+]CC1CC[NH+](C2CCC2)CC1 ZINC001172848220 1050185615 /nfs/dbraw/zinc/18/56/15/1050185615.db2.gz QYQAXFUGWYZNAU-AWEZNQCLSA-N 2 0 338.898 4.264 20 0 EIADRP CC(C)C[NH+]1CCC(C[NH2+][C@@H](C)Cc2ccc(F)cc2Cl)CC1 ZINC001172859142 1050196054 /nfs/dbraw/zinc/19/60/54/1050196054.db2.gz ROKJENSXIPVUIV-HNNXBMFYSA-N 2 0 340.914 4.368 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC001172862940 1050201783 /nfs/dbraw/zinc/20/17/83/1050201783.db2.gz KEHVINAEZRQSLH-AWEZNQCLSA-N 2 0 334.866 4.262 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H](C)CSc2ccc(Cl)cc2)CC1 ZINC001172874937 1050214556 /nfs/dbraw/zinc/21/45/56/1050214556.db2.gz JLCCAYVXLOVFOS-CQSZACIVSA-N 2 0 326.937 4.142 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH+]1CCC(C[NH+](C)C)CC1 ZINC001172877679 1050216491 /nfs/dbraw/zinc/21/64/91/1050216491.db2.gz FXLBFQFLVGTBRC-CQSZACIVSA-N 2 0 326.937 4.094 20 0 EIADRP C[C@@H](CSc1ccc(Cl)cc1)[NH+]1CCC(C[NH+](C)C)CC1 ZINC001172877678 1050218308 /nfs/dbraw/zinc/21/83/08/1050218308.db2.gz FXLBFQFLVGTBRC-AWEZNQCLSA-N 2 0 326.937 4.094 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC001172878835 1050219529 /nfs/dbraw/zinc/21/95/29/1050219529.db2.gz VRBHJZKBNZZWEZ-OAHLLOKOSA-N 2 0 347.915 4.038 20 0 EIADRP CCC1(C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)CCOCC1 ZINC001177528532 1050239886 /nfs/dbraw/zinc/23/98/86/1050239886.db2.gz BNPBYXLASGIJOZ-UHFFFAOYSA-N 2 0 344.543 4.359 20 0 EIADRP C[C@H]1CC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)CS1 ZINC001177529959 1050241987 /nfs/dbraw/zinc/24/19/87/1050241987.db2.gz WNSAWGXLMXIYMB-PXNSSMCTSA-N 2 0 332.557 4.436 20 0 EIADRP CCCOC1CCC([NH2+]CC2CC[NH+](C3CCCCC3)CC2)CC1 ZINC001173089053 1050281450 /nfs/dbraw/zinc/28/14/50/1050281450.db2.gz ILPXDXYZFPDDPX-UHFFFAOYSA-N 2 0 336.564 4.359 20 0 EIADRP CC[C@@H]1C[C@@H](C[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)CCO1 ZINC001177743135 1050292414 /nfs/dbraw/zinc/29/24/14/1050292414.db2.gz LRVXUTJKWDYWLV-RBBKRZOGSA-N 2 0 344.543 4.213 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](C)c2ccc(OC)c(OC)c2)CC1 ZINC001173101929 1050301338 /nfs/dbraw/zinc/30/13/38/1050301338.db2.gz POSRPNUQFMCKHL-ZLPCBKJTSA-N 2 0 334.504 4.007 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccc(Br)cc2)CC1 ZINC001173101644 1050302857 /nfs/dbraw/zinc/30/28/57/1050302857.db2.gz MPNNPMFATLIGOO-UHFFFAOYSA-N 2 0 339.321 4.192 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](c2cncc(Cl)c2)C2CC2)CC1 ZINC001173105698 1050304848 /nfs/dbraw/zinc/30/48/48/1050304848.db2.gz BDALSWKJYMXEAS-CTWPCTMYSA-N 2 0 335.923 4.429 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2cccc(OC(F)(F)F)c2)CC1 ZINC001173105792 1050306724 /nfs/dbraw/zinc/30/67/24/1050306724.db2.gz UJHTZWDJONGCEF-UHFFFAOYSA-N 2 0 344.421 4.328 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC001173105910 1050306868 /nfs/dbraw/zinc/30/68/68/1050306868.db2.gz NIUSWDXKARBERY-UHFFFAOYSA-N 3 0 343.559 4.025 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2cc(Br)cs2)CC1 ZINC001173105886 1050308531 /nfs/dbraw/zinc/30/85/31/1050308531.db2.gz NBWYERKRFBGYSU-UHFFFAOYSA-N 2 0 345.350 4.253 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@H](Oc3ccc(C)cc3)C2)CC1 ZINC001173112155 1050310369 /nfs/dbraw/zinc/31/03/69/1050310369.db2.gz RGUOUWLDKZGXCI-AOMIVXANSA-N 2 0 344.543 4.491 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@@H](c3nc(C(C)C)no3)C2)CC1 ZINC001173113035 1050311056 /nfs/dbraw/zinc/31/10/56/1050311056.db2.gz GZTWXZPDJDGMIH-WWDZGPRUSA-N 2 0 348.535 4.025 20 0 EIADRP CC(C)[N@@H+]1CC[C@H]([NH2+]C2CCC(Oc3ccccc3)CC2)[C@H](C)C1 ZINC001173202547 1050345243 /nfs/dbraw/zinc/34/52/43/1050345243.db2.gz UJNSJROBNXYYKF-SDEKRAFDSA-N 2 0 330.516 4.085 20 0 EIADRP CC1([NH+]2CCCC2)CC[NH+](C2CCC(Oc3ccccc3)CC2)CC1 ZINC001173206959 1050365661 /nfs/dbraw/zinc/36/56/61/1050365661.db2.gz WPWZXPKHJMTIBN-UHFFFAOYSA-N 2 0 342.527 4.327 20 0 EIADRP CCc1ccc(C[C@@H](C)[NH+]2CCC([NH3+])(c3ccc(F)cc3)CC2)cc1 ZINC001173249145 1050375916 /nfs/dbraw/zinc/37/59/16/1050375916.db2.gz JWHAQEFSXRWDFZ-QGZVFWFLSA-N 2 0 340.486 4.269 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2cccc(F)c2F)C[N@@H+]1Cc1ccccc1 ZINC001178208289 1050403100 /nfs/dbraw/zinc/40/31/00/1050403100.db2.gz KYQLEIDDVKHLAH-SJLPKXTDSA-N 2 0 344.449 4.355 20 0 EIADRP C[C@H]1C[C@H](CC[NH2+][C@H]2CC[C@@H](C)SC2)C[N@@H+]1Cc1ccccc1 ZINC001178207159 1050403842 /nfs/dbraw/zinc/40/38/42/1050403842.db2.gz APOXJDJCPXDXKK-HNJRGHQBSA-N 2 0 332.557 4.161 20 0 EIADRP C1CCC2(CC1)CCC[C@H]([NH2+][C@H]1CC[C@H]([NH+]3CCOCC3)CC1)C2 ZINC001173342829 1050432137 /nfs/dbraw/zinc/43/21/37/1050432137.db2.gz FLQQQUXVDDLVKU-UFYCRDLUSA-N 2 0 334.548 4.113 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2c1CCC2)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001178331333 1050437400 /nfs/dbraw/zinc/43/74/00/1050437400.db2.gz QCNMOXNMEMRELY-GCJKJVERSA-N 2 0 334.507 4.176 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cc(Br)cs2)C1 ZINC000253355223 1050455125 /nfs/dbraw/zinc/45/51/25/1050455125.db2.gz FBVDPBPAPAFXNI-OLZOCXBDSA-N 2 0 345.350 4.282 20 0 EIADRP CSCc1ccc(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC001178458102 1050475600 /nfs/dbraw/zinc/47/56/00/1050475600.db2.gz PTDPNSDNBIBCTM-LPHOPBHVSA-N 2 0 332.557 4.292 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@H]1C[C@H]2CC[N@H+](C1)[C@H]2C ZINC001173545880 1050477912 /nfs/dbraw/zinc/47/79/12/1050477912.db2.gz BNYALNXTLBIJLA-CLWVCHIJSA-N 2 0 341.326 4.387 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001173548490 1050485826 /nfs/dbraw/zinc/48/58/26/1050485826.db2.gz CGMKKNLJRZBNCQ-KDOFPFPSSA-N 2 0 341.326 4.342 20 0 EIADRP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001173549694 1050485894 /nfs/dbraw/zinc/48/58/94/1050485894.db2.gz IFRAEYXVJVMOGN-JCKWVBRZSA-N 2 0 341.326 4.198 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@H]2CCCN(C)[C@H]2C1 ZINC001173551666 1050489125 /nfs/dbraw/zinc/48/91/25/1050489125.db2.gz UQGOASXYAXMGKB-SIIHOXLZSA-N 2 0 341.326 4.341 20 0 EIADRP Cc1cc(C[NH2+]CC(C)(C)C[NH+]2CCCC2)cc(C)c1OC(F)F ZINC001178614423 1050517496 /nfs/dbraw/zinc/51/74/96/1050517496.db2.gz MQBFRHGVIXOGOE-UHFFFAOYSA-N 2 0 340.458 4.116 20 0 EIADRP Cc1cc(C[N@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)ccc1Oc1ccccc1 ZINC001206209688 1050535759 /nfs/dbraw/zinc/53/57/59/1050535759.db2.gz IBHJEAWSWLQLRE-MOPGFXCFSA-N 2 0 328.431 4.049 20 0 EIADRP C[N@@H+]1CCC[C@@H](CC[NH2+]C2CCC3(CCc4ccccc43)CC2)C1 ZINC001173687807 1050540237 /nfs/dbraw/zinc/54/02/37/1050540237.db2.gz TZKDMTVMDFLNQY-NLMOZGTASA-N 2 0 326.528 4.135 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)C1 ZINC001179040353 1050612517 /nfs/dbraw/zinc/61/25/17/1050612517.db2.gz WKLQZXXOCKKZBS-RHNCMZPLSA-N 2 0 346.421 4.187 20 0 EIADRP CC[C@@H]1C[C@H](C[NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC001179277886 1050669153 /nfs/dbraw/zinc/66/91/53/1050669153.db2.gz OZQRCNBBARYZPF-FGZHOGPDSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@H]1CC[C@H]([NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CS1 ZINC001179278753 1050670574 /nfs/dbraw/zinc/67/05/74/1050670574.db2.gz ZFEDYXIRDIDVRZ-PXNSSMCTSA-N 2 0 332.557 4.162 20 0 EIADRP Cc1oc2ccccc2c1C[NH2+]CC1(c2ccccc2)CC[NH+](C)CC1 ZINC001179369538 1050683714 /nfs/dbraw/zinc/68/37/14/1050683714.db2.gz HIDXIWPFKFUUBA-UHFFFAOYSA-N 2 0 348.490 4.494 20 0 EIADRP Cc1ccc(-c2ncc(C[NH+]3CCC(C[NH+]4CCCC4)CC3)s2)o1 ZINC000152690227 1050829426 /nfs/dbraw/zinc/82/94/26/1050829426.db2.gz IYYGVSWYOMNQDF-UHFFFAOYSA-N 2 0 345.512 4.019 20 0 EIADRP C[C@@H]([NH2+]CCc1cn2c(n1)CCCC2)c1ccc(Cl)c(Cl)c1 ZINC000152754499 1050842755 /nfs/dbraw/zinc/84/27/55/1050842755.db2.gz MFIAXIWZGBYNQN-GFCCVEGCSA-N 2 0 338.282 4.420 20 0 EIADRP COc1cc2ccccc2cc1CN(C)CC[C@@H]1CCCC[N@@H+]1C ZINC001180099201 1050886913 /nfs/dbraw/zinc/88/69/13/1050886913.db2.gz WRFHEBVRDRMRPB-FQEVSTJZSA-N 2 0 326.484 4.155 20 0 EIADRP Cc1cccc(NC2CC[NH+](Cc3ccc(-n4ccnc4)cc3)CC2)c1 ZINC000152974864 1050916477 /nfs/dbraw/zinc/91/64/77/1050916477.db2.gz OKTCNRMDNXPSSI-UHFFFAOYSA-N 2 0 346.478 4.257 20 0 EIADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC001180302565 1050945500 /nfs/dbraw/zinc/94/55/00/1050945500.db2.gz ZLYNMXDPUBINFN-BRKWEVRTSA-N 2 0 326.528 4.455 20 0 EIADRP C[C@@H](C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C)[NH+]1CCCC1 ZINC001180586672 1051044323 /nfs/dbraw/zinc/04/43/23/1051044323.db2.gz UBNQVICVJOBINU-HNNXBMFYSA-N 2 0 328.481 4.056 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]CC1(C[NH+](C)C)CCCC1)CC3 ZINC001180673286 1051052142 /nfs/dbraw/zinc/05/21/42/1051052142.db2.gz MJLHOQAOVAFUIL-QGZVFWFLSA-N 2 0 339.527 4.045 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCc2ccco2)cc1C[NH+]1CCCCC1 ZINC000775367154 1051136810 /nfs/dbraw/zinc/13/68/10/1051136810.db2.gz WQWLIHCANQXWAW-KRWDZBQOSA-N 2 0 342.483 4.167 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@@H]1CCCc2cc(SC(F)F)ccc21 ZINC000775382355 1051175200 /nfs/dbraw/zinc/17/52/00/1051175200.db2.gz NWIZBATVOKYOLZ-MRXNPFEDSA-N 2 0 328.472 4.310 20 0 EIADRP C[C@@H](CCOCc1ccccc1)[NH2+]C[C@H]1CCC[N@@H+]1C1CCCCC1 ZINC001181276819 1051195937 /nfs/dbraw/zinc/19/59/37/1051195937.db2.gz RQKBHDJMIWVGDA-SIKLNZKXSA-N 2 0 344.543 4.369 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CC(C)(C)SC)ccc1OC ZINC000775398217 1051230578 /nfs/dbraw/zinc/23/05/78/1051230578.db2.gz XZXAXSMOOXQRTD-HNNXBMFYSA-N 2 0 338.561 4.329 20 0 EIADRP CCN(CCC[NH+](CC)CC)Cc1ccc2ccc(F)c(F)c2n1 ZINC001181506259 1051241828 /nfs/dbraw/zinc/24/18/28/1051241828.db2.gz ODCMMBAHTJDWNT-UHFFFAOYSA-N 2 0 335.442 4.067 20 0 EIADRP CCCC[N@H+](C[C@H](O)c1ccccc1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001174984961 1051304856 /nfs/dbraw/zinc/30/48/56/1051304856.db2.gz ULLHVZLUGLABHI-IBGZPJMESA-N 2 0 332.532 4.131 20 0 EIADRP CCC[NH+]1CCC([NH2+]Cc2ccc(N(C)c3ccccc3)cc2)CC1 ZINC000620878595 1051402196 /nfs/dbraw/zinc/40/21/96/1051402196.db2.gz WXPMEFMQHNNYKM-UHFFFAOYSA-N 2 0 337.511 4.419 20 0 EIADRP Cc1ccc(CCC[NH2+]C2CCN(Cc3ccccc3)CC2)c(C)c1 ZINC000620879553 1051412227 /nfs/dbraw/zinc/41/22/27/1051412227.db2.gz RAWBHXZUAPZANN-UHFFFAOYSA-N 2 0 336.523 4.490 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+](C[C@@H]1CC[C@@H](c3ccccc3)C1)CC2 ZINC001175211554 1051444215 /nfs/dbraw/zinc/44/42/15/1051444215.db2.gz SMIPUIQOIHTNMT-TZIWHRDSSA-N 2 0 326.528 4.378 20 0 EIADRP C[C@H](CC[NH2+][C@H]1CC[N@H+](C)C[C@@H]1C)c1cccc(C(F)(F)F)c1 ZINC000155868417 1051469361 /nfs/dbraw/zinc/46/93/61/1051469361.db2.gz KTWOGAWJMHEAIV-KEYYUXOJSA-N 2 0 328.422 4.129 20 0 EIADRP COc1ccc(C2CCC([NH2+]CCN3CCCC3(C)C)CC2)cc1 ZINC001182310279 1051489119 /nfs/dbraw/zinc/48/91/19/1051489119.db2.gz WDZLGTLYVUJAHE-UHFFFAOYSA-N 2 0 330.516 4.185 20 0 EIADRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2c(Cl)cccc2C(F)(F)F)CC1 ZINC001205570120 1051519075 /nfs/dbraw/zinc/51/90/75/1051519075.db2.gz GGPZBTWBCWWJMX-CQSZACIVSA-N 2 0 338.776 4.012 20 0 EIADRP COc1ccccc1CCC[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(C)CC1 ZINC001175353384 1051545838 /nfs/dbraw/zinc/54/58/38/1051545838.db2.gz XTWGFBNHNKMHFH-OAQYLSRUSA-N 2 0 344.543 4.214 20 0 EIADRP COc1ccccc1CCC[N@@H+]1CCC[C@H]1CC[NH+]1CCC(C)CC1 ZINC001175353383 1051546062 /nfs/dbraw/zinc/54/60/62/1051546062.db2.gz XTWGFBNHNKMHFH-NRFANRHFSA-N 2 0 344.543 4.214 20 0 EIADRP [NH3+]C[C@@]1(F)CCCN(Cc2cc(Cl)cc(Cl)c2Cl)CC1 ZINC001205571827 1051557353 /nfs/dbraw/zinc/55/73/53/1051557353.db2.gz YQEVOZBHXNXWIE-CQSZACIVSA-N 2 0 339.669 4.300 20 0 EIADRP c1ccc(C[N@H+]2CC=C(Nc3c[nH+]ccc3N3CCCCC3)CC2)cc1 ZINC001175504824 1051636227 /nfs/dbraw/zinc/63/62/27/1051636227.db2.gz FUNVZJNRHORMOR-UHFFFAOYSA-N 2 0 348.494 4.274 20 0 EIADRP Cc1noc(C)c1[C@H](C)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000671111880 1051638084 /nfs/dbraw/zinc/63/80/84/1051638084.db2.gz RTONNJVBZIQJLO-VMEOHVCESA-N 2 0 341.499 4.385 20 0 EIADRP CC[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC001182617030 1051660513 /nfs/dbraw/zinc/66/05/13/1051660513.db2.gz YJKWFJYXWBZXDB-VBNZEHGJSA-N 2 0 329.315 4.244 20 0 EIADRP C[C@@H]1C[N@H+](CCSc2cccc(Cl)c2)CCN1c1cc[nH+]cc1 ZINC001175775202 1051778556 /nfs/dbraw/zinc/77/85/56/1051778556.db2.gz PKGRPNGWJOMNDR-OAHLLOKOSA-N 2 0 347.915 4.038 20 0 EIADRP C[C@@H](CCc1c[nH]c2ccccc12)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC001183095480 1051785573 /nfs/dbraw/zinc/78/55/73/1051785573.db2.gz QFQVCZGBMOYIHX-HKUYNNGSSA-N 2 0 339.527 4.201 20 0 EIADRP C[C@@H](CCc1ccc(Cl)s1)[NH2+]C[C@H]1CCN1C1CCCC1 ZINC001183227244 1051807314 /nfs/dbraw/zinc/80/73/14/1051807314.db2.gz PTNLIUJZAMRSIA-DZGCQCFKSA-N 2 0 326.937 4.329 20 0 EIADRP CCN1CCC([NH2+][C@@H](C)c2ccc(SCC(F)(F)F)cc2)CC1 ZINC000159262825 1051964719 /nfs/dbraw/zinc/96/47/19/1051964719.db2.gz UKGVUDQIMQHDPF-ZDUSSCGKSA-N 2 0 346.462 4.476 20 0 EIADRP Cc1cc(C[N@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@H]3C2)ccc1C(F)(F)F ZINC001184301174 1051982873 /nfs/dbraw/zinc/98/28/73/1051982873.db2.gz GARQDWZFRRPWTE-ULQDDVLXSA-N 2 0 340.433 4.176 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccccc2OC)c1 ZINC000163550615 1051996087 /nfs/dbraw/zinc/99/60/87/1051996087.db2.gz USURAOFUIKBIMP-QGZVFWFLSA-N 2 0 326.484 4.388 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCc3ccc(OC)cc32)c1 ZINC000163549479 1051996144 /nfs/dbraw/zinc/99/61/44/1051996144.db2.gz XOMGXDCUJPLZOT-QFIPXVFZSA-N 2 0 338.495 4.314 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(-n3ccnc3C)cc2)CC1 ZINC000164476883 1052031511 /nfs/dbraw/zinc/03/15/11/1052031511.db2.gz WNRNRHCHQOVEAL-KRWDZBQOSA-N 2 0 340.515 4.096 20 0 EIADRP CCc1ccc([C@@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)o1 ZINC000165212520 1052054187 /nfs/dbraw/zinc/05/41/87/1052054187.db2.gz TTZPNQMFPMNTQA-MRXNPFEDSA-N 2 0 330.472 4.023 20 0 EIADRP CCc1ccc([C@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)o1 ZINC000165212641 1052055334 /nfs/dbraw/zinc/05/53/34/1052055334.db2.gz TTZPNQMFPMNTQA-INIZCTEOSA-N 2 0 330.472 4.023 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000165888467 1052078276 /nfs/dbraw/zinc/07/82/76/1052078276.db2.gz JRFKXJJDDMJNPE-ROUUACIJSA-N 2 0 326.484 4.347 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccc(F)cc1 ZINC000073649759 1052132891 /nfs/dbraw/zinc/13/28/91/1052132891.db2.gz UKDSKMRPUKSGED-QGZVFWFLSA-N 2 0 342.458 4.151 20 0 EIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@@H]1CCOCC12CCCC2 ZINC001176966349 1052210659 /nfs/dbraw/zinc/21/06/59/1052210659.db2.gz XJXTUKDQPVTTCF-OAQYLSRUSA-N 2 0 342.527 4.111 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cc(Cl)ccc1O ZINC000184933313 1052317129 /nfs/dbraw/zinc/31/71/29/1052317129.db2.gz LBKNARNTYZSBSE-HNNXBMFYSA-N 2 0 344.886 4.492 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)cc1 ZINC000171129656 1052396503 /nfs/dbraw/zinc/39/65/03/1052396503.db2.gz AFDLJHXXJCNXNO-SFHVURJKSA-N 2 0 326.484 4.176 20 0 EIADRP COc1ccc([C@@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)C(C)C)cc1 ZINC000171127718 1052396655 /nfs/dbraw/zinc/39/66/55/1052396655.db2.gz JMHZCAYIAVSHIM-NRFANRHFSA-N 2 0 326.484 4.244 20 0 EIADRP Cc1nc(C)c(C[NH2+][C@@H]2CCN(Cc3ccccc3)CC2(C)C)s1 ZINC000337808673 1052540743 /nfs/dbraw/zinc/54/07/43/1052540743.db2.gz LJNVNHATXNHDIV-LJQANCHMSA-N 2 0 343.540 4.150 20 0 EIADRP C[C@@H]([NH2+]C1(CN[C@H]2CC[N@H+](C)C(C)(C)C2)CCCC1)c1ccccc1 ZINC000623427615 1052654642 /nfs/dbraw/zinc/65/46/42/1052654642.db2.gz FTQLKYLPBODQAX-QUCCMNQESA-N 2 0 343.559 4.112 20 0 EIADRP C[C@@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000178087769 1052697905 /nfs/dbraw/zinc/69/79/05/1052697905.db2.gz FSEGMWQZFVOECQ-VFNWGFHPSA-N 2 0 342.458 4.104 20 0 EIADRP C[C@H]([NH2+][C@H]1CCCc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000178094535 1052699025 /nfs/dbraw/zinc/69/90/25/1052699025.db2.gz MDLFTGQJQCFNAL-JTSKRJEESA-N 2 0 338.495 4.355 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccccc1N(C)C ZINC000179398998 1052734256 /nfs/dbraw/zinc/73/42/56/1052734256.db2.gz BDLWQMDMRASILX-GOSISDBHSA-N 2 0 337.511 4.199 20 0 EIADRP Clc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000623755265 1052780051 /nfs/dbraw/zinc/78/00/51/1052780051.db2.gz ABWLZIDAEWAULR-DOXZYTNZSA-N 2 0 343.902 4.415 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1cc(-c2ccccc2)n(C)n1 ZINC000623849093 1052822380 /nfs/dbraw/zinc/82/23/80/1052822380.db2.gz VTTBUGXPEKVLRC-QZTJIDSGSA-N 2 0 342.531 4.248 20 0 EIADRP CCC[C@@H]([NH2+]C1CC[NH+](CCCOC)CC1)c1cc(C)sc1C ZINC000623884930 1052833530 /nfs/dbraw/zinc/83/35/30/1052833530.db2.gz MWCUOCCPTNLJRC-LJQANCHMSA-N 2 0 338.561 4.297 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)[C@H](C)c1nc2ccccc2s1 ZINC000624121278 1052867760 /nfs/dbraw/zinc/86/77/60/1052867760.db2.gz SCYUWCGFGVJXEN-JYJNAYRXSA-N 2 0 331.529 4.110 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H]2CCCc3cc(F)ccc32)ccc1F ZINC000182974229 1052957806 /nfs/dbraw/zinc/95/78/06/1052957806.db2.gz QMKQXUCPFDCCJZ-HXUWFJFHSA-N 2 0 330.422 4.194 20 0 EIADRP COc1cc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)ccc1C ZINC000194266605 1053037909 /nfs/dbraw/zinc/03/79/09/1053037909.db2.gz XXYMYOXNBCXWML-UHFFFAOYSA-N 2 0 326.484 4.134 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1cnn(-c2ccccc2)c1C ZINC000764435667 1053102395 /nfs/dbraw/zinc/10/23/95/1053102395.db2.gz RVLITPUAELMEAF-ROUUACIJSA-N 2 0 342.531 4.342 20 0 EIADRP Fc1cccc2c1SCC[C@@H]2[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000850582958 1053334217 /nfs/dbraw/zinc/33/42/17/1053334217.db2.gz IHPGYCPPEGFFAD-SFHVURJKSA-N 2 0 334.504 4.074 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)s1 ZINC000765305776 1053501816 /nfs/dbraw/zinc/50/18/16/1053501816.db2.gz QDVQWOMUCUCZMD-CVEARBPZSA-N 2 0 332.513 4.409 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1cccc(F)c1 ZINC000765361057 1053516161 /nfs/dbraw/zinc/51/61/61/1053516161.db2.gz VDLWRZFSXBFLNH-JBYIUTFZSA-N 2 0 340.486 4.429 20 0 EIADRP C[N@@H+]1CC[C@@H]([NH2+][C@@H]2CCCO[C@H]2c2ccc(Cl)cc2)CC1(C)C ZINC000865830384 1053601994 /nfs/dbraw/zinc/60/19/94/1053601994.db2.gz MAVYYFBEUVWZIV-KURKYZTESA-N 2 0 336.907 4.023 20 0 EIADRP C[C@@H](CCc1cccnc1)[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000866249541 1053665724 /nfs/dbraw/zinc/66/57/24/1053665724.db2.gz LEWOCYYDSGSJFB-SFHVURJKSA-N 2 0 329.532 4.037 20 0 EIADRP CN1CCC[C@H](C[NH2+][C@H](C2CCC2)[C@@H]2CCCO2)[C@@H]1c1cccs1 ZINC000866271591 1053671557 /nfs/dbraw/zinc/67/15/57/1053671557.db2.gz ANQJYFWZSCWSIL-PIKOESSRSA-N 2 0 348.556 4.068 20 0 EIADRP COc1cccc(C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)c1 ZINC000386321887 1053680317 /nfs/dbraw/zinc/68/03/17/1053680317.db2.gz IPTNWEZEEYDFEY-NRFANRHFSA-N 2 0 338.495 4.087 20 0 EIADRP CCCC[N@H+](CCCCn1ccnc1C)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196545910 1053696898 /nfs/dbraw/zinc/69/68/98/1053696898.db2.gz UOEQNFSCEFPSLP-UHFFFAOYSA-N 2 0 348.579 4.383 20 0 EIADRP c1ccc(CC[C@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2ccccn2)cc1 ZINC000866349809 1053699357 /nfs/dbraw/zinc/69/93/57/1053699357.db2.gz OSZQYUYFJXXPSX-QHCPKHFHSA-N 2 0 349.522 4.220 20 0 EIADRP C[C@@H](Cc1cccs1)[NH2+]C[C@@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000690007583 1053740869 /nfs/dbraw/zinc/74/08/69/1053740869.db2.gz SPBAGCJURPZFBJ-FXAWDEMLSA-N 2 0 328.525 4.181 20 0 EIADRP CC[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ccc(OC)c(OC)c1 ZINC000866516225 1053764031 /nfs/dbraw/zinc/76/40/31/1053764031.db2.gz NPLUXCJZLZAPFO-GNZRSQJKSA-N 2 0 334.504 4.007 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)cc1 ZINC000866517080 1053764170 /nfs/dbraw/zinc/76/41/70/1053764170.db2.gz WAROPZHTIJWHND-YQHFOJDRSA-N 2 0 340.515 4.094 20 0 EIADRP C[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ccccc1OC(F)F ZINC000866516272 1053764930 /nfs/dbraw/zinc/76/49/30/1053764930.db2.gz NYHFJLAARSWNJH-VNSJNIRKSA-N 2 0 326.431 4.202 20 0 EIADRP CC(C)C1=[NH+]CCc2ccc(N3C[C@H](CC[NH3+])c4ccccc43)cc21 ZINC001168547221 1053784619 /nfs/dbraw/zinc/78/46/19/1053784619.db2.gz BMTFZKNXFARAMC-KRWDZBQOSA-N 2 0 333.479 4.272 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](Cc2ccccc2F)c2ccccc2)C1 ZINC000429515148 1053853405 /nfs/dbraw/zinc/85/34/05/1053853405.db2.gz AYHXBRLUSRFHAI-UTKZUKDTSA-N 2 0 326.459 4.041 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](Cc2ccccc2F)c2ccccc2)C1 ZINC000429515145 1053853582 /nfs/dbraw/zinc/85/35/82/1053853582.db2.gz AYHXBRLUSRFHAI-DYESRHJHSA-N 2 0 326.459 4.041 20 0 EIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+]C[C@@H]2CCCC2(C)C)CC1 ZINC001202528784 1054030984 /nfs/dbraw/zinc/03/09/84/1054030984.db2.gz RJGXETCIIGVZMN-INIZCTEOSA-N 2 0 349.950 4.008 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2cscc2C(F)(F)F)CC1 ZINC001203917803 1054269392 /nfs/dbraw/zinc/26/93/92/1054269392.db2.gz PNJMAYXCUNJOAV-UHFFFAOYSA-N 2 0 332.435 4.264 20 0 EIADRP Fc1ccc(/C=C/C[NH2+]C[C@H](c2ccccc2)N2CCCC2)c(F)c1 ZINC001198967738 1054313730 /nfs/dbraw/zinc/31/37/30/1054313730.db2.gz BZNJKGZGBBDBFQ-VHTFYLNKSA-N 2 0 342.433 4.405 20 0 EIADRP CCNc1ccccc1C[NH2+]Cc1ccc(C[NH+](CC)CC)cc1 ZINC001199027999 1054336171 /nfs/dbraw/zinc/33/61/71/1054336171.db2.gz NFVXNWOQISEJGK-UHFFFAOYSA-N 2 0 325.500 4.250 20 0 EIADRP COCc1ccccc1C[NH2+]CC(C)(C)C[N@H+](C)Cc1ccccc1 ZINC001199100612 1054345636 /nfs/dbraw/zinc/34/56/36/1054345636.db2.gz KOMPJXAFWRUNAG-UHFFFAOYSA-N 2 0 340.511 4.081 20 0 EIADRP CC(C)[C@@H](C[NH2+][C@H]1CCCc2ccccc2C1)[NH+]1CCCCCC1 ZINC001199161231 1054355301 /nfs/dbraw/zinc/35/53/01/1054355301.db2.gz IQAZKFGQPGSSJO-FCHUYYIVSA-N 2 0 328.544 4.424 20 0 EIADRP CC[C@@H](CCC(F)(F)F)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000872066303 1054375162 /nfs/dbraw/zinc/37/51/62/1054375162.db2.gz GWMCKXHFCUYFPH-IRXDYDNUSA-N 2 0 328.422 4.219 20 0 EIADRP CC[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[NH+]2C[C@H](C)C[C@@H](C)C2)CCO1 ZINC001199310374 1054386159 /nfs/dbraw/zinc/38/61/59/1054386159.db2.gz TZUJWHJDPWKWHF-MCEIDBOGSA-N 2 0 344.543 4.212 20 0 EIADRP Cc1cc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)c2c(n1)CCCC2 ZINC001199336202 1054395142 /nfs/dbraw/zinc/39/51/42/1054395142.db2.gz IZCDXSPYJFSUBS-SFHVURJKSA-N 2 0 329.532 4.013 20 0 EIADRP c1ccc(C[NH+]2CCC(C[NH2+]C[C@@H]3C[C@H]3c3ccccc3)CC2)cc1 ZINC001199677409 1054441013 /nfs/dbraw/zinc/44/10/13/1054441013.db2.gz BBOVWCGETBXMMZ-GOTSBHOMSA-N 2 0 334.507 4.292 20 0 EIADRP CC[C@H]1C[C@H](C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)CCO1 ZINC001199896509 1054484597 /nfs/dbraw/zinc/48/45/97/1054484597.db2.gz MXEGSAHROKSQOJ-IRLDBZIGSA-N 2 0 344.543 4.357 20 0 EIADRP Cc1nc(C(C)C)sc1[C@H](C)[N@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC000873206966 1054509322 /nfs/dbraw/zinc/50/93/22/1054509322.db2.gz GYGIFIKACZOJHI-ZDUSSCGKSA-N 2 0 349.569 4.475 20 0 EIADRP CCSc1ccc([C@H](C)[NH2+]Cc2cc3c(s2)CC[NH2+]C3)cc1 ZINC000873213027 1054509473 /nfs/dbraw/zinc/50/94/73/1054509473.db2.gz UPSDARIPYICXOX-ZDUSSCGKSA-N 2 0 332.538 4.357 20 0 EIADRP CSc1cccc([C@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)c2ccc(F)c(F)c2)c1 ZINC000873250424 1054514432 /nfs/dbraw/zinc/51/44/32/1054514432.db2.gz HJHGBUQJLZOKGB-HGQUKEQDSA-N 2 0 348.462 4.103 20 0 EIADRP c1c2ccccc2oc1[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccnc1 ZINC000873266070 1054517176 /nfs/dbraw/zinc/51/71/76/1054517176.db2.gz ZMHSEWJISSNBSE-AKYGZRSFSA-N 2 0 347.462 4.037 20 0 EIADRP CSc1cccc([C@@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)c2ccc(F)c(F)c2)c1 ZINC000873255542 1054517266 /nfs/dbraw/zinc/51/72/66/1054517266.db2.gz HJHGBUQJLZOKGB-KPAZRMRSSA-N 2 0 348.462 4.103 20 0 EIADRP CC(C)(C)c1csc(C[NH2+]C2CCC([NH+]3CCCCC3)CC2)n1 ZINC001200880361 1054565924 /nfs/dbraw/zinc/56/59/24/1054565924.db2.gz SDAUHOUHQGMPEZ-UHFFFAOYSA-N 2 0 335.561 4.327 20 0 EIADRP CSc1ccc(CN[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)o1 ZINC001200880368 1054566633 /nfs/dbraw/zinc/56/66/33/1054566633.db2.gz SIMJNHSDFTZRMG-DOTOQJQBSA-N 2 0 330.497 4.144 20 0 EIADRP COC[C@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](C[C@@H](C)CCC=C(C)C)C2 ZINC001201486256 1054815353 /nfs/dbraw/zinc/81/53/53/1054815353.db2.gz HWJDCUUUPYLZGV-NNWRFLSQSA-N 2 0 348.575 4.049 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2nc3ccccc3o2)C[N@@H+]1Cc1ccccc1 ZINC001201492513 1054818396 /nfs/dbraw/zinc/81/83/96/1054818396.db2.gz QHDZOIDOAGCAKO-IEBWSBKVSA-N 2 0 349.478 4.218 20 0 EIADRP C[C@H]1C[C@H](CC[NH2+]Cc2cccc(F)c2)C[N@@H+]1Cc1ccccc1 ZINC001201492554 1054819135 /nfs/dbraw/zinc/81/91/35/1054819135.db2.gz RJRIQKQDHLBWOC-PXNSSMCTSA-N 2 0 326.459 4.216 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CCO[C@@H](c2ccc(OC)cc2)C1 ZINC001168593012 1054947748 /nfs/dbraw/zinc/94/77/48/1054947748.db2.gz BPMFXOSESGFWAZ-FBBABVLZSA-N 2 0 348.531 4.015 20 0 EIADRP C[C@]1(C[NH2+]C/C=C\c2ccc(F)cc2)CC[N@H+](Cc2ccccc2)C1 ZINC001202220999 1055092385 /nfs/dbraw/zinc/09/23/85/1055092385.db2.gz XUTUWIFFHNUYMW-HUPBUCHYSA-N 2 0 338.470 4.341 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+](Cc1csc(-c3ccsc3)n1)CC2 ZINC000877684671 1055107840 /nfs/dbraw/zinc/10/78/40/1055107840.db2.gz SKLBHNBWGWJAMB-UHFFFAOYSA-N 2 0 347.553 4.179 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2cc3nc(Cl)ccc3s2)CC1 ZINC000877711675 1055109523 /nfs/dbraw/zinc/10/95/23/1055109523.db2.gz UPZYMZLOVXQEET-UHFFFAOYSA-N 2 0 337.920 4.302 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccccc1 ZINC000542680025 1055820425 /nfs/dbraw/zinc/82/04/25/1055820425.db2.gz DTZQLBBGMFSIKY-MSOLQXFVSA-N 2 0 326.484 4.081 20 0 EIADRP C[C@@H]([NH2+]CCCc1cccs1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000542818642 1056116479 /nfs/dbraw/zinc/11/64/79/1056116479.db2.gz XZRXJUXHEZVART-IEBWSBKVSA-N 2 0 328.525 4.181 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@H]2CC3c4ccccc4C2c2ccccc23)C1 ZINC000656193724 1056693473 /nfs/dbraw/zinc/69/34/73/1056693473.db2.gz QMNHHEIZZGCSKS-IMOWGURISA-N 2 0 332.491 4.143 20 0 EIADRP CCCCC[C@@H]([NH2+][C@H]1CCN(C2CC[NH+](C)CC2)C1)c1ccccc1 ZINC000765943434 1056693630 /nfs/dbraw/zinc/69/36/30/1056693630.db2.gz KVJOECNMEVKNLP-RBBKRZOGSA-N 2 0 343.559 4.066 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000188148621 1060127957 /nfs/dbraw/zinc/12/79/57/1060127957.db2.gz UNCDKBBRJUTRME-KBRIMQKVSA-N 2 0 326.406 4.025 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1OCc1ccccc1)C1CC[NH+](C)CC1 ZINC000381142622 1060207711 /nfs/dbraw/zinc/20/77/11/1060207711.db2.gz SQCQWFUGKBGBHA-SFHVURJKSA-N 2 0 338.495 4.086 20 0 EIADRP Cc1nc(C)c([C@@H](C)[NH2+]C[C@H]2CCCN(Cc3ccccc3)C2)s1 ZINC000383343405 1060247914 /nfs/dbraw/zinc/24/79/14/1060247914.db2.gz LNEFHQLOZUKONT-DNVCBOLYSA-N 2 0 343.540 4.323 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2cnccc2c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000388982830 1060282046 /nfs/dbraw/zinc/28/20/46/1060282046.db2.gz RCJPPVGROIXVEJ-MBSDFSHPSA-N 2 0 345.490 4.235 20 0 EIADRP CCc1nc(C)c([C@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)s1 ZINC000766511315 1060430995 /nfs/dbraw/zinc/43/09/95/1060430995.db2.gz OWBKLORNPUIPFX-OOHWJJMZSA-N 2 0 335.561 4.462 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)c(F)c1 ZINC000766511978 1060479071 /nfs/dbraw/zinc/47/90/71/1060479071.db2.gz UZJQDXMGSATUDR-GTPINHCMSA-N 2 0 334.479 4.282 20 0 EIADRP c1ccc2c(c1)OCCC[C@@H]2[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000766512766 1060487440 /nfs/dbraw/zinc/48/74/40/1060487440.db2.gz MNGLFQPIVBMKNQ-QLOJAFMTSA-N 2 0 328.500 4.287 20 0 EIADRP CCCCCC(C)(C)C[NH2+][C@@H]1CCN(Cc2ccccn2)C[C@H]1C ZINC000766551982 1060535321 /nfs/dbraw/zinc/53/53/21/1060535321.db2.gz XKBKIGQEUNBZDS-UYAOXDASSA-N 2 0 331.548 4.488 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@H]1C[C@@H]1c1ccc(-c3cccc(O)c3)cc1)C2 ZINC001169109083 1060657827 /nfs/dbraw/zinc/65/78/27/1060657827.db2.gz YBGVCJQYRYJDQB-FQVVGKCUSA-N 2 0 348.490 4.130 20 0 EIADRP CCCC[C@@H]([NH3+])Cc1cn([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc12 ZINC001169109483 1060658366 /nfs/dbraw/zinc/65/83/66/1060658366.db2.gz JDNYHUBZMNHQQG-YSTOQKLRSA-N 2 0 339.527 4.499 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1c1ccc(N[C@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)nc1 ZINC001169141810 1060663182 /nfs/dbraw/zinc/66/31/82/1060663182.db2.gz KWSLKQMCLDDPLD-UEXGIBASSA-N 2 0 344.547 4.194 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC(c3nc4ccccc4s3)CC1)C2 ZINC001169142403 1060663703 /nfs/dbraw/zinc/66/37/03/1060663703.db2.gz UDWPWWFHCNBERN-BJWYYQGGSA-N 2 0 341.524 4.101 20 0 EIADRP C[N@@H+]1CC[C@H](c2ccc(N[C@H]3CC(C)(C)C[C@](C)(C[NH3+])C3)cc2)C1 ZINC001169148772 1060668424 /nfs/dbraw/zinc/66/84/24/1060668424.db2.gz ZYHNFNMFNAQZES-HFSMHLIXSA-N 2 0 329.532 4.061 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1)C2 ZINC001169154262 1060671229 /nfs/dbraw/zinc/67/12/29/1060671229.db2.gz PCDDHHYQTQGNMG-VSZNYVQBSA-N 2 0 338.417 4.468 20 0 EIADRP CCCC[C@H]([NH3+])Cc1cn(C2CC[NH+](CC)CC2)c2ccccc12 ZINC001169237896 1060713735 /nfs/dbraw/zinc/71/37/35/1060713735.db2.gz BPCULPOAMHBJIA-SFHVURJKSA-N 2 0 327.516 4.358 20 0 EIADRP CC(=O)N1CCC[C@@H]([NH2+]CCC[PH+](C(C)(C)C)C(C)(C)C)C1 ZINC001169593813 1060864689 /nfs/dbraw/zinc/86/46/89/1060864689.db2.gz JGHJQZSBULMHAR-MRXNPFEDSA-N 2 0 328.481 4.056 20 0 EIADRP CC(=O)N1CCC[C@H]([NH2+]CCC[PH+](C(C)(C)C)C(C)(C)C)C1 ZINC001169593810 1060864944 /nfs/dbraw/zinc/86/49/44/1060864944.db2.gz JGHJQZSBULMHAR-INIZCTEOSA-N 2 0 328.481 4.056 20 0 EIADRP CC(C)Oc1ccc([C@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000298246603 519781846 /nfs/dbraw/zinc/78/18/46/519781846.db2.gz CZDIKVSLOYNNEH-KRWDZBQOSA-N 2 0 339.483 4.188 20 0 EIADRP C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1OC(F)F ZINC000298447645 525295429 /nfs/dbraw/zinc/29/54/29/525295429.db2.gz NUDKSOQDRWUGQC-AWEZNQCLSA-N 2 0 347.409 4.003 20 0 EIADRP C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1OC(F)F ZINC000298447658 525404499 /nfs/dbraw/zinc/40/44/99/525404499.db2.gz NUDKSOQDRWUGQC-CQSZACIVSA-N 2 0 347.409 4.003 20 0 EIADRP COc1ccc2cc(C[NH2+]C3CC[NH+](C(C)(C)C)CC3)ccc2c1 ZINC000119859871 525631057 /nfs/dbraw/zinc/63/10/57/525631057.db2.gz YIVRDRBDXJNIMD-UHFFFAOYSA-N 2 0 326.484 4.201 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@H]3C)s2)cc1 ZINC000532249385 1032111149 /nfs/dbraw/zinc/11/11/49/1032111149.db2.gz WYXNNSZKMKCTEY-ZRGWGRIASA-N 2 0 344.524 4.242 20 0 EIADRP c1ccc2ncc(C[NH2+]CCCCCCC[NH+]3CCCC3)cc2c1 ZINC000729682479 1032131555 /nfs/dbraw/zinc/13/15/55/1032131555.db2.gz VCLRTWHQRMLQLU-UHFFFAOYSA-N 2 0 325.500 4.371 20 0 EIADRP c1ccc(C[N@H+]2CC[C@@H](C[NH2+][C@@H]3CCCOc4ccccc43)C2)cc1 ZINC000195137044 1032204942 /nfs/dbraw/zinc/20/49/42/1032204942.db2.gz XKYCQGHQBXWCFM-PZJWPPBQSA-N 2 0 336.479 4.012 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3cccc4cc[nH]c43)CC2)CC1 ZINC000532784194 1032311725 /nfs/dbraw/zinc/31/17/25/1032311725.db2.gz WFWGLQZNYZKZHP-UHFFFAOYSA-N 2 0 325.500 4.301 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)C1CC(F)(F)C1 ZINC000529543739 1032434856 /nfs/dbraw/zinc/43/48/56/1032434856.db2.gz NDWNDUSWBSNAGA-RYRKJORJSA-N 2 0 336.470 4.311 20 0 EIADRP C[N@@H+](Cc1ccc2cc[nH]c2c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000529535979 1032442317 /nfs/dbraw/zinc/44/23/17/1032442317.db2.gz VHLRMZPUHIRLBJ-FQEVSTJZSA-N 2 0 333.479 4.122 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H]2CSCCc3ccccc32)ccc1F ZINC000120957516 1032481679 /nfs/dbraw/zinc/48/16/79/1032481679.db2.gz PWKYXWZYBHAACV-HXUWFJFHSA-N 2 0 344.499 4.008 20 0 EIADRP C[C@H](c1ccc(CN2CC[C@H](C[NH+]3CCCC3)C2)cc1)C(F)(F)F ZINC000450427245 1032487510 /nfs/dbraw/zinc/48/75/10/1032487510.db2.gz FFOPRUKBJWKTEV-NVXWUHKLSA-N 2 0 340.433 4.270 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)c1ccccc1C(C)(C)C ZINC000533170057 1032529397 /nfs/dbraw/zinc/52/93/97/1032529397.db2.gz QQRGKZAJRKBGIA-MSOLQXFVSA-N 2 0 344.543 4.136 20 0 EIADRP CC[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1OC ZINC000179468343 1032560974 /nfs/dbraw/zinc/56/09/74/1032560974.db2.gz ZGEIGVPXVYOOJQ-HXUWFJFHSA-N 2 0 339.483 4.048 20 0 EIADRP C[C@H]1CCN(Cc2ccc(C(F)(F)F)s2)C[C@@H]1n1ccnc1 ZINC000432732333 1032617070 /nfs/dbraw/zinc/61/70/70/1032617070.db2.gz ULUNTBFRAKJAHD-AAEUAGOBSA-N 2 0 329.391 4.047 20 0 EIADRP FC1(F)CC(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)C1 ZINC000450651197 1032620139 /nfs/dbraw/zinc/62/01/39/1032620139.db2.gz SACHYJTVMUUDJA-UHFFFAOYSA-N 2 0 334.454 4.020 20 0 EIADRP CCC1(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CCOCC1 ZINC000512396973 1032663415 /nfs/dbraw/zinc/66/34/15/1032663415.db2.gz XVRRFJOWCCLKSY-TZIWHRDSSA-N 2 0 344.543 4.084 20 0 EIADRP Clc1ccccc1C[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1 ZINC001203384683 1018826976 /nfs/dbraw/zinc/82/69/76/1018826976.db2.gz FNMNPZAFTUFELE-UHFFFAOYSA-N 2 0 340.898 4.438 20 0 EIADRP CC[N@H+](Cc1ccc(-c2nc([C@@H]([NH3+])CC(C)C)no2)cc1)C(C)C ZINC000339394860 1018835023 /nfs/dbraw/zinc/83/50/23/1018835023.db2.gz PLDABSMVLYNPDR-KRWDZBQOSA-N 2 0 330.476 4.013 20 0 EIADRP c1sc(C[NH2+]CCCCC[NH+]2CCCC2)nc1-c1ccccc1 ZINC000339498299 1019002145 /nfs/dbraw/zinc/00/21/45/1019002145.db2.gz KLPWMKPDMZXXPL-UHFFFAOYSA-N 2 0 329.513 4.166 20 0 EIADRP Fc1ccc(C(NC2CC[NH+](C3CC3)CC2)c2ccc(F)cc2)cc1 ZINC000180028747 1020034435 /nfs/dbraw/zinc/03/44/35/1020034435.db2.gz CFYREEKLSGQJSU-UHFFFAOYSA-N 2 0 342.433 4.271 20 0 EIADRP C[NH+](C)CC1CCN(c2cc[nH+]c3cc(C(F)(F)F)ccc32)CC1 ZINC000443671501 1020206092 /nfs/dbraw/zinc/20/60/92/1020206092.db2.gz CBDKMGCNHLSMNA-UHFFFAOYSA-N 2 0 337.389 4.032 20 0 EIADRP CC(C)(C)C[C@@H]([NH2+]C1CCN([C@H]2CCOC2)CC1)c1ccc(F)cc1 ZINC000655693913 1020900077 /nfs/dbraw/zinc/90/00/77/1020900077.db2.gz ARCIPTCGQCHSPN-VQTJNVASSA-N 2 0 348.506 4.146 20 0 EIADRP C[C@H]1CC[C@@H]([NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CS1 ZINC000655714693 1020912351 /nfs/dbraw/zinc/91/23/51/1020912351.db2.gz AMQNEZATMXAVIC-QFBILLFUSA-N 2 0 344.524 4.285 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000655803926 1020974462 /nfs/dbraw/zinc/97/44/62/1020974462.db2.gz IPBJWNJOXCJSIO-OXXUSNJHSA-N 2 0 340.433 4.271 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cccc(OCc2ccccc2)c1 ZINC000655805688 1020976080 /nfs/dbraw/zinc/97/60/80/1020976080.db2.gz KEXYDCNTDGYCRV-HFSMHLIXSA-N 2 0 338.495 4.256 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000340471391 1021078546 /nfs/dbraw/zinc/07/85/46/1021078546.db2.gz WJIZFGCZRKDVEF-NRFANRHFSA-N 2 0 338.495 4.401 20 0 EIADRP c1cc(C[NH2+]Cc2ccc3cnccc3c2)cc(C[NH+]2CCCC2)c1 ZINC000683765677 1021385328 /nfs/dbraw/zinc/38/53/28/1021385328.db2.gz XPADRIQOQNLMNO-UHFFFAOYSA-N 2 0 331.463 4.120 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](c1cccc(F)c1)C(C)(C)C ZINC000422841877 1021647777 /nfs/dbraw/zinc/64/77/77/1021647777.db2.gz XAHGTZMFMGYEHR-KUHUBIRLSA-N 2 0 329.463 4.426 20 0 EIADRP CC[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc2c(c1)CCO2 ZINC000160470225 1021883044 /nfs/dbraw/zinc/88/30/44/1021883044.db2.gz ZYZKZJCDUKLPLC-HXUWFJFHSA-N 2 0 328.500 4.069 20 0 EIADRP Cc1ccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)nc1C ZINC000414164486 1022006687 /nfs/dbraw/zinc/00/66/87/1022006687.db2.gz KFTLPUZEEZMEAM-UHFFFAOYSA-N 2 0 337.511 4.231 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1nc(-c2ccccc2)cs1 ZINC000414184747 1022061589 /nfs/dbraw/zinc/06/15/89/1022061589.db2.gz OGHHKRXIAGNJHC-JKSUJKDBSA-N 2 0 329.513 4.193 20 0 EIADRP Cc1cc([C@H](C)[NH2+]CC[C@@H]2CCC[N@H+](C)C2)sc1Br ZINC000414193286 1022084933 /nfs/dbraw/zinc/08/49/33/1022084933.db2.gz SYLISOSGWOFARE-STQMWFEESA-N 2 0 345.350 4.202 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c[nH+]cn2c1)c1ccc(OCC(F)(F)F)cc1 ZINC000414197022 1022096813 /nfs/dbraw/zinc/09/68/13/1022096813.db2.gz XKFYWIPLCXDPKO-ZDUSSCGKSA-N 2 0 349.356 4.126 20 0 EIADRP C([NH2+]C1CCC2(CCCO2)CC1)[C@@H]1CCC[N@@H+]1CC1CCCCC1 ZINC000580501677 1022120145 /nfs/dbraw/zinc/12/01/45/1022120145.db2.gz KZWJVFBYYQPSCA-KBWCOIMZSA-N 2 0 334.548 4.113 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@H]2Cc4ccccc42)C3)cc1 ZINC000245731169 1033034090 /nfs/dbraw/zinc/03/40/90/1033034090.db2.gz QFHAFYNRQRYZEP-YUMYIRISSA-N 2 0 332.491 4.112 20 0 EIADRP COc1ccsc1[C@H](C)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000471597218 1022245998 /nfs/dbraw/zinc/24/59/98/1022245998.db2.gz NOMQGQAOQACUAC-GTPINHCMSA-N 2 0 336.545 4.450 20 0 EIADRP CCc1onc(C)c1C[NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000892575069 1022266153 /nfs/dbraw/zinc/26/61/53/1022266153.db2.gz RHEOKXRNUOHWQV-INIZCTEOSA-N 2 0 341.499 4.067 20 0 EIADRP FC(F)(F)c1ccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000047969283 1022288762 /nfs/dbraw/zinc/28/87/62/1022288762.db2.gz QZHODIWKEIXIGW-UHFFFAOYSA-N 2 0 326.406 4.013 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H](C)C2)cnc1F ZINC000892579936 1022302851 /nfs/dbraw/zinc/30/28/51/1022302851.db2.gz DEGMKNPEERHLLD-MRXNPFEDSA-N 2 0 341.474 4.051 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2coc(-c3ccc(C)cc3)n2)CC1 ZINC000047978545 1022340027 /nfs/dbraw/zinc/34/00/27/1022340027.db2.gz LGHVEQPUIRUCBQ-UHFFFAOYSA-N 2 0 341.499 4.204 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CC2CC[NH+](C)CC2)ccc1OC1CCCC1 ZINC000892594617 1022388043 /nfs/dbraw/zinc/38/80/43/1022388043.db2.gz NHZBJSJPOHYSPU-MRXNPFEDSA-N 2 0 346.515 4.009 20 0 EIADRP FC1(F)CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)C1 ZINC000651300801 1022401400 /nfs/dbraw/zinc/40/14/00/1022401400.db2.gz GENWZPIAOBJHOG-INDMIFKZSA-N 2 0 334.454 4.207 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2cc3c(s2)CCCC3)CC[NH+](C)CC1 ZINC000580744559 1022446953 /nfs/dbraw/zinc/44/69/53/1022446953.db2.gz YTZPHNZLFVJRNA-AWEZNQCLSA-N 2 0 338.586 4.105 20 0 EIADRP C[C@H]([NH2+]CC1(c2cccc(C(F)(F)F)c2)CC1)C1CC[NH+](C)CC1 ZINC000161628098 1022508702 /nfs/dbraw/zinc/50/87/02/1022508702.db2.gz UPDIQHPRQICKSK-AWEZNQCLSA-N 2 0 340.433 4.057 20 0 EIADRP CCCCOc1ccc(C[N@H+](C)[C@@H]2CCN(C)C[C@H]2C)cc1OCC ZINC000580801445 1022510854 /nfs/dbraw/zinc/51/08/54/1022510854.db2.gz JFPYGVJEIBKKAX-IEBWSBKVSA-N 2 0 348.531 4.036 20 0 EIADRP CC(C)Oc1ccc(CC[C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000892630867 1022700529 /nfs/dbraw/zinc/70/05/29/1022700529.db2.gz KGYXLYSEOYINIC-OHSMVPPVSA-N 2 0 330.516 4.010 20 0 EIADRP c1sc(C[N@@H+]2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)nc1-c1ccccc1 ZINC000647542955 1022778648 /nfs/dbraw/zinc/77/86/48/1022778648.db2.gz FGGLESDVRQDVKT-ROUUACIJSA-N 2 0 341.524 4.022 20 0 EIADRP CC[C@H](C)c1ccc([C@H](C)[NH2+]CCCC[NH+]2CCN(CC)CC2)cc1 ZINC000623861779 1022870954 /nfs/dbraw/zinc/87/09/54/1022870954.db2.gz CHJIOPAQVVMQSB-PMACEKPBSA-N 2 0 345.575 4.268 20 0 EIADRP c1csc([C@H](Cc2ccccc2)[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000090015592 1023263927 /nfs/dbraw/zinc/26/39/27/1023263927.db2.gz XZKIXSHNOMYCNU-QRVBRYPASA-N 2 0 326.509 4.248 20 0 EIADRP C[C@H]([NH2+][C@@H](Cc1ccccc1)c1cccs1)C1CC[NH+](C)CC1 ZINC000090015772 1023264020 /nfs/dbraw/zinc/26/40/20/1023264020.db2.gz SWZVLKGEOMJOQA-LPHOPBHVSA-N 2 0 328.525 4.352 20 0 EIADRP C[C@H](Cc1ccsc1)[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000584760789 1023289937 /nfs/dbraw/zinc/28/99/37/1023289937.db2.gz GBWNMDLBEAGIFK-QZTJIDSGSA-N 2 0 342.552 4.364 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)C1 ZINC000584819125 1023346052 /nfs/dbraw/zinc/34/60/52/1023346052.db2.gz DWIHZDUNRLXAJE-GHTZIAJQSA-N 2 0 326.459 4.041 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+]Cc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000415015659 1023391494 /nfs/dbraw/zinc/39/14/94/1023391494.db2.gz BBJQWCLMUXEXCO-SNVBAGLBSA-N 2 0 344.311 4.334 20 0 EIADRP C[N@H+](CCCc1cc(-c2ccccc2)no1)CC[C@@H]1CCCC[NH+]1C ZINC000472687124 1023411970 /nfs/dbraw/zinc/41/19/70/1023411970.db2.gz YSMGVDZOYJTRKC-IBGZPJMESA-N 2 0 341.499 4.080 20 0 EIADRP C[C@H](C[C@H]1CCC[NH2+]1)[NH2+]Cc1ccccc1COCc1ccccc1 ZINC000415076808 1023422623 /nfs/dbraw/zinc/42/26/23/1023422623.db2.gz GQXOJWLFUVRHGI-XMSQKQJNSA-N 2 0 338.495 4.024 20 0 EIADRP [NH3+]CC1CCC([NH2+]Cc2ccccc2COCc2ccccc2)CC1 ZINC000415077309 1023423500 /nfs/dbraw/zinc/42/35/00/1023423500.db2.gz HIZYKRGVVFZBJV-UHFFFAOYSA-N 2 0 338.495 4.011 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]C[C@H]1CCC[NH2+]C1 ZINC000415073216 1023425720 /nfs/dbraw/zinc/42/57/20/1023425720.db2.gz ARHFEDUGPLIBPD-JSGCOSHPSA-N 2 0 349.931 4.422 20 0 EIADRP COc1ccc2cc(C[NH2+][C@H](CCC[NH3+])c3ccccc3)ccc2c1 ZINC000415073840 1023428375 /nfs/dbraw/zinc/42/83/75/1023428375.db2.gz ZWKMZJQFIQZLMA-JOCHJYFZSA-N 2 0 334.463 4.418 20 0 EIADRP C[C@@H](CC[NH2+]C[C@H]1CC[NH2+][C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000415085935 1023434106 /nfs/dbraw/zinc/43/41/06/1023434106.db2.gz IZHGWLHZDSOXBZ-ZNMIVQPWSA-N 2 0 328.422 4.177 20 0 EIADRP c1ccc2c(c1)C1C[C@H](C[NH2+][C@H]3CCC[NH2+]CC3)C2c2ccccc21 ZINC000415110152 1023448767 /nfs/dbraw/zinc/44/87/67/1023448767.db2.gz QDUXIUBJNUNLBT-FXAUUADQSA-N 2 0 332.491 4.015 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCN[C@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000415121017 1023451170 /nfs/dbraw/zinc/45/11/70/1023451170.db2.gz YSKPEYXAAKBRNR-ZTQAJYAQSA-N 2 0 330.422 4.151 20 0 EIADRP Cc1cc(F)ncc1C[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000893328072 1023472722 /nfs/dbraw/zinc/47/27/22/1023472722.db2.gz TWXPKXHFYFKEGM-UHFFFAOYSA-N 2 0 341.474 4.051 20 0 EIADRP CC[C@@H](c1ccc(Br)cc1)[N@H+](C)C[C@@H]1CCCN(C)C1 ZINC000472737615 1023476004 /nfs/dbraw/zinc/47/60/04/1023476004.db2.gz KLPBVDSFEFTOMX-PBHICJAKSA-N 2 0 339.321 4.174 20 0 EIADRP C[C@H](C[N@H+](C)[C@H]1CCN(C)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097668 1023499744 /nfs/dbraw/zinc/49/97/44/1023499744.db2.gz MWQQZHXQQMZTDO-CPUCHLNUSA-N 2 0 328.422 4.223 20 0 EIADRP c1nc(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)sc1-c1ccccc1 ZINC000656783627 1023518043 /nfs/dbraw/zinc/51/80/43/1023518043.db2.gz RLJFTLSRMHHNMX-SFHVURJKSA-N 2 0 341.524 4.022 20 0 EIADRP [NH3+][C@H]1CCO[C@@H](C2CC[NH+](Cc3cccc(C4CCCC4)c3)CC2)C1 ZINC000656786178 1023527551 /nfs/dbraw/zinc/52/75/51/1023527551.db2.gz LWBYXUAVPOHDKZ-FCHUYYIVSA-N 2 0 342.527 4.063 20 0 EIADRP Clc1cc2cccnc2c(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)c1 ZINC000656784449 1023528967 /nfs/dbraw/zinc/52/89/67/1023528967.db2.gz DFWAMTQJEURUNL-KRWDZBQOSA-N 2 0 343.902 4.100 20 0 EIADRP [NH3+][C@@H]1CCO[C@H]([C@H]2CCCC[N@@H+]2Cc2cccc(C3CCCC3)c2)C1 ZINC000656785848 1023529187 /nfs/dbraw/zinc/52/91/87/1023529187.db2.gz KEENGOPTWCDCCA-VSKRKVRLSA-N 2 0 342.527 4.205 20 0 EIADRP c1csc(-c2ncc(C[NH+]3CCC([C@@H]4CCC[NH2+]C4)CC3)s2)c1 ZINC000656785316 1023530543 /nfs/dbraw/zinc/53/05/43/1023530543.db2.gz GSAHJKKJNPCRKX-OAHLLOKOSA-N 2 0 347.553 4.083 20 0 EIADRP [NH3+][C@@H]1CCO[C@H]([C@@H]2CCC[N@H+](Cc3cccc(C4CCCC4)c3)C2)C1 ZINC000656786436 1023532011 /nfs/dbraw/zinc/53/20/11/1023532011.db2.gz MNUMTVRDIVJSBK-VSKRKVRLSA-N 2 0 342.527 4.063 20 0 EIADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CCCC1 ZINC000656789500 1023535746 /nfs/dbraw/zinc/53/57/46/1023535746.db2.gz OYNDRTFMDQLHBX-HZPDHXFCSA-N 2 0 326.406 4.203 20 0 EIADRP c1sc(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)nc1-c1ccccc1 ZINC000656786757 1023536561 /nfs/dbraw/zinc/53/65/61/1023536561.db2.gz XKALJJZGLQRQPI-GOSISDBHSA-N 2 0 341.524 4.022 20 0 EIADRP CC(C)C[C@H](C)[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000341314014 1023567367 /nfs/dbraw/zinc/56/73/67/1023567367.db2.gz PHPHGUGZBKNXIF-IBGZPJMESA-N 2 0 332.532 4.082 20 0 EIADRP C[C@@H]1OCC[C@@H]1[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549261835 1023583855 /nfs/dbraw/zinc/58/38/55/1023583855.db2.gz PKNWWFYWKOILJI-OVQBEFFGSA-N 2 0 348.918 4.021 20 0 EIADRP C[C@@H]1OCC[C@H]1[NH2+][C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549261828 1023584083 /nfs/dbraw/zinc/58/40/83/1023584083.db2.gz PKNWWFYWKOILJI-ABZDAADZSA-N 2 0 348.918 4.021 20 0 EIADRP CCC1(C[NH2+][C@@H]2CCC[C@H](OC)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000684388552 1023616331 /nfs/dbraw/zinc/61/63/31/1023616331.db2.gz UPXBXRQFFHQCAA-RTWAWAEBSA-N 2 0 344.543 4.226 20 0 EIADRP CCOc1ccc(C[C@@H](C)C[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1 ZINC000651489893 1023627349 /nfs/dbraw/zinc/62/73/49/1023627349.db2.gz OIIZMSZHDMVGCN-QGZVFWFLSA-N 2 0 332.532 4.116 20 0 EIADRP CC[C@H](Cc1cccs1)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000684410404 1023660359 /nfs/dbraw/zinc/66/03/59/1023660359.db2.gz XPGGXCXUAWJJDX-RTBURBONSA-N 2 0 328.525 4.181 20 0 EIADRP C[NH+](C)CC1CCC([NH2+]Cc2ccc(Sc3ccccn3)o2)CC1 ZINC000511711004 1023835814 /nfs/dbraw/zinc/83/58/14/1023835814.db2.gz CMYSUBGOAVJQAS-UHFFFAOYSA-N 2 0 345.512 4.036 20 0 EIADRP C[NH2+]CC1CC[NH+](Cc2cnc(-c3ccc(C(C)C)cc3)s2)CC1 ZINC000430932658 1024235772 /nfs/dbraw/zinc/23/57/72/1024235772.db2.gz GRTVWQSKHZWYIA-UHFFFAOYSA-N 2 0 343.540 4.365 20 0 EIADRP c1cc(C2CC[NH+](Cc3cccc(C[NH+]4CCCCC4)c3)CC2)no1 ZINC000662049133 1024835975 /nfs/dbraw/zinc/83/59/75/1024835975.db2.gz SBROGERGVXOTTC-UHFFFAOYSA-N 2 0 339.483 4.040 20 0 EIADRP COC1CCC(CC[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000548485643 1024839016 /nfs/dbraw/zinc/83/90/16/1024839016.db2.gz ASZZJZHNAJOVFY-FFKUYJCKSA-N 2 0 344.543 4.082 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2csc(-c3ccccc3)n2)CC1 ZINC000535811419 1024957966 /nfs/dbraw/zinc/95/79/66/1024957966.db2.gz YUOXEYSKFYFVEN-UHFFFAOYSA-N 2 0 343.540 4.362 20 0 EIADRP C[C@H]([NH2+]CCSCc1cccc2ccccc21)C1CC[NH+](C)CC1 ZINC000610803926 1024985895 /nfs/dbraw/zinc/98/58/95/1024985895.db2.gz JGOMTGBDWVWWFU-KRWDZBQOSA-N 2 0 342.552 4.393 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccccc1OC(F)F ZINC000662284476 1025033673 /nfs/dbraw/zinc/03/36/73/1025033673.db2.gz YUHUWIMOEBRODC-SFHVURJKSA-N 2 0 346.421 4.175 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2occc2c1 ZINC000511995492 1025598282 /nfs/dbraw/zinc/59/82/82/1025598282.db2.gz ABNDZKZARBUYFV-UTKZUKDTSA-N 2 0 334.463 4.433 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@H](Sc2ccncc2)C1 ZINC001167826938 1025631250 /nfs/dbraw/zinc/63/12/50/1025631250.db2.gz SDMRAAGPEFDRGV-HKUYNNGSSA-N 2 0 335.561 4.149 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)sc1Br ZINC000512011436 1025714157 /nfs/dbraw/zinc/71/41/57/1025714157.db2.gz VUNJVCATZGETLG-RWMBFGLXSA-N 2 0 345.350 4.342 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](C)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC001167833355 1025784297 /nfs/dbraw/zinc/78/42/97/1025784297.db2.gz APSSOASVHKWFRF-RBBKRZOGSA-N 2 0 345.575 4.093 20 0 EIADRP Cc1cccc2[nH]c(C[NH2+]Cc3cccc(C[NH+]4CCCC4)c3)cc21 ZINC000657300036 1025807031 /nfs/dbraw/zinc/80/70/31/1025807031.db2.gz GKOXOFGUQCXMOV-UHFFFAOYSA-N 2 0 333.479 4.362 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(OC)(c2ccccc2)CC1 ZINC001167836533 1025847384 /nfs/dbraw/zinc/84/73/84/1025847384.db2.gz FCDWXHOBURSEFQ-LJQANCHMSA-N 2 0 332.532 4.135 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(Oc2ccccc2OC)CC1 ZINC001167839522 1025849668 /nfs/dbraw/zinc/84/96/68/1025849668.db2.gz YVQIECRLWKTCEY-SFHVURJKSA-N 2 0 348.531 4.049 20 0 EIADRP Cc1ccc(-c2nn(-c3ccccc3)cc2C[NH2+][C@@H](C)CCC[NH3+])cc1 ZINC000415019332 1025851968 /nfs/dbraw/zinc/85/19/68/1025851968.db2.gz IAIMMRHNEOARJQ-SFHVURJKSA-N 2 0 348.494 4.065 20 0 EIADRP CC(C)C1CCC(C[NH2+][C@@H]2CCN(Cc3ccccn3)C[C@@H]2C)CC1 ZINC000512056043 1025853950 /nfs/dbraw/zinc/85/39/50/1025853950.db2.gz FFDYIXVGJMFVKQ-HKEJHHQYSA-N 2 0 343.559 4.344 20 0 EIADRP Clc1ccc2c(c1)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3CC1CC1)CC2 ZINC001167967946 1025889446 /nfs/dbraw/zinc/88/94/46/1025889446.db2.gz MCNNUEVTRQXSQF-AQDPXUSMSA-N 2 0 330.903 4.322 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1cncc(F)c1 ZINC000157645215 1025901186 /nfs/dbraw/zinc/90/11/86/1025901186.db2.gz KVWHHRTWTGHHJN-SJORKVTESA-N 2 0 341.474 4.303 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2cc3ccncc3s2)C1 ZINC000657313475 1025975052 /nfs/dbraw/zinc/97/50/52/1025975052.db2.gz SEXQQMPDWLDHMV-HOTGVXAUSA-N 2 0 331.529 4.144 20 0 EIADRP C[C@H]([NH2+]CCCN1CCCO[C@@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000432447185 1026027922 /nfs/dbraw/zinc/02/79/22/1026027922.db2.gz OKURUDITGZEMKQ-KBPBESRZSA-N 2 0 345.314 4.145 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000301216788 1026054218 /nfs/dbraw/zinc/05/42/18/1026054218.db2.gz ZGYBRBIMGYDIHW-AZUAARDMSA-N 2 0 338.495 4.258 20 0 EIADRP C[N@@H+]1CCC[C@@H](CNc2[nH+]ccc3[nH]ccc32)[C@@H]1c1cccs1 ZINC000663660333 1026063453 /nfs/dbraw/zinc/06/34/53/1026063453.db2.gz MBTLFTLPVWLIHX-SUMWQHHRSA-N 2 0 326.469 4.119 20 0 EIADRP CCc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)cn1 ZINC000512124463 1026070658 /nfs/dbraw/zinc/07/06/58/1026070658.db2.gz RGCZQTOSFYXLJP-UHFFFAOYSA-N 2 0 337.511 4.310 20 0 EIADRP CO[C@H](C[NH2+]Cc1cc(-n2ccnc2)cs1)c1ccc(Cl)cc1 ZINC000344201884 1026128714 /nfs/dbraw/zinc/12/87/14/1026128714.db2.gz YPZNSTZAKDMZSS-QGZVFWFLSA-N 2 0 347.871 4.065 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000431353864 1026148569 /nfs/dbraw/zinc/14/85/69/1026148569.db2.gz XCSHWZKNYSTUFS-QKLQHJQFSA-N 2 0 328.500 4.240 20 0 EIADRP CCN(CC)[C@H](C[NH2+]Cc1ccnc2ccccc12)c1ccccc1 ZINC000327564059 1026204988 /nfs/dbraw/zinc/20/49/88/1026204988.db2.gz UZESBDJPKOZYBK-JOCHJYFZSA-N 2 0 333.479 4.408 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1)C1CC[NH+](C)CC1 ZINC000684773695 1026247838 /nfs/dbraw/zinc/24/78/38/1026247838.db2.gz CRTUOFKUVGVXJA-OWQGQXMQSA-N 2 0 340.433 4.271 20 0 EIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000582328342 1026454939 /nfs/dbraw/zinc/45/49/39/1026454939.db2.gz VBLBLQNFEDQMQK-DOTOQJQBSA-N 2 0 342.449 4.346 20 0 EIADRP C[NH+](C)CC1CC[NH+](Cc2c(OC(F)F)ccc3ccccc32)CC1 ZINC000506868475 1026477382 /nfs/dbraw/zinc/47/73/82/1026477382.db2.gz SCACDBKQVYQJQD-UHFFFAOYSA-N 2 0 348.437 4.215 20 0 EIADRP CCC(C)(C)c1ccc(C[NH2+]Cc2ccnn2-c2cc[nH+]cc2)cc1 ZINC000657415478 1026574790 /nfs/dbraw/zinc/57/47/90/1026574790.db2.gz KQIRKLOSHAKJOY-UHFFFAOYSA-N 2 0 334.467 4.245 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCC2)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512318487 1026687750 /nfs/dbraw/zinc/68/77/50/1026687750.db2.gz PSCVPWZULWJPBL-FVJLSDCUSA-N 2 0 326.528 4.479 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2cccc(Br)c2)CC1 ZINC000467872920 1026788556 /nfs/dbraw/zinc/78/85/56/1026788556.db2.gz FRLMMJQBEMCMOF-CQSZACIVSA-N 2 0 339.321 4.222 20 0 EIADRP CCc1cnccc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12 ZINC000507498290 1026812734 /nfs/dbraw/zinc/81/27/34/1026812734.db2.gz UXBRHBDLRBXQHR-HQAQVQPGSA-N 2 0 349.522 4.205 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C[C@@]2(C(C)(C)C)CC[N@H+](Cc3ccccc3)C2)CCO1 ZINC000638799909 1026862336 /nfs/dbraw/zinc/86/23/36/1026862336.db2.gz LSQTZDRTOQXONF-CBQOVEMMSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@H]2CCCc3cccnc32)C1 ZINC000684953662 1026888620 /nfs/dbraw/zinc/88/86/20/1026888620.db2.gz QQSJSTXCMJWDET-GCJKJVERSA-N 2 0 349.522 4.481 20 0 EIADRP CC1CC[NH+](Cc2cccc(C[NH2+][C@@H]3CCCc4cccnc43)c2)CC1 ZINC000684956085 1026892580 /nfs/dbraw/zinc/89/25/80/1026892580.db2.gz YZGBFFFZWJQVQD-JOCHJYFZSA-N 2 0 349.522 4.481 20 0 EIADRP CC(C)CC[C@@H]1CC[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C1 ZINC000657538349 1026995991 /nfs/dbraw/zinc/99/59/91/1026995991.db2.gz ZORLYHKDAKLIRF-UYAOXDASSA-N 2 0 336.564 4.072 20 0 EIADRP CS[C@H](C[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)C(C)(C)C ZINC000544365369 1027141748 /nfs/dbraw/zinc/14/17/48/1027141748.db2.gz IBLJJVXSEOETIV-BPQIPLTHSA-N 2 0 326.594 4.397 20 0 EIADRP CCOC1CCC([NH2+][C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168036226 1027152056 /nfs/dbraw/zinc/15/20/56/1027152056.db2.gz UPKTYJQKFCTTPJ-PYOJYGLTSA-N 2 0 344.543 4.365 20 0 EIADRP C[C@H]1CC([NH2+]CCCOC(C)(C)C)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168037721 1027271940 /nfs/dbraw/zinc/27/19/40/1027271940.db2.gz ZUQOWVGLFCCXOS-ROUUACIJSA-N 2 0 332.532 4.223 20 0 EIADRP CC[C@@H](C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccc1 ZINC000657613234 1027288350 /nfs/dbraw/zinc/28/83/50/1027288350.db2.gz JKDZIKBDWFVJCZ-NRFANRHFSA-N 2 0 337.511 4.077 20 0 EIADRP c1cc(C[NH+]2CCC(C[NH2+]Cc3ccc(C4CCC4)cc3)CC2)ccn1 ZINC000657613872 1027307338 /nfs/dbraw/zinc/30/73/38/1027307338.db2.gz VDFLUWRQHMBPQP-UHFFFAOYSA-N 2 0 349.522 4.351 20 0 EIADRP Clc1cc2cccnc2c(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000054317139 1027309198 /nfs/dbraw/zinc/30/91/98/1027309198.db2.gz GAVQRGOVQRUWCR-UHFFFAOYSA-N 2 0 343.902 4.196 20 0 EIADRP Cc1cc(NC[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)c(F)c2)cc[nH+]1 ZINC000302504982 1027322879 /nfs/dbraw/zinc/32/28/79/1027322879.db2.gz WBRVNHILBAMCQG-KSSFIOAISA-N 2 0 333.838 4.287 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(F)c(F)c1 ZINC000112518301 1027580002 /nfs/dbraw/zinc/58/00/02/1027580002.db2.gz JIRUASIORHBROA-HNNXBMFYSA-N 2 0 330.422 4.411 20 0 EIADRP CC(C)OC1CCC([NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)CC1 ZINC000090771515 1027592658 /nfs/dbraw/zinc/59/26/58/1027592658.db2.gz AHSNWPQVUIUGER-CZOVOBHWSA-N 2 0 336.564 4.355 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2oc(C(C)C)nc2C)CC1 ZINC000428364805 1027698062 /nfs/dbraw/zinc/69/80/62/1027698062.db2.gz TTYSIBLPTFPBHQ-UHFFFAOYSA-N 2 0 335.536 4.440 20 0 EIADRP CCOC[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000474874641 1027716674 /nfs/dbraw/zinc/71/66/74/1027716674.db2.gz BVESUQMUTGBEAR-GBAJDQEWSA-N 2 0 344.543 4.082 20 0 EIADRP Clc1ccc(CCCC[NH2+][C@H]2CCn3ccnc3C2)cc1Cl ZINC000474922598 1027802986 /nfs/dbraw/zinc/80/29/86/1027802986.db2.gz GPVOGBSUYQKIRD-AWEZNQCLSA-N 2 0 338.282 4.117 20 0 EIADRP CCc1cccc(F)c1C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000474938057 1027815821 /nfs/dbraw/zinc/81/58/21/1027815821.db2.gz DSUKXCJTZMRMRF-UHFFFAOYSA-N 2 0 341.474 4.132 20 0 EIADRP COCCC1(C[NH2+]C2CC[NH+](CC3CCCC3)CC2)CCCCC1 ZINC000189097617 1028068939 /nfs/dbraw/zinc/06/89/39/1028068939.db2.gz IMUKUQHXPUBIIY-UHFFFAOYSA-N 2 0 336.564 4.218 20 0 EIADRP COc1cc([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)ccc1SC ZINC000123686281 1028091317 /nfs/dbraw/zinc/09/13/17/1028091317.db2.gz DWWOCEOSFWKKRN-OAHLLOKOSA-N 2 0 344.524 4.330 20 0 EIADRP c1ccc2c(c1)cccc2OCC[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000523452280 1028103697 /nfs/dbraw/zinc/10/36/97/1028103697.db2.gz HOQUMLOSRGCCQA-FQEVSTJZSA-N 2 0 338.495 4.169 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C)CCCCc1ccccc1 ZINC000346149404 1028282409 /nfs/dbraw/zinc/28/24/09/1028282409.db2.gz WYHTVZXHXDKVTE-UHFFFAOYSA-N 2 0 334.467 4.030 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C1CC1)[C@@H]1CCc2ccccc21 ZINC000346174936 1028305881 /nfs/dbraw/zinc/30/58/81/1028305881.db2.gz NDGDSKISBYBQGQ-JOCHJYFZSA-N 2 0 344.462 4.228 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1F ZINC000162910416 1028532146 /nfs/dbraw/zinc/53/21/46/1028532146.db2.gz GZWYJEAGFWROOU-MRXNPFEDSA-N 2 0 342.458 4.281 20 0 EIADRP [NH3+]C1CC[NH+](Cc2cccc(-c3cccc(C(F)(F)F)c3)c2)CC1 ZINC000629696218 1028624893 /nfs/dbraw/zinc/62/48/93/1028624893.db2.gz WARZJPFPMOZBKM-UHFFFAOYSA-N 2 0 334.385 4.296 20 0 EIADRP C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1N1CC[NH+](C)CC1)c1cccs1 ZINC000126685542 1028657215 /nfs/dbraw/zinc/65/72/15/1028657215.db2.gz ROIDWCALHJENED-HUUCEWRRSA-N 2 0 347.503 4.051 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)CC[N@@H+]1C ZINC000443983780 1028691849 /nfs/dbraw/zinc/69/18/49/1028691849.db2.gz FXZFFQDJODLJKW-YJBOKZPZSA-N 2 0 328.431 4.190 20 0 EIADRP C[C@H](CC[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1)[NH+]1CCCCC1 ZINC000346882766 1028799211 /nfs/dbraw/zinc/79/92/11/1028799211.db2.gz YYGODXWHFVDQIZ-DYXWJJEUSA-N 2 0 330.516 4.008 20 0 EIADRP Cc1cc(OC(F)F)ccc1-c1cccc(C[NH+]2CCC([NH3+])CC2)c1 ZINC000629737185 1028813962 /nfs/dbraw/zinc/81/39/62/1028813962.db2.gz ZOOILMUPHFCGHS-UHFFFAOYSA-N 2 0 346.421 4.187 20 0 EIADRP C[C@H]([NH2+]CCSCc1ccccc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000192637927 1028867254 /nfs/dbraw/zinc/86/72/54/1028867254.db2.gz MMFSLYUYMOXJKV-PKOBYXMFSA-N 2 0 332.557 4.162 20 0 EIADRP C[C@H](C[NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(C(F)(F)F)cc1 ZINC000650716755 1028870440 /nfs/dbraw/zinc/87/04/40/1028870440.db2.gz INQBRJWUORLYGH-GFCCVEGCSA-N 2 0 340.364 4.197 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@H](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000281815923 1028874172 /nfs/dbraw/zinc/87/41/72/1028874172.db2.gz ZIMNZMAMIVUGKS-CQSZACIVSA-N 2 0 328.422 4.099 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cnc(-c2ccco2)s1 ZINC000278395103 1029103309 /nfs/dbraw/zinc/10/33/09/1029103309.db2.gz MYZJOTPYWWUYFT-OAHLLOKOSA-N 2 0 333.501 4.147 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](C[C@@H]3CC[C@H]([NH3+])[C@H](C)C3)C[C@@H]2C)CCO1 ZINC001168087488 1029184791 /nfs/dbraw/zinc/18/47/91/1029184791.db2.gz LYMXSDHTMGCEQE-OUOVREQUSA-N 2 0 336.564 4.102 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCCSc2ccc(OC)cc21 ZINC000650756667 1029195089 /nfs/dbraw/zinc/19/50/89/1029195089.db2.gz HMUFTGKTSFQFGM-LJQANCHMSA-N 2 0 342.508 4.131 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCSCc1cccc2ccccc21 ZINC000151160701 1029209010 /nfs/dbraw/zinc/20/90/10/1029209010.db2.gz FCQMNYNJJPNSKN-JXFKEZNVSA-N 2 0 328.525 4.003 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[NH2+]C)c1ccc(OC(F)F)cc1 ZINC000650759097 1029221092 /nfs/dbraw/zinc/22/10/92/1029221092.db2.gz CWPZGAYZXXCJNT-SFHVURJKSA-N 2 0 334.410 4.248 20 0 EIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC2CC[NH2+]CC2)CCC3)cc1 ZINC000650764166 1029280569 /nfs/dbraw/zinc/28/05/69/1029280569.db2.gz RLBVWGBDZGCCMY-QGZVFWFLSA-N 2 0 341.524 4.167 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C2CCC(OC)CC2)ccc1OC ZINC000840793211 1029343544 /nfs/dbraw/zinc/34/35/44/1029343544.db2.gz QOYDNONKRIBIAX-DZIBYMRMSA-N 2 0 348.531 4.145 20 0 EIADRP COC1CCC(C)(C[NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)CC1 ZINC000475211955 1029445477 /nfs/dbraw/zinc/44/54/77/1029445477.db2.gz CPAWARYNNYWMPT-GUSVMJMASA-N 2 0 336.564 4.214 20 0 EIADRP FC(F)(F)C1CCC(C[NH2+]CC2CC[NH+](CC3CC3)CC2)CC1 ZINC000657813654 1029459805 /nfs/dbraw/zinc/45/98/05/1029459805.db2.gz WOKHCRXDAWMCNH-UHFFFAOYSA-N 2 0 332.454 4.067 20 0 EIADRP C[C@@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(OC(F)(F)F)cc1 ZINC000623348124 1029547252 /nfs/dbraw/zinc/54/72/52/1029547252.db2.gz SIAIYKUISMMJOZ-OCCSQVGLSA-N 2 0 330.394 4.109 20 0 EIADRP C[C@@H]1CCC[C@H]([NH2+]C2CC(N3CCC(C(F)(F)F)CC3)C2)[C@H]1C ZINC000475352773 1029566245 /nfs/dbraw/zinc/56/62/45/1029566245.db2.gz JAPIRBXHSGZGFP-KTQJEEDSSA-N 2 0 332.454 4.206 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H](c2ccccc2)c2ccc3ccccc3n2)C1 ZINC000584047450 1029566739 /nfs/dbraw/zinc/56/67/39/1029566739.db2.gz AGWTUCCHIUINKR-WGGBDISSSA-N 2 0 345.490 4.431 20 0 EIADRP C[C@@H]1C[C@@H]([NH+](C)CC2CC(F)(F)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168063900 1029616219 /nfs/dbraw/zinc/61/62/19/1029616219.db2.gz NUYPBONUNMUUME-HGKCTWBKSA-N 2 0 336.470 4.405 20 0 EIADRP c1ccc(CC[C@@H]2CCC[C@@H]2[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446886672 1029632094 /nfs/dbraw/zinc/63/20/94/1029632094.db2.gz IMYCMTKOADSGHE-UNMCSNQZSA-N 2 0 326.528 4.252 20 0 EIADRP c1ccc(CC(Cc2ccccc2)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446890189 1029632879 /nfs/dbraw/zinc/63/28/79/1029632879.db2.gz HOCTUZNUXQQXIF-UHFFFAOYSA-N 2 0 348.534 4.304 20 0 EIADRP C[NH2+]Cc1cccc(NC2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001168065245 1029646229 /nfs/dbraw/zinc/64/62/29/1029646229.db2.gz VEXHEPXBITZBLO-QZTJIDSGSA-N 2 0 337.511 4.260 20 0 EIADRP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000657834014 1029668269 /nfs/dbraw/zinc/66/82/69/1029668269.db2.gz IDFGTPBPGJVEKP-DOTOQJQBSA-N 2 0 340.433 4.100 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]C2CC(CF)(CF)C2)C1 ZINC000657838665 1029716418 /nfs/dbraw/zinc/71/64/18/1029716418.db2.gz WYPYFDUQKDYYKE-MRXNPFEDSA-N 2 0 336.470 4.096 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000708510419 1029742859 /nfs/dbraw/zinc/74/28/59/1029742859.db2.gz JXVSRBSVBCUHFN-OXJNMPFZSA-N 2 0 344.449 4.482 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNCc1ccc(Cl)cc1F ZINC000708519307 1029743156 /nfs/dbraw/zinc/74/31/56/1029743156.db2.gz HNRPWTURFWUPRO-MAUKXSAKSA-N 2 0 346.877 4.337 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(Cl)s1 ZINC000708528743 1029812974 /nfs/dbraw/zinc/81/29/74/1029812974.db2.gz IGKGJNJDPDFCDV-HOCLYGCPSA-N 2 0 334.916 4.259 20 0 EIADRP c1cc2c(s1)CCC[C@@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000089215571 1029846467 /nfs/dbraw/zinc/84/64/67/1029846467.db2.gz LKQKFUOWVUTGKK-SFHVURJKSA-N 2 0 327.497 4.027 20 0 EIADRP FC(F)c1ccc(C[NH2+]C[C@H]2CCCN2Cc2ccccc2)cc1 ZINC000390550049 1029959355 /nfs/dbraw/zinc/95/93/55/1029959355.db2.gz BUNJQLSWNZDWGS-LJQANCHMSA-N 2 0 330.422 4.378 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(C(F)F)nc1 ZINC000657876414 1030150730 /nfs/dbraw/zinc/15/07/30/1030150730.db2.gz BLBRZLTYARHMPN-OAHLLOKOSA-N 2 0 325.447 4.326 20 0 EIADRP COc1ccc2oc([C@@H](C)[NH2+]CC3CC[NH+](C4CC4)CC3)c(C)c2c1 ZINC000447570922 1030153941 /nfs/dbraw/zinc/15/39/41/1030153941.db2.gz IDSPDRCFNIEKOA-OAHLLOKOSA-N 2 0 342.483 4.275 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(Br)c(Cl)c1 ZINC000657877304 1030154463 /nfs/dbraw/zinc/15/44/63/1030154463.db2.gz PUYOODWCPKWMGA-VXGBXAGGSA-N 2 0 345.712 4.095 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1nc(-c2ccccc2)cs1 ZINC000447571453 1030158911 /nfs/dbraw/zinc/15/89/11/1030158911.db2.gz KEKAAJCBCWKFAY-OAHLLOKOSA-N 2 0 341.524 4.335 20 0 EIADRP Cc1[nH]c2ccc(F)cc2c1CC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000530221291 1030216330 /nfs/dbraw/zinc/21/63/30/1030216330.db2.gz OWOYZLQOHLVMQA-DFQSSKMNSA-N 2 0 343.490 4.058 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]C2CC(c3cc(F)cc(F)c3)C2)C1 ZINC000685421386 1030298166 /nfs/dbraw/zinc/29/81/66/1030298166.db2.gz CSCKROIEMRIMPL-XRTORIHISA-N 2 0 336.470 4.313 20 0 EIADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(OCc2ccccc2)cc1 ZINC000392263985 1030332195 /nfs/dbraw/zinc/33/21/95/1030332195.db2.gz LDILFFDDEFKRBG-GOSISDBHSA-N 2 0 336.479 4.178 20 0 EIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000685455209 1030338510 /nfs/dbraw/zinc/33/85/10/1030338510.db2.gz JCNOLGUBXHZBKJ-HUUCEWRRSA-N 2 0 328.422 4.129 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1cccc2cccnc21 ZINC000708571136 1030391895 /nfs/dbraw/zinc/39/18/95/1030391895.db2.gz QRYGAPPCCUQJCV-GCJKJVERSA-N 2 0 345.490 4.093 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ncc(C(C)(C)C)s2)C1 ZINC000447939244 1030432456 /nfs/dbraw/zinc/43/24/56/1030432456.db2.gz JMDYOHQHSGEEFU-IYBDPMFKSA-N 2 0 337.577 4.288 20 0 EIADRP CCOC1CCC([NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000657907436 1030455643 /nfs/dbraw/zinc/45/56/43/1030455643.db2.gz LUOSNXNSQHMMSV-DXHCPDEFSA-N 2 0 344.543 4.080 20 0 EIADRP C[C@@H](C[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(F)cc1 ZINC000527111372 1030500729 /nfs/dbraw/zinc/50/07/29/1030500729.db2.gz UAGPOEQRTIZNDO-ICSRJNTNSA-N 2 0 340.486 4.083 20 0 EIADRP Cc1ccc(C[C@H]([NH2+]CCc2cncn2C)c2ccc(C)cc2)cc1 ZINC000530513312 1030504055 /nfs/dbraw/zinc/50/40/55/1030504055.db2.gz FUXBJSWQEFVWJW-QFIPXVFZSA-N 2 0 333.479 4.153 20 0 EIADRP Cc1c([C@H](C)NC2CC[NH+](C3CCCCC3)CC2)cnn1C(C)C ZINC000191325741 1030617353 /nfs/dbraw/zinc/61/73/53/1030617353.db2.gz MBGSLERZSIJHSX-INIZCTEOSA-N 2 0 332.536 4.220 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c3cccnc23)C[C@H]1C ZINC000530663210 1030617604 /nfs/dbraw/zinc/61/76/04/1030617604.db2.gz YNSHKOXVEPOUSC-GDBMZVCRSA-N 2 0 331.891 4.193 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCOc2ccc3ccccc3c2)C[C@H]1C ZINC000530662946 1030618099 /nfs/dbraw/zinc/61/80/99/1030618099.db2.gz RXDWRDXVDHATOU-XLIONFOSSA-N 2 0 326.484 4.023 20 0 EIADRP CCN1CCC([N@H+](C)CCCOc2cccc3ccccc32)CC1 ZINC000530666383 1030619422 /nfs/dbraw/zinc/61/94/22/1030619422.db2.gz WRLHZGTWSPDFMY-UHFFFAOYSA-N 2 0 326.484 4.025 20 0 EIADRP COCC1(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CCCCC1 ZINC000685665274 1030664792 /nfs/dbraw/zinc/66/47/92/1030664792.db2.gz QERVGKLNGHBMDL-PZJWPPBQSA-N 2 0 344.543 4.084 20 0 EIADRP Cc1nccn1CCCC[N@@H+]1CCCC[C@@H]1c1nc2ccccc2[nH]1 ZINC000451878312 1030756683 /nfs/dbraw/zinc/75/66/83/1030756683.db2.gz MJVXPJVWZFUZCY-LJQANCHMSA-N 2 0 337.471 4.075 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2ccsc2C(F)(F)F)c1 ZINC000527634866 1030791764 /nfs/dbraw/zinc/79/17/64/1030791764.db2.gz SEHNJFAJIDOMOB-UHFFFAOYSA-N 2 0 328.403 4.118 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H]2CCC[C@@H](c3ccccc3)CC2)CC1 ZINC000527652805 1030811627 /nfs/dbraw/zinc/81/16/27/1030811627.db2.gz LGZYZEVBYSWGAM-NHCUHLMSSA-N 2 0 344.543 4.193 20 0 EIADRP C[C@@H]([C@H](C)[NH2+]CC1CC[NH+](C2CCOCC2)CC1)C1CCCCC1 ZINC000658066998 1030811838 /nfs/dbraw/zinc/81/18/38/1030811838.db2.gz JHHIDCNEAXLQAT-ROUUACIJSA-N 2 0 336.564 4.072 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H]2CCC[C@@H](c3ccccc3)CC2)CC1 ZINC000527652806 1030811962 /nfs/dbraw/zinc/81/19/62/1030811962.db2.gz LGZYZEVBYSWGAM-RTWAWAEBSA-N 2 0 344.543 4.193 20 0 EIADRP C[C@@H](C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)c1ccccn1 ZINC000658067629 1030814344 /nfs/dbraw/zinc/81/43/44/1030814344.db2.gz XCNRKCOFTRETBV-KRWDZBQOSA-N 2 0 331.548 4.454 20 0 EIADRP Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658165410 1030863238 /nfs/dbraw/zinc/86/32/38/1030863238.db2.gz JJXMOPFVKZXLCA-PGRDOPGGSA-N 2 0 349.522 4.440 20 0 EIADRP CC(C)[C@H]1CCCC[C@H]1[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658168346 1030865478 /nfs/dbraw/zinc/86/54/78/1030865478.db2.gz WFJMFANYZRDFMI-NHCUHLMSSA-N 2 0 329.532 4.098 20 0 EIADRP C[C@]1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@H]32)CC1(F)F ZINC000658219635 1030885155 /nfs/dbraw/zinc/88/51/55/1030885155.db2.gz CJANBTSUOQPLGU-WJFTUGDTSA-N 2 0 334.454 4.065 20 0 EIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2c[nH]c3ccccc23)CC1 ZINC000532441705 1031071369 /nfs/dbraw/zinc/07/13/69/1031071369.db2.gz CJZVIYWCAXKUPU-JTSKRJEESA-N 2 0 339.527 4.343 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCSCc1cccc2ccccc21 ZINC000532477057 1031204162 /nfs/dbraw/zinc/20/41/62/1031204162.db2.gz MPKQUSUOBDUGEJ-CBGDNZLLSA-N 2 0 342.552 4.391 20 0 EIADRP CC[N@@H+](Cc1cc2cccnc2o1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000449038588 1031375053 /nfs/dbraw/zinc/37/50/53/1031375053.db2.gz VYPNWYRPLNDNKY-LJQANCHMSA-N 2 0 349.478 4.172 20 0 EIADRP C[C@H](CCc1ccco1)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449059243 1031390774 /nfs/dbraw/zinc/39/07/74/1031390774.db2.gz PDRWXWFVJPCYFN-MOPGFXCFSA-N 2 0 340.511 4.286 20 0 EIADRP CC1CC[NH+](Cc2ccc(C[NH2+]Cc3cc4cccnc4o3)cc2)CC1 ZINC000449069547 1031422213 /nfs/dbraw/zinc/42/22/13/1031422213.db2.gz GWMLZJIRAMUQBQ-UHFFFAOYSA-N 2 0 349.478 4.350 20 0 EIADRP c1c2cccnc2oc1C[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000449107724 1031447265 /nfs/dbraw/zinc/44/72/65/1031447265.db2.gz RBRYYFUIVRQFNL-UHFFFAOYSA-N 2 0 349.478 4.494 20 0 EIADRP Cc1cc2c(cc1C)[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)CCCO2 ZINC000123660754 1031477768 /nfs/dbraw/zinc/47/77/68/1031477768.db2.gz QWBNFKILVCRLGK-OAQYLSRUSA-N 2 0 338.495 4.369 20 0 EIADRP CC(C)C[C@@H](CCO)C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449172983 1031493807 /nfs/dbraw/zinc/49/38/07/1031493807.db2.gz KPUXMWGDEZIJHI-GOSISDBHSA-N 2 0 340.596 4.300 20 0 EIADRP COC1CCC(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CC1 ZINC000449177485 1031497043 /nfs/dbraw/zinc/49/70/43/1031497043.db2.gz PQYSOEYFDVKBIK-UHFFFAOYSA-N 2 0 338.580 4.460 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc2c(c1)OCCCO2 ZINC000531718290 1031517679 /nfs/dbraw/zinc/51/76/79/1031517679.db2.gz YCOWLHUHOUIXKB-SFHVURJKSA-N 2 0 346.515 4.155 20 0 EIADRP COc1cccc(-c2ccc(C[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@@H]3C)cc2)c1 ZINC000531725043 1031525964 /nfs/dbraw/zinc/52/59/64/1031525964.db2.gz GKOGDKVOLNRRMT-GSHUGGBRSA-N 2 0 338.495 4.181 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2cc3cccnc3o2)C[N@@H+]1Cc1ccccc1 ZINC000449217118 1031551686 /nfs/dbraw/zinc/55/16/86/1031551686.db2.gz WZNDHCAMSUOETM-MJGOQNOKSA-N 2 0 349.478 4.218 20 0 EIADRP COc1cc(C)ccc1C[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000449218384 1031551732 /nfs/dbraw/zinc/55/17/32/1031551732.db2.gz HUIOWSSHNJGUKG-UHFFFAOYSA-N 2 0 326.484 4.134 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](C)c1cc(F)cc(F)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000449232834 1031565115 /nfs/dbraw/zinc/56/51/15/1031565115.db2.gz JGOXTYFLVQFORB-OAGGEKHMSA-N 2 0 336.470 4.311 20 0 EIADRP Cc1nccn1CCC[N@@H+](CC(C)C)[C@H]1CCCc2cccnc21 ZINC000126884622 1031666427 /nfs/dbraw/zinc/66/64/27/1031666427.db2.gz RIHFREFOVVWDQO-IBGZPJMESA-N 2 0 326.488 4.012 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C2CC2)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000188733730 1031761303 /nfs/dbraw/zinc/76/13/03/1031761303.db2.gz SBMNVBHJNMXTMC-KRWDZBQOSA-N 2 0 338.495 4.355 20 0 EIADRP Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)ccc1F ZINC000453261491 1031785629 /nfs/dbraw/zinc/78/56/29/1031785629.db2.gz RTHJFZBCKPBHMT-DLBZAZTESA-N 2 0 344.474 4.486 20 0 EIADRP Cc1ccc(-c2ncc(C[NH2+]C(C)(C)CCC[NH+](C)C)s2)cc1 ZINC000449526777 1031822185 /nfs/dbraw/zinc/82/21/85/1031822185.db2.gz FQUOTQCOOOYFOQ-UHFFFAOYSA-N 2 0 331.529 4.329 20 0 EIADRP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449560532 1031847451 /nfs/dbraw/zinc/84/74/51/1031847451.db2.gz MHYGMZJLCYFGNS-RLAWYHOSSA-N 2 0 327.299 4.139 20 0 EIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+]CCCC[NH+](C)C)cc1 ZINC000531962915 1031881170 /nfs/dbraw/zinc/88/11/70/1031881170.db2.gz IBEPXVVIHRGLSJ-OAQYLSRUSA-N 2 0 344.474 4.050 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000531972412 1031909181 /nfs/dbraw/zinc/90/91/81/1031909181.db2.gz RIVLNIKSUXKXEW-DYESRHJHSA-N 2 0 344.449 4.180 20 0 EIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cc1 ZINC000531972878 1031909667 /nfs/dbraw/zinc/90/96/67/1031909667.db2.gz BEMRBFRKIGSERO-RBUKOAKNSA-N 2 0 332.532 4.433 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2cccc(Br)c21 ZINC000453366821 1031910057 /nfs/dbraw/zinc/91/00/57/1031910057.db2.gz SWLNWJYQITZZPD-FVSUXCLVSA-N 2 0 349.316 4.212 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+]C1CCN(c2ccccc2)CC1 ZINC000531979748 1031922630 /nfs/dbraw/zinc/92/26/30/1031922630.db2.gz OPTABOOIXBGRHC-UGKGYDQZSA-N 2 0 343.559 4.146 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2ccc(Br)cc2)CC1 ZINC000531980674 1031926055 /nfs/dbraw/zinc/92/60/55/1031926055.db2.gz SGPUQZZOAWTDCJ-AWEZNQCLSA-N 2 0 339.321 4.222 20 0 EIADRP CN(C)Cc1cnc(C[NH2+]C[C@@H]2CCCC[C@H]2c2ccccc2)s1 ZINC000449687742 1031941452 /nfs/dbraw/zinc/94/14/52/1031941452.db2.gz DKIZHJPMJYGJFC-HKUYNNGSSA-N 2 0 343.540 4.268 20 0 EIADRP Cc1cccc([C@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)c1 ZINC000453408963 1031943357 /nfs/dbraw/zinc/94/33/57/1031943357.db2.gz WDWORXQOQJFWLT-ZWKOTPCHSA-N 2 0 326.484 4.347 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]C[C@H]2CCOC(C)(C)C2)cc1 ZINC000453417285 1031952059 /nfs/dbraw/zinc/95/20/59/1031952059.db2.gz KCOWSAHJEAKWAT-WBVHZDCISA-N 2 0 327.472 4.037 20 0 EIADRP FC1(F)CC(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000453416160 1031952256 /nfs/dbraw/zinc/95/22/56/1031952256.db2.gz JYGYILBCTVHSHX-REPLKXPHSA-N 2 0 334.454 4.207 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000531994304 1031962886 /nfs/dbraw/zinc/96/28/86/1031962886.db2.gz UPQSPABHJAUTHG-DENIHFKCSA-N 2 0 344.543 4.226 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C1(C(C)(C)c2ccccc2)CC1 ZINC000449727045 1031963318 /nfs/dbraw/zinc/96/33/18/1031963318.db2.gz ZAJFIKVVFMTHLA-UHFFFAOYSA-N 2 0 346.478 4.176 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCC2CC(F)(F)C2)CC1 ZINC000453428131 1031981325 /nfs/dbraw/zinc/98/13/25/1031981325.db2.gz PMXIWDGWOFUOIR-UHFFFAOYSA-N 2 0 336.470 4.455 20 0 EIADRP c1cc(C[N@@H+](Cc2ccncc2)C2CC2)cc(C[NH+]2CCCCC2)c1 ZINC000411426717 1033884189 /nfs/dbraw/zinc/88/41/89/1033884189.db2.gz YUJWYDZRRCRFML-UHFFFAOYSA-N 2 0 335.495 4.232 20 0 EIADRP c1ccc(C[NH+]2CCC3(CC[N@@H+](CCCc4ccncc4)C3)CC2)cc1 ZINC000433172338 1033979056 /nfs/dbraw/zinc/97/90/56/1033979056.db2.gz HFBOAQTXKZMGCD-UHFFFAOYSA-N 2 0 349.522 4.002 20 0 EIADRP FC(F)(F)Oc1ccccc1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC000500913312 1034091744 /nfs/dbraw/zinc/09/17/44/1034091744.db2.gz BOIQKMCGXYYYNE-UHFFFAOYSA-N 2 0 344.421 4.331 20 0 EIADRP Cc1ncoc1C[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000894169853 1034530943 /nfs/dbraw/zinc/53/09/43/1034530943.db2.gz JWZLBDFTORRGBD-UHFFFAOYSA-N 2 0 335.451 4.001 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2ccc(Cl)o2)C[N@@H+]1Cc1ccccc1 ZINC000513501546 1034999283 /nfs/dbraw/zinc/99/92/83/1034999283.db2.gz TVTQRHXIURNJQL-WBVHZDCISA-N 2 0 332.875 4.323 20 0 EIADRP C[N@H+](CCCc1cccc(F)c1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501054159 1035362336 /nfs/dbraw/zinc/36/23/36/1035362336.db2.gz UGPRSDKQKBNREG-UHFFFAOYSA-N 2 0 341.474 4.002 20 0 EIADRP C[N@H+](CCC[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1)C1CCCCC1 ZINC000501379494 1035436429 /nfs/dbraw/zinc/43/64/29/1035436429.db2.gz BBZVFUPJFKATMS-QUCCMNQESA-N 2 0 329.532 4.352 20 0 EIADRP CCc1cc(OC)ccc1C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000501420668 1035441929 /nfs/dbraw/zinc/44/19/29/1035441929.db2.gz IHHSUHNHIBSFLW-UHFFFAOYSA-N 2 0 338.495 4.143 20 0 EIADRP c1cncc([C@H]2CCC[C@@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)c1 ZINC000501454082 1035448477 /nfs/dbraw/zinc/44/84/77/1035448477.db2.gz UDFJQBGPAJORMW-GHTZIAJQSA-N 2 0 341.543 4.495 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]CC1CC[NH+](C)CC1 ZINC000501468739 1035449015 /nfs/dbraw/zinc/44/90/15/1035449015.db2.gz SCCZIPVYUMKGEO-SDNWHVSQSA-N 2 0 326.406 4.040 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000501466379 1035449598 /nfs/dbraw/zinc/44/95/98/1035449598.db2.gz JNXGAHNQKXKFCR-YYKIQEHNSA-N 2 0 326.406 4.181 20 0 EIADRP FC(F)(F)c1cccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000261818054 1035482842 /nfs/dbraw/zinc/48/28/42/1035482842.db2.gz WIZAOJBFLINDQT-YESZJQIVSA-N 2 0 326.406 4.106 20 0 EIADRP c1csc(C[N@@H+](CCCC2CCCC2)[C@@H]2CC23CC[NH2+]CC3)n1 ZINC000420319151 1035512781 /nfs/dbraw/zinc/51/27/81/1035512781.db2.gz XESXRUHOFXCLRU-QGZVFWFLSA-N 2 0 333.545 4.058 20 0 EIADRP c1csc([C@H]2c3ccsc3CC[N@H+]2CC[C@H]2CCC[NH2+]C2)c1 ZINC000420320521 1035513628 /nfs/dbraw/zinc/51/36/28/1035513628.db2.gz QKXLOIGOHNMZMQ-RDTXWAMCSA-N 2 0 332.538 4.147 20 0 EIADRP C[C@H](c1ccc2ccccc2c1)[NH+]1CCC([C@@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000420383849 1035559726 /nfs/dbraw/zinc/55/97/26/1035559726.db2.gz FWFZXRZVOGUHEE-XGRCMKMKSA-N 2 0 338.495 4.119 20 0 EIADRP c1cnc2c(c1)cccc2C[N@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491053936 1035796972 /nfs/dbraw/zinc/79/69/72/1035796972.db2.gz ACMSWCCASFFPOM-IBGZPJMESA-N 2 0 337.511 4.323 20 0 EIADRP Clc1cccc(Cl)c1CCC[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000666993796 1035826722 /nfs/dbraw/zinc/82/67/22/1035826722.db2.gz KBTTVXHZTZVTAU-CYBMUJFWSA-N 2 0 327.299 4.190 20 0 EIADRP C[C@@H](CC[NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccc1 ZINC000668512604 1036011213 /nfs/dbraw/zinc/01/12/13/1036011213.db2.gz OFTPFSHYLLXXTN-IBGZPJMESA-N 2 0 337.511 4.077 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H](C)c2cnn(C3CCCC3)c2)CC1 ZINC000502483112 1036263805 /nfs/dbraw/zinc/26/38/05/1036263805.db2.gz UCIDAAOBBLFIQR-GOSISDBHSA-N 2 0 346.563 4.407 20 0 EIADRP C[C@@H](CCc1ccc(OC(F)F)cc1)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421365790 1036312120 /nfs/dbraw/zinc/31/21/20/1036312120.db2.gz BCZHLHNBOYPGSF-OOHWJJMZSA-N 2 0 340.458 4.072 20 0 EIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421375485 1036324791 /nfs/dbraw/zinc/32/47/91/1036324791.db2.gz PFSRKWYWGKKVQI-WYMLVPIESA-N 2 0 338.442 4.154 20 0 EIADRP C[C@H](NCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502683277 1036501966 /nfs/dbraw/zinc/50/19/66/1036501966.db2.gz IPBDNSKAWDHTIS-KSZLIROESA-N 2 0 332.536 4.017 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000502696047 1036515583 /nfs/dbraw/zinc/51/55/83/1036515583.db2.gz BMJSLHZGLUHBPA-COPCDDAFSA-N 2 0 344.543 4.213 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1 ZINC000502725582 1036583746 /nfs/dbraw/zinc/58/37/46/1036583746.db2.gz XUVKLZSTDGHCGE-DXIQSLLYSA-N 2 0 344.543 4.213 20 0 EIADRP Clc1ccc([C@@H](C[NH2+]C2CC[NH+](CC3CC3)CC2)C2CC2)cc1 ZINC001168370966 1036710466 /nfs/dbraw/zinc/71/04/66/1036710466.db2.gz JDQQIDFYOMRORT-FQEVSTJZSA-N 2 0 332.919 4.298 20 0 EIADRP COc1ccc([C@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)C(C)C)c(F)c1 ZINC000421821081 1036773409 /nfs/dbraw/zinc/77/34/09/1036773409.db2.gz PJCXECNPHJEGEO-OAQYLSRUSA-N 2 0 344.474 4.383 20 0 EIADRP COc1ccc([C@H]([NH2+]Cc2cccc(C[NH+](C)C)c2)C(C)C)c(F)c1 ZINC000421819390 1036774869 /nfs/dbraw/zinc/77/48/69/1036774869.db2.gz GWCXKSSQVSSKSC-OAQYLSRUSA-N 2 0 344.474 4.383 20 0 EIADRP C[C@@H]([NH2+]Cc1cc2ccc(F)cc2[nH]1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000486719641 1036826456 /nfs/dbraw/zinc/82/64/56/1036826456.db2.gz HMXVBOGXCOTLFH-ZBFHGGJFSA-N 2 0 329.463 4.050 20 0 EIADRP COc1ccc([C@H]2CCCC[C@H]2[NH2+]C2CCC([NH+](C)C)CC2)cc1F ZINC000421887438 1036835788 /nfs/dbraw/zinc/83/57/88/1036835788.db2.gz VWQJYOPAKIMJNQ-SMRJSYMMSA-N 2 0 348.506 4.323 20 0 EIADRP CC(C)(C)C[NH+]1CCC(C[NH2+][C@@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168414453 1036837881 /nfs/dbraw/zinc/83/78/81/1036837881.db2.gz GFQLEGGVTFGOAT-HXUWFJFHSA-N 2 0 332.507 4.031 20 0 EIADRP C/C(=C\c1cccc(C(F)(F)F)c1)C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000572849124 1036843846 /nfs/dbraw/zinc/84/38/46/1036843846.db2.gz HJSZLDZBDSSWJK-RVDMUPIBSA-N 2 0 340.433 4.382 20 0 EIADRP CCOc1ccc([C@@H]2CCC[N@@H+]2C2CC[NH+](CC3CC3)CC2)cc1 ZINC001168392695 1036853181 /nfs/dbraw/zinc/85/31/81/1036853181.db2.gz SBRLOHALUCJXJE-NRFANRHFSA-N 2 0 328.500 4.097 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccc(CNCc3ccc(Cl)o3)cc2)C1 ZINC000589832004 1036878633 /nfs/dbraw/zinc/87/86/33/1036878633.db2.gz ULZRYFUVYBXSLB-HNNXBMFYSA-N 2 0 332.875 4.455 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]C/C=C/c1ccncc1 ZINC000486944395 1036898916 /nfs/dbraw/zinc/89/89/16/1036898916.db2.gz PMNQBJUKCOWGFW-FNQPIQQGSA-N 2 0 335.495 4.259 20 0 EIADRP Cc1ccsc1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499147374 1036926132 /nfs/dbraw/zinc/92/61/32/1036926132.db2.gz PXPXOHKJJSHVOD-REPLKXPHSA-N 2 0 326.509 4.342 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]C/C=C\c3ccncc3)cc2)C1 ZINC000486989682 1036939511 /nfs/dbraw/zinc/93/95/11/1036939511.db2.gz UUVHQLXZIUMBGJ-JGAFRWBPSA-N 2 0 349.522 4.363 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311088390 1037080408 /nfs/dbraw/zinc/08/04/08/1037080408.db2.gz NJNYOPFCJYHFPH-LVCYWYKZSA-N 2 0 340.486 4.257 20 0 EIADRP C[C@@]12CC3([NH3+])CC([NH2+][C@H]4CCc5cc(F)ccc5C4)(C1)C[C@](C)(C3)C2 ZINC001168415958 1037103429 /nfs/dbraw/zinc/10/34/29/1037103429.db2.gz ULJWOAZACYLWTD-JEDRFMAYSA-N 2 0 342.502 4.103 20 0 EIADRP Oc1ccc(C2CCC([NH2+]CC3CC[NH+](CC4CC4)CC3)CC2)cc1 ZINC000668784049 1037173184 /nfs/dbraw/zinc/17/31/84/1037173184.db2.gz ZUWCSONGSNALQJ-UHFFFAOYSA-N 2 0 342.527 4.130 20 0 EIADRP CC(C)(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cc(F)ccc2C1 ZINC001168417414 1037354466 /nfs/dbraw/zinc/35/44/66/1037354466.db2.gz PLMHUOKVEAGBSI-VAMGGRTRSA-N 2 0 332.507 4.301 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2cc3ccccc3[nH]2)CC1 ZINC000760831243 1037446577 /nfs/dbraw/zinc/44/65/77/1037446577.db2.gz XJUJRWLDEMORDH-LJQANCHMSA-N 2 0 325.500 4.222 20 0 EIADRP CC[N@@H+]1CCC[C@H](C[NH2+]C/C(C)=C/c2cccc(C(F)(F)F)c2)C1 ZINC000573596131 1037596576 /nfs/dbraw/zinc/59/65/76/1037596576.db2.gz CXUZOHUXCCXLCQ-IUYQLWOBSA-N 2 0 340.433 4.430 20 0 EIADRP C[C@H]([NH2+][C@@H]1CS[C@H](C(C)(C)C)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000488551028 1037663340 /nfs/dbraw/zinc/66/33/40/1037663340.db2.gz ZOHQJIUJKFPPCB-LEAZDLGRSA-N 2 0 346.584 4.407 20 0 EIADRP CC[C@@H](C(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)[NH+](CC)CC ZINC000605425138 1037779487 /nfs/dbraw/zinc/77/94/87/1037779487.db2.gz WFQOCXCEMFBPLS-XLIONFOSSA-N 2 0 345.531 4.120 20 0 EIADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000422710323 1037803581 /nfs/dbraw/zinc/80/35/81/1037803581.db2.gz LPRXBNVYFOUVQL-DOTOQJQBSA-N 2 0 346.446 4.023 20 0 EIADRP COC[C@H](CCC[NH3+])[NH2+][C@H](C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000422710326 1037804838 /nfs/dbraw/zinc/80/48/38/1037804838.db2.gz LPRXBNVYFOUVQL-WBVHZDCISA-N 2 0 346.446 4.023 20 0 EIADRP CCCC[C@H]([NH2+][C@H](C)c1ccc(C[NH3+])nc1C)c1ccc(OC)cc1 ZINC000422718074 1037813544 /nfs/dbraw/zinc/81/35/44/1037813544.db2.gz WLQZOFYBIUDOGF-IERDGZPVSA-N 2 0 341.499 4.439 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCc1ccc(Cl)cc1Cl ZINC000422727083 1037818082 /nfs/dbraw/zinc/81/80/82/1037818082.db2.gz GKNGTJYHMWLLBH-NSHDSACASA-N 2 0 338.282 4.049 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC1 ZINC000422769759 1037829188 /nfs/dbraw/zinc/82/91/88/1037829188.db2.gz PLKNDKZRBYQGJS-FAFZWHIHSA-N 2 0 346.421 4.237 20 0 EIADRP [NH3+][C@@H]1C[C@H]([NH2+]CCc2csc(-c3ccccc3)n2)c2ccccc21 ZINC000422776628 1037831079 /nfs/dbraw/zinc/83/10/79/1037831079.db2.gz AQSXDIDIHNCRAT-MOPGFXCFSA-N 2 0 335.476 4.087 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](Cc1ccccc1)c1ccccc1 ZINC000422773957 1037831447 /nfs/dbraw/zinc/83/14/47/1037831447.db2.gz ZLXBJHIPXYZSQE-FDDCHVKYSA-N 2 0 345.490 4.483 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)C(C)(C)c1ccccc1 ZINC000422784779 1037832623 /nfs/dbraw/zinc/83/26/23/1037832623.db2.gz OOGXLQYJNQUZEW-JXFKEZNVSA-N 2 0 325.500 4.256 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000422764188 1037834932 /nfs/dbraw/zinc/83/49/32/1037834932.db2.gz UUXQOXLWFMQHJN-QGZVFWFLSA-N 2 0 345.490 4.331 20 0 EIADRP Cc1ccc([C@@H]2OCCC[C@@H]2C[NH2+][C@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000422804649 1037838487 /nfs/dbraw/zinc/83/84/87/1037838487.db2.gz HZLWWIINTYYVGC-GFRNBQLOSA-N 2 0 336.479 4.197 20 0 EIADRP C[C@H]([NH2+][C@H]1CCCc2nc(-c3ccccc3)sc21)[C@H]1CCC[NH2+]C1 ZINC000422866004 1037848302 /nfs/dbraw/zinc/84/83/02/1037848302.db2.gz ZUHMHKNDQUGLHM-XIRDDKMYSA-N 2 0 341.524 4.165 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H](c2cccc(F)c2)c2cccc(Cl)c2)CC1 ZINC000422879177 1037852422 /nfs/dbraw/zinc/85/24/22/1037852422.db2.gz UWSHIMZEXNLTFZ-CTWPCTMYSA-N 2 0 332.850 4.428 20 0 EIADRP Cc1ccc(-c2nc(CC[NH2+][C@H](C)C[C@H]3CCCCC[NH2+]3)co2)cc1 ZINC000422878865 1037852593 /nfs/dbraw/zinc/85/25/93/1037852593.db2.gz LAEPUEYQLWSYIX-IEBWSBKVSA-N 2 0 341.499 4.093 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCCOc1ccc2ccccc2c1 ZINC000422886486 1037854819 /nfs/dbraw/zinc/85/48/19/1037854819.db2.gz JELIRGZBCNHKPS-INIZCTEOSA-N 2 0 349.478 4.122 20 0 EIADRP COC[C@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1cccc2ccccc21 ZINC000422902440 1037863504 /nfs/dbraw/zinc/86/35/04/1037863504.db2.gz DDWXNGVEVSZUDS-NZQKXSOJSA-N 2 0 348.490 4.273 20 0 EIADRP CC(C)Oc1ccc(C[NH2+][C@@H](C)CCCC[NH3+])c(C(F)(F)F)c1 ZINC000422902773 1037863737 /nfs/dbraw/zinc/86/37/37/1037863737.db2.gz NMCPUSJGPQGTDA-ZDUSSCGKSA-N 2 0 332.410 4.100 20 0 EIADRP COc1ccc([C@@H]([NH2+][C@@H](C)CCC[NH3+])c2ccccc2Cl)cc1 ZINC000422927731 1037871267 /nfs/dbraw/zinc/87/12/67/1037871267.db2.gz ZYRCUBPYYWVYDP-IFXJQAMLSA-N 2 0 332.875 4.155 20 0 EIADRP Clc1ccc(OCCCC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)cc1 ZINC000422934254 1037873193 /nfs/dbraw/zinc/87/31/93/1037873193.db2.gz JKBQQDVULYJUHJ-QRVBRYPASA-N 2 0 336.907 4.009 20 0 EIADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CC2c3ccccc3C1c1ccccc12 ZINC000422940098 1037876019 /nfs/dbraw/zinc/87/60/19/1037876019.db2.gz IQFUVVLLNSOVOM-PMCWCKIBSA-N 2 0 332.491 4.001 20 0 EIADRP COc1ccc([C@H]([NH2+]C2CCC(C[NH3+])CC2)c2ccc(C)cc2)cc1 ZINC000422936663 1037876723 /nfs/dbraw/zinc/87/67/23/1037876723.db2.gz MYYZVUZRNGDDTB-INXVGGANSA-N 2 0 338.495 4.200 20 0 EIADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](c1cccc(C(F)(F)F)c1)C(C)(C)C ZINC000422920654 1037880392 /nfs/dbraw/zinc/88/03/92/1037880392.db2.gz MMJBESLTFXPCRR-HZPDHXFCSA-N 2 0 346.437 4.136 20 0 EIADRP COc1ccc([C@@H]([NH2+]C2CCC(C[NH3+])CC2)c2ccc(F)cc2)cc1 ZINC000422945729 1037885944 /nfs/dbraw/zinc/88/59/44/1037885944.db2.gz NWEGBEMFWWAJEI-ZJKHUDDUSA-N 2 0 342.458 4.031 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@H]1CCC(C)(C)c2ccccc21 ZINC000423010953 1037899638 /nfs/dbraw/zinc/89/96/38/1037899638.db2.gz AKOCLTYNVPBLKT-NVXWUHKLSA-N 2 0 337.511 4.355 20 0 EIADRP Fc1ccc(C2(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)CC2)c(Cl)c1 ZINC000423030293 1037909902 /nfs/dbraw/zinc/90/99/02/1037909902.db2.gz WACDWJGHESASGW-ZTFGCOKTSA-N 2 0 336.882 4.021 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000423028959 1037910779 /nfs/dbraw/zinc/91/07/79/1037910779.db2.gz UFYNWXJRZQBIJU-UKPHBRMFSA-N 2 0 328.422 4.449 20 0 EIADRP C[C@@H]([NH2+]C1CCC(C[NH3+])CC1)[C@H](C)c1ccccc1C(F)(F)F ZINC000423026216 1037913396 /nfs/dbraw/zinc/91/33/96/1037913396.db2.gz PRZQNZUFMMSOHR-ZUJMUWTESA-N 2 0 328.422 4.305 20 0 EIADRP CC(C)c1cccc(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000423050201 1037936659 /nfs/dbraw/zinc/93/66/59/1037936659.db2.gz LDUURPAKVMHHGF-IFMALSPDSA-N 2 0 336.479 4.156 20 0 EIADRP c1ccc(C2CC(C[NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)C2)cc1 ZINC000423110762 1037990716 /nfs/dbraw/zinc/99/07/16/1037990716.db2.gz INORSBRZEXZMNJ-JAUAWXEUSA-N 2 0 348.490 4.026 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(C2CC2)c1 ZINC000423148174 1037994811 /nfs/dbraw/zinc/99/48/11/1037994811.db2.gz USLLWUMKLJOGQG-YROCYRMSSA-N 2 0 348.490 4.471 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CCCC[C@H]3OC(F)F)CC2)C1 ZINC000503919223 1037995719 /nfs/dbraw/zinc/99/57/19/1037995719.db2.gz FUWJOMXSGYWPGO-BZZMCLGOSA-N 2 0 344.490 4.170 20 0 EIADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC[C@H](c2ccccc2)C(F)(F)F)c2ccccc21 ZINC000423140108 1038012873 /nfs/dbraw/zinc/01/28/73/1038012873.db2.gz XHYHTQUZEGSOTH-KZNAEPCWSA-N 2 0 334.385 4.457 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC1(Cc2cccc(Cl)c2)CC1 ZINC000423172159 1038026852 /nfs/dbraw/zinc/02/68/52/1038026852.db2.gz RPYDJGQSAUQOPB-AWEZNQCLSA-N 2 0 343.902 4.176 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cccs1 ZINC000423206063 1038037815 /nfs/dbraw/zinc/03/78/15/1038037815.db2.gz FRVBLFLVIUIHPP-WMLDXEAASA-N 2 0 334.916 4.275 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000423209378 1038038162 /nfs/dbraw/zinc/03/81/62/1038038162.db2.gz FDBNHNNOPOVTAX-FMKPAKJESA-N 2 0 328.422 4.004 20 0 EIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCCC[C@H]2OC(F)F)CC1 ZINC000503950156 1038042749 /nfs/dbraw/zinc/04/27/49/1038042749.db2.gz BIMNTVCRROYLHN-XOYOTBSWSA-N 2 0 344.490 4.170 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000423221165 1038067048 /nfs/dbraw/zinc/06/70/48/1038067048.db2.gz WLPIYVQSFSRHBD-VKJFTORMSA-N 2 0 343.540 4.081 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423264076 1038072186 /nfs/dbraw/zinc/07/21/86/1038072186.db2.gz XZTCDZXTPGJXNB-WBVHZDCISA-N 2 0 343.540 4.467 20 0 EIADRP CC[NH+](CC)CC1CC[NH+]([C@@H](C)c2ncc(-c3ccccc3)o2)CC1 ZINC000607357989 1038076720 /nfs/dbraw/zinc/07/67/20/1038076720.db2.gz PMEFKDKXOSRLLY-KRWDZBQOSA-N 2 0 341.499 4.456 20 0 EIADRP C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccc2ccccc2c1OC(F)F ZINC000423248248 1038080306 /nfs/dbraw/zinc/08/03/06/1038080306.db2.gz MTLOIUHFQBFZOR-ZIAGYGMSSA-N 2 0 334.410 4.091 20 0 EIADRP C[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423256657 1038084013 /nfs/dbraw/zinc/08/40/13/1038084013.db2.gz FPCPBHUITWYKGN-KGLIPLIRSA-N 2 0 346.462 4.381 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC[C@@H]2CC[NH2+]C2)CCC3)cc1 ZINC000423253827 1038085139 /nfs/dbraw/zinc/08/51/39/1038085139.db2.gz WLMCILFWXQIBMY-RDJZCZTQSA-N 2 0 341.524 4.085 20 0 EIADRP c1ccc([C@H]([NH2+]CC[C@H]2CCC[NH2+]C2)c2ccc3ccccc3n2)cc1 ZINC000423256075 1038086217 /nfs/dbraw/zinc/08/62/17/1038086217.db2.gz DJHRUZRDIMJYQK-JPYJTQIMSA-N 2 0 345.490 4.304 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)CCS2 ZINC000423291667 1038096169 /nfs/dbraw/zinc/09/61/69/1038096169.db2.gz JIERSUAHDIZLHN-FZKQIMNGSA-N 2 0 328.481 4.042 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423316345 1038111628 /nfs/dbraw/zinc/11/16/28/1038111628.db2.gz AMKCJGUOUZLCFN-HNNXBMFYSA-N 2 0 343.540 4.467 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1nc2ccc(Cl)cc2n1C ZINC000423296007 1038120934 /nfs/dbraw/zinc/12/09/34/1038120934.db2.gz YEWKATMSCCHFQB-QWHCGFSZSA-N 2 0 342.874 4.097 20 0 EIADRP [NH3+]C1(C[NH2+][C@@H]2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)CCC1 ZINC000423322355 1038124150 /nfs/dbraw/zinc/12/41/50/1038124150.db2.gz IHMYGHNJFFLNRU-JKSUJKDBSA-N 2 0 326.406 4.203 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423330347 1038141100 /nfs/dbraw/zinc/14/11/00/1038141100.db2.gz NPOILIUALLIMHE-FOIQADDNSA-N 2 0 343.540 4.467 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423329047 1038143432 /nfs/dbraw/zinc/14/34/32/1038143432.db2.gz DULPDPXEKBHJIQ-HRAATJIYSA-N 2 0 327.516 4.203 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423335838 1038149969 /nfs/dbraw/zinc/14/99/69/1038149969.db2.gz SFBSTSXWKOORPR-INIZCTEOSA-N 2 0 327.516 4.203 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423340180 1038153943 /nfs/dbraw/zinc/15/39/43/1038153943.db2.gz VLPGAOILGKWTMT-BFUOFWGJSA-N 2 0 347.503 4.298 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000423385160 1038196012 /nfs/dbraw/zinc/19/60/12/1038196012.db2.gz GKVVXRQQHWAWPX-GRDNDAEWSA-N 2 0 329.513 4.076 20 0 EIADRP c1cc(C[NH2+][C@H]2CCCOc3cc4c(cc32)CCCC4)cc2c1C[NH2+]C2 ZINC000423390643 1038197945 /nfs/dbraw/zinc/19/79/45/1038197945.db2.gz PARCWPZPOSKXJY-QFIPXVFZSA-N 2 0 348.490 4.172 20 0 EIADRP Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CCCO2 ZINC000423393158 1038198124 /nfs/dbraw/zinc/19/81/24/1038198124.db2.gz QOJHISFQUUWBCS-IBGZPJMESA-N 2 0 342.870 4.255 20 0 EIADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]C1CCC(c2cccc(C(F)(F)F)c2)CC1 ZINC000423406513 1038215198 /nfs/dbraw/zinc/21/51/98/1038215198.db2.gz UTIVOXCIPPJCER-QQOVODFUSA-N 2 0 340.433 4.319 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000423431913 1038233174 /nfs/dbraw/zinc/23/31/74/1038233174.db2.gz MBVILGUOVOMXGI-UKPHBRMFSA-N 2 0 328.422 4.449 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000423441512 1038238517 /nfs/dbraw/zinc/23/85/17/1038238517.db2.gz PFSDGGWVNMIUQL-FYINFDKHSA-N 2 0 339.527 4.202 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1ccc(Br)cc1 ZINC000423461239 1038240571 /nfs/dbraw/zinc/24/05/71/1038240571.db2.gz NSXZHZZKTCDMHI-RCBQFDQVSA-N 2 0 325.294 4.007 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000423457773 1038241363 /nfs/dbraw/zinc/24/13/63/1038241363.db2.gz PNCYADIDMGDWJS-WIYYLYMNSA-N 3 0 349.538 4.096 20 0 EIADRP CCOc1ccc([C@H](CC)[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)cc1OCC ZINC000423464848 1038242665 /nfs/dbraw/zinc/24/26/65/1038242665.db2.gz RGGOQUNVPYKWGB-NXHRZFHOSA-N 2 0 334.504 4.042 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H](c2ccc(Br)cc2)C2CC2)C1 ZINC000423461976 1038242912 /nfs/dbraw/zinc/24/29/12/1038242912.db2.gz DBEUEJMHKIRWER-VUCTXSBTSA-N 2 0 337.305 4.007 20 0 EIADRP CSC[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(C(F)(F)F)cc1 ZINC000423480504 1038251414 /nfs/dbraw/zinc/25/14/14/1038251414.db2.gz NJUGFOXPQQYSSJ-CVEARBPZSA-N 2 0 346.462 4.231 20 0 EIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000423501145 1038258399 /nfs/dbraw/zinc/25/83/99/1038258399.db2.gz LALOSUUYSPLCAC-KDOFPFPSSA-N 2 0 334.410 4.419 20 0 EIADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1csc(-c2ccccc2F)n1 ZINC000423484307 1038259473 /nfs/dbraw/zinc/25/94/73/1038259473.db2.gz QQUFETQSNUWWRW-KBPBESRZSA-N 2 0 333.476 4.132 20 0 EIADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(Oc2ccccc2)cn1 ZINC000423490946 1038262194 /nfs/dbraw/zinc/26/21/94/1038262194.db2.gz YEMBKDSVOHJPFG-IAGOWNOFSA-N 2 0 325.456 4.057 20 0 EIADRP CC[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(OC)c(OC)c1 ZINC000423495317 1038265230 /nfs/dbraw/zinc/26/52/30/1038265230.db2.gz BQZGKSDCXPPMJJ-OALUTQOASA-N 2 0 342.483 4.225 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CCC[NH2+]C1CC1 ZINC000423531699 1038267153 /nfs/dbraw/zinc/26/71/53/1038267153.db2.gz TWLFJKLQQACWAG-AWEZNQCLSA-N 2 0 329.513 4.220 20 0 EIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cc(-c2ccccc2)nn1C ZINC000423521357 1038273737 /nfs/dbraw/zinc/27/37/37/1038273737.db2.gz SSFHYYXITKZPPY-XLIONFOSSA-N 2 0 348.494 4.218 20 0 EIADRP FC(F)(F)c1ccc([C@H]2CC[C@H]([NH2+]CCC3=CC[NH2+]CC3)C2)cc1 ZINC000423535389 1038286041 /nfs/dbraw/zinc/28/60/41/1038286041.db2.gz CWMPWANFXPQPPL-WMZOPIPTSA-N 2 0 338.417 4.241 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000574749287 1038323405 /nfs/dbraw/zinc/32/34/05/1038323405.db2.gz HLTMUAQBEJPSRX-CDHQVMDDSA-N 2 0 343.902 4.126 20 0 EIADRP C[C@H](c1ccc(Br)cc1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000490159719 1038364073 /nfs/dbraw/zinc/36/40/73/1038364073.db2.gz YSIDTTKBVJRFJP-CQSZACIVSA-N 2 0 339.321 4.174 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC[NH2+][C@@H](Cc1ccncc1)c1cccs1 ZINC000424266214 1038763363 /nfs/dbraw/zinc/76/33/63/1038763363.db2.gz WPYQMWFMOSTQSA-HKUYNNGSSA-N 2 0 343.540 4.281 20 0 EIADRP FC(F)(F)c1ccc(-c2ccc(C[NH2+]C3CC[NH2+]CC3)s2)cc1 ZINC000414780357 1038767025 /nfs/dbraw/zinc/76/70/25/1038767025.db2.gz AWHWBDCOZKILAE-UHFFFAOYSA-N 2 0 340.414 4.276 20 0 EIADRP Cc1c(Cl)c(C[N@H+]2CC3(C[C@H]2C)CC[NH2+]CC3)nc2ccccc12 ZINC000424289146 1038769236 /nfs/dbraw/zinc/76/92/36/1038769236.db2.gz LTBVRURZFFSRAT-CQSZACIVSA-N 2 0 343.902 4.161 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cccc(OC(F)F)c2)C1 ZINC000539050703 1038797643 /nfs/dbraw/zinc/79/76/43/1038797643.db2.gz QBZXBNXLVIXRNG-JKSUJKDBSA-N 2 0 340.458 4.307 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](Cc2ccncc2)c2cccs2)CC1 ZINC000424311927 1038800248 /nfs/dbraw/zinc/80/02/48/1038800248.db2.gz LKXKONDXHDHTGM-IBGZPJMESA-N 2 0 343.540 4.139 20 0 EIADRP CC(C)[C@@H](CCc1ccc(Cl)cc1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000480770557 1038808465 /nfs/dbraw/zinc/80/84/65/1038808465.db2.gz OOVQGMGCPSIRMN-FXAWDEMLSA-N 2 0 334.935 4.371 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccccc1N(C)C ZINC000539043262 1038810962 /nfs/dbraw/zinc/81/09/62/1038810962.db2.gz AESAPYAUWUFKQN-XEVCZEQESA-N 2 0 343.559 4.446 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]CCOc2ccccc2-c2ccccc2)[C@H](C)C1 ZINC000539093786 1038834142 /nfs/dbraw/zinc/83/41/42/1038834142.db2.gz TWODIFIATSLHCX-WIYYLYMNSA-N 2 0 338.495 4.052 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+]CCOc2cccc(Cl)c2Cl)CC1 ZINC000539093185 1038834491 /nfs/dbraw/zinc/83/44/91/1038834491.db2.gz LOABPAXHJFBKSZ-UHFFFAOYSA-N 2 0 345.314 4.225 20 0 EIADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000504906339 1038846477 /nfs/dbraw/zinc/84/64/77/1038846477.db2.gz WVCDQJSVIWMDGP-MLYOOKFZSA-N 2 0 330.516 4.022 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)ccc1F ZINC000504917182 1038851271 /nfs/dbraw/zinc/85/12/71/1038851271.db2.gz BDWMAOBPTQRPOQ-MRXNPFEDSA-N 2 0 336.495 4.243 20 0 EIADRP Brc1ccc(C2([NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)CCC2)cc1 ZINC000252734722 1038863318 /nfs/dbraw/zinc/86/33/18/1038863318.db2.gz ZEUIZNQQZUQMGP-SJORKVTESA-N 2 0 349.316 4.045 20 0 EIADRP C[NH+](C)C1CCC([NH+]2CCC(Oc3ccccc3Cl)CC2)CC1 ZINC001168323433 1038877851 /nfs/dbraw/zinc/87/78/51/1038877851.db2.gz ZBNKVSPZPMMVMK-UHFFFAOYSA-N 2 0 336.907 4.056 20 0 EIADRP C[NH+](C)C1CCC([N@@H+]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC001168328140 1038934876 /nfs/dbraw/zinc/93/48/76/1038934876.db2.gz XCHGYKVUVIIETQ-ZLPCBKJTSA-N 2 0 340.433 4.368 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cnn(C(C)(C)C)c2)CC1 ZINC000537619447 1038943197 /nfs/dbraw/zinc/94/31/97/1038943197.db2.gz DCAMSRZJTZGCCO-GOSISDBHSA-N 2 0 346.563 4.115 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(SCC(F)F)cc2)C1 ZINC000481041002 1038989189 /nfs/dbraw/zinc/98/91/89/1038989189.db2.gz RXZBAZFQRMVTPS-LSDHHAIUSA-N 2 0 342.499 4.426 20 0 EIADRP COc1c(Cl)cc(Cl)cc1C[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414804449 1039001201 /nfs/dbraw/zinc/00/12/01/1039001201.db2.gz FAUXECBXGGUZJW-LLVKDONJSA-N 2 0 339.266 4.312 20 0 EIADRP CC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000539394933 1039029500 /nfs/dbraw/zinc/02/95/00/1039029500.db2.gz AISZRCPHIFQRIW-NEWSRXKRSA-N 2 0 328.500 4.143 20 0 EIADRP Clc1ccc(OCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000481104074 1039032728 /nfs/dbraw/zinc/03/27/28/1039032728.db2.gz HDTAECMPKAOOOX-UHFFFAOYSA-N 2 0 336.907 4.106 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(F)c(Cl)c2Cl)cc1 ZINC000414812303 1039072741 /nfs/dbraw/zinc/07/27/41/1039072741.db2.gz KSNRIVOZQYUKHA-SNVBAGLBSA-N 2 0 327.230 4.442 20 0 EIADRP CC1(C)CCCC[C@@H]1[NH2+]CC1(C[NH2+][C@H]2CCCCC2(C)C)COC1 ZINC000481183690 1039085000 /nfs/dbraw/zinc/08/50/00/1039085000.db2.gz RRXUKKKGBMJFCR-ROUUACIJSA-N 2 0 336.564 4.120 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CCCCc2ccc(Cl)s2)[C@H]2CCC[C@H]21 ZINC000552052887 1039104269 /nfs/dbraw/zinc/10/42/69/1039104269.db2.gz IUMLOVMOTVXYCR-OWCLPIDISA-N 2 0 326.937 4.187 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(c2cccc(Cl)c2F)CCCC1 ZINC000477861514 1039143194 /nfs/dbraw/zinc/14/31/94/1039143194.db2.gz NOAWQAHFHZGAKD-WMLDXEAASA-N 2 0 338.898 4.221 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccc(C)o3)CC2)cc1 ZINC000120689366 1039205797 /nfs/dbraw/zinc/20/57/97/1039205797.db2.gz NQTFBXCFMCRUNP-KRWDZBQOSA-N 2 0 342.483 4.159 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)C1 ZINC000481298672 1039235272 /nfs/dbraw/zinc/23/52/72/1039235272.db2.gz INBDZTSAJOQWME-UTKZUKDTSA-N 2 0 344.449 4.180 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](CCc2ccccc2)Cc2ccccc2)C1 ZINC000481324777 1039294521 /nfs/dbraw/zinc/29/45/21/1039294521.db2.gz RXLGEGRTTKDYGV-PKTZIBPZSA-N 2 0 336.523 4.162 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(N[C@@H]2CC[NH+](C)[C@@H]3CCC[C@@H]32)cc1 ZINC000552276352 1039354725 /nfs/dbraw/zinc/35/47/25/1039354725.db2.gz UNCGNKJUYDYSCW-BRKWEVRTSA-N 2 0 341.543 4.346 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1)c1ccc2n[nH]cc2c1 ZINC000552338651 1039403311 /nfs/dbraw/zinc/40/33/11/1039403311.db2.gz LCBYTTIECYXVNT-QINHECLXSA-N 2 0 340.515 4.257 20 0 EIADRP Cc1cc(CC[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)cc(C)c1O ZINC000470132795 1039424036 /nfs/dbraw/zinc/42/40/36/1039424036.db2.gz LPAKSRDOOMWUCN-IIBYNOLFSA-N 2 0 344.543 4.184 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2ccccc2OC(F)F)CC1 ZINC000121709948 1039440514 /nfs/dbraw/zinc/44/05/14/1039440514.db2.gz CSSVFDIBYRYZTO-CQSZACIVSA-N 2 0 326.431 4.061 20 0 EIADRP Fc1ccc2nc(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)oc2c1 ZINC000121709994 1039440731 /nfs/dbraw/zinc/44/07/31/1039440731.db2.gz TYZPNVGSGCBUHP-UHFFFAOYSA-N 2 0 345.462 4.055 20 0 EIADRP CCC[C@@H](C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2CCOC)c1ccccc1 ZINC000552392093 1039443421 /nfs/dbraw/zinc/44/34/21/1039443421.db2.gz GGYJHKJKEKNJBM-CCDCCJRHSA-N 2 0 344.543 4.144 20 0 EIADRP Cc1cccc([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)c1C ZINC000122295183 1039637239 /nfs/dbraw/zinc/63/72/39/1039637239.db2.gz KBPQSRPLZLZQTO-SFHVURJKSA-N 2 0 326.484 4.095 20 0 EIADRP c1ccc(C[C@@H]([NH2+]C2CC[NH+](CC3CC3)CC2)c2ccccc2)cc1 ZINC001168351258 1039729559 /nfs/dbraw/zinc/72/95/59/1039729559.db2.gz OFIRWDHAYLVRHC-HSZRJFAPSA-N 2 0 334.507 4.434 20 0 EIADRP COc1ccc(F)cc1[C@@H](C)[NH2+][C@@H](C)c1cccc(C[NH+](C)C)c1 ZINC000924706959 1039778294 /nfs/dbraw/zinc/77/82/94/1039778294.db2.gz RXHKRAQBIQZVDW-LSDHHAIUSA-N 2 0 330.447 4.308 20 0 EIADRP COc1ccc(F)cc1[C@@H](C)[NH2+][C@H](C)c1cccc(C[NH+](C)C)c1 ZINC000924706958 1039778805 /nfs/dbraw/zinc/77/88/05/1039778805.db2.gz RXHKRAQBIQZVDW-HUUCEWRRSA-N 2 0 330.447 4.308 20 0 EIADRP C[C@H](NC1(C[NH2+][C@@H]2CC(C)(C)C[C@H]2C)CCOCC1)c1ccccc1 ZINC000434760095 1039860353 /nfs/dbraw/zinc/86/03/53/1039860353.db2.gz YAGJDADQRXOQKK-WSTZPKSXSA-N 2 0 344.543 4.301 20 0 EIADRP CC[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666954197 1039861116 /nfs/dbraw/zinc/86/11/16/1039861116.db2.gz RXQGTVLRLYFYAN-GOEBONIOSA-N 2 0 327.299 4.046 20 0 EIADRP c1ccc(C[NH+]2CCC(C[NH2+][C@@H](c3cccnc3)C3CCC3)CC2)cc1 ZINC000481922448 1039898302 /nfs/dbraw/zinc/89/83/02/1039898302.db2.gz ORBIBEPFSVISRL-HSZRJFAPSA-N 2 0 349.522 4.425 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCCC[NH+](C)C)CCC3)cc1 ZINC000481944783 1039916135 /nfs/dbraw/zinc/91/61/35/1039916135.db2.gz IKYAXFDXOHBRDC-KRWDZBQOSA-N 2 0 343.540 4.427 20 0 EIADRP Cc1cc([C@@H]([NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)C2CC2)ccc1F ZINC000553104203 1039991332 /nfs/dbraw/zinc/99/13/32/1039991332.db2.gz OXXJKYSYFWTFKY-FVJLSDCUSA-N 2 0 348.506 4.064 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)C1CC1 ZINC000551174422 1040017112 /nfs/dbraw/zinc/01/71/12/1040017112.db2.gz BTOVAGTTWKFRGX-AFMYVXGZSA-N 2 0 332.919 4.268 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@H]1CC(C)(C)c2ccc(Br)cc21 ZINC000479067052 1040092858 /nfs/dbraw/zinc/09/28/58/1040092858.db2.gz XIWWABZNDZHXQO-INIZCTEOSA-N 2 0 339.321 4.103 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)[C@@]1(C)CCCO1 ZINC000551268554 1040134798 /nfs/dbraw/zinc/13/47/98/1040134798.db2.gz XYHOSQDLBSAECN-LVCYWYKZSA-N 2 0 330.516 4.108 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000551273213 1040140740 /nfs/dbraw/zinc/14/07/40/1040140740.db2.gz VFVYEWZFCSNSIK-PVSGBFIBSA-N 2 0 334.507 4.290 20 0 EIADRP CSC1(C[NH2+][C@H](C)c2cccc(Cl)c2Cl)CC[NH+](C)CC1 ZINC000514696599 1040144142 /nfs/dbraw/zinc/14/41/42/1040144142.db2.gz NBDBYSDKSSDQQF-GFCCVEGCSA-N 2 0 347.355 4.471 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]CCC2CC[NH+](C)CC2)cc1OC ZINC000482356767 1040197756 /nfs/dbraw/zinc/19/77/56/1040197756.db2.gz WRQORLSMVUYHDB-QGZVFWFLSA-N 2 0 348.531 4.257 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@H]2[NH2+]CCC2CC[NH+](C)CC2)cc1F ZINC000482358696 1040197794 /nfs/dbraw/zinc/19/77/94/1040197794.db2.gz NGKIQFJMPDBBNI-AZUAARDMSA-N 2 0 348.506 4.182 20 0 EIADRP CC1=CC[C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000551308381 1040198001 /nfs/dbraw/zinc/19/80/01/1040198001.db2.gz KKCQMEUQEIAPKD-NRFANRHFSA-N 2 0 342.527 4.146 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(OC(F)(F)F)cc2)C1 ZINC000482360660 1040200313 /nfs/dbraw/zinc/20/03/13/1040200313.db2.gz PWNPKNDLFDULPH-HUUCEWRRSA-N 2 0 344.421 4.356 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+]C2CC(c3cc(F)cc(F)c3)C2)cc1 ZINC000514759064 1040209451 /nfs/dbraw/zinc/20/94/51/1040209451.db2.gz SGBTXBVLSVQGOR-UHFFFAOYSA-N 2 0 330.422 4.062 20 0 EIADRP COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000162916178 1040229795 /nfs/dbraw/zinc/22/97/95/1040229795.db2.gz SSMKBHOENKEKMH-SFHVURJKSA-N 2 0 338.495 4.450 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(F)cc1 ZINC000482434326 1040242077 /nfs/dbraw/zinc/24/20/77/1040242077.db2.gz FNKLMMJLDYXELO-MJGOQNOKSA-N 2 0 326.459 4.041 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)s1 ZINC000482462792 1040272133 /nfs/dbraw/zinc/27/21/33/1040272133.db2.gz XMIQLEIDEPGICQ-MJGOQNOKSA-N 2 0 328.525 4.272 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(F)cc2OC(F)F)CC1 ZINC000482498807 1040293364 /nfs/dbraw/zinc/29/33/64/1040293364.db2.gz CLSBGBCUBSAXLX-CYBMUJFWSA-N 2 0 344.421 4.200 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)CC1 ZINC000482500642 1040294359 /nfs/dbraw/zinc/29/43/59/1040294359.db2.gz AUFOQAUZBKQQDS-AWEZNQCLSA-N 2 0 328.422 4.478 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000482558668 1040348706 /nfs/dbraw/zinc/34/87/06/1040348706.db2.gz LVLGEWQBNYOXFA-NRFANRHFSA-N 2 0 344.449 4.180 20 0 EIADRP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995698 1040392499 /nfs/dbraw/zinc/39/24/99/1040392499.db2.gz WWJXPZNWKYHUTC-CHWSQXEVSA-N 2 0 327.299 4.189 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000666995159 1040407512 /nfs/dbraw/zinc/40/75/12/1040407512.db2.gz FABOVAMCWQDFGN-GIVPXCGWSA-N 2 0 342.527 4.374 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc3ccncc3s2)CC1 ZINC000667501858 1040411979 /nfs/dbraw/zinc/41/19/79/1040411979.db2.gz NFFIOOSOTFULNL-UHFFFAOYSA-N 2 0 331.529 4.240 20 0 EIADRP C[C@@H]([NH2+]CCCc1cccc(F)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000482879105 1040535934 /nfs/dbraw/zinc/53/59/34/1040535934.db2.gz WLYVHLVZORFSDK-QGZVFWFLSA-N 2 0 344.474 4.050 20 0 EIADRP CC(C)CC[NH+]1CCC([NH2+]C[C@@H]2CCCO[C@H]2c2ccccc2)CC1 ZINC000924781868 1040546371 /nfs/dbraw/zinc/54/63/71/1040546371.db2.gz KKGQBNAUADSOPB-UNMCSNQZSA-N 2 0 344.543 4.254 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@H]32)cc1 ZINC000668172370 1040604612 /nfs/dbraw/zinc/60/46/12/1040604612.db2.gz MCQRXBFJLKWDCD-RBUKOAKNSA-N 2 0 341.524 4.035 20 0 EIADRP C[N@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)[C@@H]1CCc2ccc(F)cc21 ZINC000483088706 1040697504 /nfs/dbraw/zinc/69/75/04/1040697504.db2.gz LILZWBICRUBQOU-XMSQKQJNSA-N 2 0 338.470 4.267 20 0 EIADRP C[C@@]1(C[NH2+]Cc2cccc3cnccc32)CC[N@H+](Cc2ccccc2)C1 ZINC000311581912 1040734142 /nfs/dbraw/zinc/73/41/42/1040734142.db2.gz DAEGVTZCQOBTKN-QHCPKHFHSA-N 2 0 345.490 4.237 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1)C1CC1 ZINC000483170760 1040753609 /nfs/dbraw/zinc/75/36/09/1040753609.db2.gz ABWYIOOICXBBPA-XCRHUMRWSA-N 2 0 340.433 4.476 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(F)c(C(F)(F)F)c2)[C@@H](C)C1 ZINC000539816871 1040808844 /nfs/dbraw/zinc/80/88/44/1040808844.db2.gz BKSUWNBVUFUJND-BLLLJJGKSA-N 2 0 332.385 4.007 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC(N[C@@H]2CCCc3c(O)cccc32)CC1 ZINC000483431999 1040857175 /nfs/dbraw/zinc/85/71/75/1040857175.db2.gz FWASCXAQGRWKJI-MAODMQOUSA-N 2 0 342.527 4.402 20 0 EIADRP Cc1cn2c(n1)[C@@H](C[NH2+][C@H](C)c1ccc(OCC(C)C)cc1)CCC2 ZINC000483444491 1040860845 /nfs/dbraw/zinc/86/08/45/1040860845.db2.gz FTLSARLIGQGWIN-IEBWSBKVSA-N 2 0 341.499 4.455 20 0 EIADRP CCC[C@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccccc1 ZINC000483514269 1040883065 /nfs/dbraw/zinc/88/30/65/1040883065.db2.gz REGPNEYTXAUVNU-NRFANRHFSA-N 2 0 343.559 4.068 20 0 EIADRP CCN1CCC[C@@H]1C[NH2+][C@H](C)c1ccc(SCC(F)F)cc1 ZINC000480089329 1040927657 /nfs/dbraw/zinc/92/76/57/1040927657.db2.gz HFZBJLNIILNJHZ-UKRRQHHQSA-N 2 0 328.472 4.179 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]C[C@H]2CCCN2CC)cc1OC ZINC000480082864 1040939380 /nfs/dbraw/zinc/93/93/80/1040939380.db2.gz GTIQOVXBTMSKJN-FUHWJXTLSA-N 2 0 334.504 4.009 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)o1 ZINC000483660545 1040940955 /nfs/dbraw/zinc/94/09/55/1040940955.db2.gz MDEVBPUJCLPZNV-FUHWJXTLSA-N 2 0 344.499 4.200 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)C1CC(F)(F)C1 ZINC000898519773 1040975093 /nfs/dbraw/zinc/97/50/93/1040975093.db2.gz RBKNZMMVEHXVCZ-PHXBYCTMSA-N 2 0 348.481 4.311 20 0 EIADRP C[C@@H](C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1)Cc1cccs1 ZINC000483741949 1040993610 /nfs/dbraw/zinc/99/36/10/1040993610.db2.gz INCJWKKDWFFFIJ-IAGOWNOFSA-N 2 0 346.540 4.218 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccncc2Cl)CC1)CC(C)C ZINC000537998320 1040998443 /nfs/dbraw/zinc/99/84/43/1040998443.db2.gz PEOKHJYEGGHTGB-UHFFFAOYSA-N 2 0 337.939 4.315 20 0 EIADRP C[C@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(F)cc1F ZINC000483809812 1041019965 /nfs/dbraw/zinc/01/99/65/1041019965.db2.gz SBGRJRIMHHQLBY-OAHLLOKOSA-N 2 0 336.470 4.455 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H]2CCCC[C@@H]2c2ccc(OC)c(F)c2)CC1 ZINC000480170798 1041032577 /nfs/dbraw/zinc/03/25/77/1041032577.db2.gz RGWYZKOYTTZNRC-UYAOXDASSA-N 2 0 348.506 4.325 20 0 EIADRP Cc1ccsc1CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000538116112 1041069602 /nfs/dbraw/zinc/06/96/02/1041069602.db2.gz DZHWNKNFWBEJFP-PKOBYXMFSA-N 2 0 328.525 4.099 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000436315436 1041082471 /nfs/dbraw/zinc/08/24/71/1041082471.db2.gz PKUMMOQJYBTHLZ-GZMRBYKVSA-N 2 0 340.433 4.270 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000436315434 1041084212 /nfs/dbraw/zinc/08/42/12/1041084212.db2.gz PKUMMOQJYBTHLZ-AQDKSWOWSA-N 2 0 340.433 4.270 20 0 EIADRP C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000480267477 1041141020 /nfs/dbraw/zinc/14/10/20/1041141020.db2.gz SCIHNVCCTQFTQF-BTYIYWSLSA-N 2 0 326.459 4.301 20 0 EIADRP Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000540136652 1041180626 /nfs/dbraw/zinc/18/06/26/1041180626.db2.gz WLJCNAZRDZENAS-LAUBAEHRSA-N 2 0 335.495 4.445 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccc(SCC(F)F)cc1 ZINC000515846161 1041185373 /nfs/dbraw/zinc/18/53/73/1041185373.db2.gz HVIPYWILICWDEB-CYBMUJFWSA-N 2 0 336.451 4.353 20 0 EIADRP CC[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(Cl)s1 ZINC000540172346 1041217227 /nfs/dbraw/zinc/21/72/27/1041217227.db2.gz AHHVLYODOODIHU-QLFBSQMISA-N 2 0 344.952 4.332 20 0 EIADRP C[C@@H](CC[NH3+])[NH2+]Cc1ccc(-c2ccccc2Br)s1 ZINC000414884105 1041223589 /nfs/dbraw/zinc/22/35/89/1041223589.db2.gz AVQOHHSCOAIUDM-NSHDSACASA-N 2 0 339.302 4.005 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCC1 ZINC000540163763 1041226135 /nfs/dbraw/zinc/22/61/35/1041226135.db2.gz JQNRLHHFLQVDPH-GUYCJALGSA-N 2 0 341.326 4.345 20 0 EIADRP COc1ccc2cc([C@H](C)[NH2+][C@H]3CCC[C@H]([NH+](C)C)C3)ccc2c1 ZINC000484471724 1041250084 /nfs/dbraw/zinc/25/00/84/1041250084.db2.gz ILZUVRGOJICWPD-YSSFQJQWSA-N 2 0 326.484 4.372 20 0 EIADRP CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc[nH+]c2cc(F)ccc21 ZINC000463063264 1041296564 /nfs/dbraw/zinc/29/65/64/1041296564.db2.gz GPXDTBCOAXLMFE-GOSISDBHSA-N 2 0 349.453 4.332 20 0 EIADRP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000538408850 1041328153 /nfs/dbraw/zinc/32/81/53/1041328153.db2.gz UKAKJSONDKBXFK-MRXNPFEDSA-N 2 0 327.299 4.166 20 0 EIADRP Cc1ccc([C@@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C2CC2)cc1 ZINC000540315281 1041359101 /nfs/dbraw/zinc/35/91/01/1041359101.db2.gz FZBNWZLFMJTTSR-JOCHJYFZSA-N 2 0 335.495 4.347 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CCCOC2CCCCC2)CCN1Cc1ccccc1 ZINC000463140787 1041359906 /nfs/dbraw/zinc/35/99/06/1041359906.db2.gz IILQDPBXVWTRJA-PZJWPPBQSA-N 2 0 344.543 4.369 20 0 EIADRP CC(C)(C[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)C(F)(F)F ZINC000554722033 1041363562 /nfs/dbraw/zinc/36/35/62/1041363562.db2.gz DJVVFMKVCLMZRO-YESZJQIVSA-N 2 0 340.433 4.075 20 0 EIADRP CCc1nc2c(s1)[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)CCC2 ZINC000480612195 1041423229 /nfs/dbraw/zinc/42/32/29/1041423229.db2.gz OCCNKNBYHXUHJF-HZPDHXFCSA-N 2 0 335.561 4.185 20 0 EIADRP CCc1nc2c(s1)[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)CCC2 ZINC000480612190 1041424063 /nfs/dbraw/zinc/42/40/63/1041424063.db2.gz OCCNKNBYHXUHJF-CVEARBPZSA-N 2 0 335.561 4.185 20 0 EIADRP Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000924668090 1041439391 /nfs/dbraw/zinc/43/93/91/1041439391.db2.gz OIPCMYGZFPIQCS-HOTGVXAUSA-N 2 0 341.499 4.374 20 0 EIADRP C[C@@H]([NH2+]CC1(C[NH2+][C@@H](C)C2CCCCC2)COC1)C1CCCCC1 ZINC000554842241 1041442185 /nfs/dbraw/zinc/44/21/85/1041442185.db2.gz KFOZMRBJVRSQOC-HDICACEKSA-N 2 0 336.564 4.120 20 0 EIADRP Cc1cccc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c1Br ZINC000904349850 1041444404 /nfs/dbraw/zinc/44/44/04/1041444404.db2.gz DENBNWRRDZKVDZ-CYBMUJFWSA-N 2 0 333.273 4.067 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CCc2ccc3[nH]ccc3c2)CCN1Cc1ccccc1 ZINC000463262586 1041458863 /nfs/dbraw/zinc/45/88/63/1041458863.db2.gz ZKCOIRDQSKPOTC-XMSQKQJNSA-N 2 0 347.506 4.353 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)[C@H](C)C1 ZINC000540496199 1041499159 /nfs/dbraw/zinc/49/91/59/1041499159.db2.gz YDYQNCIAKAJSCR-IZBJGVDFSA-N 2 0 342.527 4.389 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1ccncc1F ZINC000516322179 1041505667 /nfs/dbraw/zinc/50/56/67/1041505667.db2.gz PXULEEHFQUWLLE-QGZVFWFLSA-N 2 0 341.474 4.448 20 0 EIADRP CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000437076327 1041624833 /nfs/dbraw/zinc/62/48/33/1041624833.db2.gz OBFQGWJVJMLUFM-YOEHRIQHSA-N 2 0 346.437 4.255 20 0 EIADRP CO[C@@H](c1ccc(F)cc1)[C@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000540982946 1041766239 /nfs/dbraw/zinc/76/62/39/1041766239.db2.gz YAYHQXBRKVPSPY-HRAATJIYSA-N 2 0 348.506 4.288 20 0 EIADRP [NH3+][C@H]1CCC[C@@H]([NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 ZINC000414909767 1041855197 /nfs/dbraw/zinc/85/51/97/1041855197.db2.gz CKIUBBMSXKSADX-QWHCGFSZSA-N 2 0 340.311 4.084 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCCc3cc(N)ccc32)CC1 ZINC000414910774 1041869692 /nfs/dbraw/zinc/86/96/92/1041869692.db2.gz CSBFVBOVHXPIBX-URZJWIJPSA-N 2 0 341.543 4.279 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000437782359 1041899083 /nfs/dbraw/zinc/89/90/83/1041899083.db2.gz YLPNXWHQAQHSFG-BACDZXNISA-N 2 0 326.406 4.201 20 0 EIADRP c1ccc(OCCCCC[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1 ZINC000437793252 1041914778 /nfs/dbraw/zinc/91/47/78/1041914778.db2.gz ATLZFOZJNVWIKY-UHFFFAOYSA-N 2 0 344.543 4.480 20 0 EIADRP C[C@H](C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1 ZINC000437982498 1042003277 /nfs/dbraw/zinc/00/32/77/1042003277.db2.gz CNOGXOCTUSXDIB-QGZVFWFLSA-N 2 0 341.474 4.173 20 0 EIADRP C[C@H](CCC(F)(F)F)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000541555744 1042011542 /nfs/dbraw/zinc/01/15/42/1042011542.db2.gz IRZJHNOWVWWJBG-BFYDXBDKSA-N 2 0 328.422 4.218 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cccc(OC(F)(F)F)c1 ZINC000517536464 1042070207 /nfs/dbraw/zinc/07/02/07/1042070207.db2.gz LZWZECPZWIHGDB-HNNXBMFYSA-N 2 0 344.421 4.329 20 0 EIADRP CCCC[C@@H](CC)C[N@@H+]1CCCC2(CC[NH+](C[C@H](C)CO)CC2)C1 ZINC001280202245 1042126728 /nfs/dbraw/zinc/12/67/28/1042126728.db2.gz YLWSNBQDMYGJGC-VQTJNVASSA-N 2 0 338.580 4.009 20 0 EIADRP CC[N@H+](CCCc1ccccc1)CC1CCN(c2ccccn2)CC1 ZINC000464800593 1042167424 /nfs/dbraw/zinc/16/74/24/1042167424.db2.gz ABZOJWQICRRFQS-UHFFFAOYSA-N 2 0 337.511 4.253 20 0 EIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@@H](c1ccccc1)C1CCCCC1 ZINC000542084068 1042270241 /nfs/dbraw/zinc/27/02/41/1042270241.db2.gz AJFCAXCQVRZOPK-VXKWHMMOSA-N 2 0 344.543 4.135 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC[NH2+]1 ZINC000414948185 1042336381 /nfs/dbraw/zinc/33/63/81/1042336381.db2.gz LSSXKIUVIMZOES-YYQUZTFQSA-N 2 0 326.406 4.072 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@]2(C)CCCS2)CC1 ZINC000438826648 1042371339 /nfs/dbraw/zinc/37/13/39/1042371339.db2.gz OJRHHDCOGJGRKQ-MHJFOBGBSA-N 2 0 332.557 4.305 20 0 EIADRP COc1ccc(Oc2ccc(C[NH2+][C@H]3CC[N@H+](C)[C@H](C)C3)cc2)cc1 ZINC000542322930 1042388432 /nfs/dbraw/zinc/38/84/32/1042388432.db2.gz NGRSGYTZFYGJTN-AEFFLSMTSA-N 2 0 340.467 4.060 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)CC3 ZINC000491399276 1042440085 /nfs/dbraw/zinc/44/00/85/1042440085.db2.gz WEIYQJGBMJOZBP-IBGZPJMESA-N 2 0 347.506 4.185 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCN3)CC[N@@H+]1Cc1ccccc1 ZINC000414974632 1042461503 /nfs/dbraw/zinc/46/15/03/1042461503.db2.gz DUDJKIOKKVBLDZ-XMSQKQJNSA-N 2 0 349.522 4.187 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1OC ZINC000173325000 1042565244 /nfs/dbraw/zinc/56/52/44/1042565244.db2.gz BQCANOFDKOKIMO-IRXDYDNUSA-N 2 0 334.504 4.009 20 0 EIADRP CC(C)(C)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167964626 1042641767 /nfs/dbraw/zinc/64/17/67/1042641767.db2.gz VEGFNNZHDJLGOF-SEJPIABJSA-N 2 0 326.528 4.479 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(Cl)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309875645 1042823226 /nfs/dbraw/zinc/82/32/26/1042823226.db2.gz SYKBHBQASWVKIU-APWZRJJASA-N 2 0 328.887 4.340 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCCC(F)(F)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310236028 1042831903 /nfs/dbraw/zinc/83/19/03/1042831903.db2.gz KSFFZNFLYDVSOF-WDSOQIARSA-N 2 0 336.470 4.312 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310537056 1042840070 /nfs/dbraw/zinc/84/00/70/1042840070.db2.gz RNGFZEDVUMOLHA-ZWOKBUDYSA-N 2 0 326.459 4.387 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1 ZINC000177734005 1042847414 /nfs/dbraw/zinc/84/74/14/1042847414.db2.gz BMVFKWDFUQMXDR-KRWDZBQOSA-N 2 0 326.484 4.388 20 0 EIADRP Cc1ccccc1C1CC([NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000310925270 1042848219 /nfs/dbraw/zinc/84/82/19/1042848219.db2.gz RXZTWUCSTIKZMT-HWELCPFYSA-N 2 0 334.507 4.353 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311145901 1042853818 /nfs/dbraw/zinc/85/38/18/1042853818.db2.gz ZLARZIMBKPEGNL-XWFZLUIHSA-N 2 0 338.470 4.313 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3ccsc3)CC2)cc1 ZINC000178157478 1042860282 /nfs/dbraw/zinc/86/02/82/1042860282.db2.gz VKLYAFAPQRJSHV-INIZCTEOSA-N 2 0 344.524 4.320 20 0 EIADRP CC[C@@H]1C[C@@H](C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)CCO1 ZINC000507784918 1042934324 /nfs/dbraw/zinc/93/43/24/1042934324.db2.gz UERKNUIPWHBCQB-FCHUYYIVSA-N 2 0 344.543 4.036 20 0 EIADRP COC[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(Cl)cc1 ZINC000493884682 1042970800 /nfs/dbraw/zinc/97/08/00/1042970800.db2.gz ZNNQGCITJNPICD-VQIMIIECSA-N 2 0 338.923 4.272 20 0 EIADRP COC[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(Cl)cc1 ZINC000493882621 1042971539 /nfs/dbraw/zinc/97/15/39/1042971539.db2.gz JOXROKYMEUDERV-QFBILLFUSA-N 2 0 338.923 4.129 20 0 EIADRP C[C@@H]1CC([NH2+]CCCc2ccncc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168007270 1043015741 /nfs/dbraw/zinc/01/57/41/1043015741.db2.gz ACFSPNLNUWMXJK-RTBURBONSA-N 2 0 337.511 4.045 20 0 EIADRP C[C@H]([NH2+]Cc1ccnc2ccccc12)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000388842124 1043061113 /nfs/dbraw/zinc/06/11/13/1043061113.db2.gz YFOLSSDRRPBLHW-GHTZIAJQSA-N 2 0 345.490 4.235 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2cscc2Br)C1 ZINC000512147701 1043085986 /nfs/dbraw/zinc/08/59/86/1043085986.db2.gz UZVIILDFZOJLNQ-CYBMUJFWSA-N 2 0 345.350 4.112 20 0 EIADRP C[NH+](C)CC1CCC([NH2+]Cc2cccc(Oc3ccccn3)c2)CC1 ZINC000921921384 1043091190 /nfs/dbraw/zinc/09/11/90/1043091190.db2.gz XBBXDJFHHIHBFO-UHFFFAOYSA-N 2 0 339.483 4.084 20 0 EIADRP FC(F)Oc1ccc2ccccc2c1C[N@@H+]1CCC2(C1)CC[NH2+]CC2 ZINC000262148273 1043123062 /nfs/dbraw/zinc/12/30/62/1043123062.db2.gz ZQTDCHWYORUXMZ-UHFFFAOYSA-N 2 0 346.421 4.017 20 0 EIADRP FC(F)c1ccc(C[NH2+]C2CCN(CCc3ccccc3)CC2)cc1 ZINC000184987316 1043147138 /nfs/dbraw/zinc/14/71/38/1043147138.db2.gz RREAITIIXSORQP-UHFFFAOYSA-N 2 0 344.449 4.421 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000164758796 1043152037 /nfs/dbraw/zinc/15/20/37/1043152037.db2.gz WDCHESDSWJVRHH-HUUCEWRRSA-N 2 0 343.540 4.499 20 0 EIADRP FC(F)(F)C1CCC(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)CC1 ZINC000185517814 1043193961 /nfs/dbraw/zinc/19/39/61/1043193961.db2.gz BEXRDIIRTOTKCV-CGZBRXJRSA-N 2 0 332.454 4.163 20 0 EIADRP FC(F)(F)C1CCC(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)CC1 ZINC000185517834 1043194461 /nfs/dbraw/zinc/19/44/61/1043194461.db2.gz BEXRDIIRTOTKCV-AQFXKWCLSA-N 2 0 332.454 4.163 20 0 EIADRP FC(F)(F)C1CCC(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)CC1 ZINC000185522427 1043194662 /nfs/dbraw/zinc/19/46/62/1043194662.db2.gz WIUANNIINMIKRO-OQGULXLBSA-N 2 0 344.465 4.304 20 0 EIADRP Cc1cnc([C@@H](C)NCc2ccccc2C[N@@H+]2CCCC[C@H]2C)cn1 ZINC000427821005 1043214909 /nfs/dbraw/zinc/21/49/09/1043214909.db2.gz AVIGCRHPHMTYTR-QZTJIDSGSA-N 2 0 338.499 4.010 20 0 EIADRP c1ccc(C[C@H](C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000166784566 1043315497 /nfs/dbraw/zinc/31/54/97/1043315497.db2.gz XCNKJBJGAVRUTF-DNVJHFABSA-N 2 0 334.507 4.229 20 0 EIADRP C[C@@H]1CC(Nc2cccc(F)c2C[NH3+])C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168011592 1043335107 /nfs/dbraw/zinc/33/51/07/1043335107.db2.gz PTVVMFCREJZXFP-HZPDHXFCSA-N 2 0 341.474 4.138 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(-c2nc3ccccc3[nH]2)cc1)C1CC[NH+](C)CC1 ZINC000167576598 1043366418 /nfs/dbraw/zinc/36/64/18/1043366418.db2.gz GCSYPGZJZGSLLQ-MRXNPFEDSA-N 2 0 348.494 4.050 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cccc(C2CC2)c1 ZINC000658071105 1043743885 /nfs/dbraw/zinc/74/38/85/1043743885.db2.gz UOYWUQCXCMTFJE-QGZVFWFLSA-N 2 0 342.527 4.106 20 0 EIADRP CCC(CC)[NH+]1CCC(C[NH2+][C@@H]2Cc3cccc(Cl)c3C2)CC1 ZINC001168704061 1043796511 /nfs/dbraw/zinc/79/65/11/1043796511.db2.gz DDMLEJOOEYGSAG-QGZVFWFLSA-N 2 0 334.935 4.297 20 0 EIADRP Cc1c([C@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)cnn1C(C)C ZINC000191331682 1043808517 /nfs/dbraw/zinc/80/85/17/1043808517.db2.gz KXHWXFWMDVPMJF-KRWDZBQOSA-N 2 0 334.552 4.181 20 0 EIADRP C[NH+](C)CCCCCCC[NH2+]Cc1ccc2c(c1)CCC(C)(C)O2 ZINC000731677573 1043815424 /nfs/dbraw/zinc/81/54/24/1043815424.db2.gz WDAUHPZTMJZZPN-UHFFFAOYSA-N 2 0 332.532 4.392 20 0 EIADRP C[C@@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1cccc(O)c1 ZINC000442779925 1043832461 /nfs/dbraw/zinc/83/24/61/1043832461.db2.gz MEMAFWKKJBGKGW-FOUBCARRSA-N 2 0 338.495 4.199 20 0 EIADRP CC[NH+](CC)CCCN1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000191814613 1043849496 /nfs/dbraw/zinc/84/94/96/1043849496.db2.gz IMZMBZPGHCZOHI-CYBMUJFWSA-N 2 0 349.466 4.073 20 0 EIADRP Clc1cccc2c1C[C@@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)C2 ZINC001168708771 1043999739 /nfs/dbraw/zinc/99/97/39/1043999739.db2.gz OVYDGORHLVRXCN-SFHVURJKSA-N 2 0 332.919 4.051 20 0 EIADRP C[C@H]1CC(n2cc3cc(C[NH3+])ccc3n2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168015202 1044075670 /nfs/dbraw/zinc/07/56/70/1044075670.db2.gz PMGFFALJBGJOBK-IRXDYDNUSA-N 2 0 348.494 4.109 20 0 EIADRP COc1ccc(-c2csc(C[NH2+][C@@H](C)C3CC[NH+](C)CC3)c2)cc1 ZINC000157668903 1044145002 /nfs/dbraw/zinc/14/50/02/1044145002.db2.gz ZUSQUXHDHSEJHO-HNNXBMFYSA-N 2 0 344.524 4.244 20 0 EIADRP Fc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](Cc3cccs3)CC1)CC2 ZINC000479391963 1044235516 /nfs/dbraw/zinc/23/55/16/1044235516.db2.gz NUDCGXOTVKJZBX-HXUWFJFHSA-N 2 0 344.499 4.376 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCc3ccc(F)cc32)cc1 ZINC000479409957 1044246167 /nfs/dbraw/zinc/24/61/67/1044246167.db2.gz KUYOCTBCESFCBL-OAQYLSRUSA-N 2 0 326.459 4.445 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](CC2CCCC2)CC1)C1CCC(F)(F)CC1 ZINC000474057677 1044319913 /nfs/dbraw/zinc/31/99/13/1044319913.db2.gz XITCRWGVVTYXNX-HNNXBMFYSA-N 2 0 328.491 4.445 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]CC2CCC(C(F)(F)F)CC2)C1 ZINC000466360376 1044320462 /nfs/dbraw/zinc/32/04/62/1044320462.db2.gz CNDICPVHFOECHL-KLAILNCOSA-N 2 0 334.470 4.457 20 0 EIADRP C[C@H](C[NH2+]CC1CC[NH+](C2CCOCC2)CC1)CC1CCCCC1 ZINC000657537183 1044377874 /nfs/dbraw/zinc/37/78/74/1044377874.db2.gz BRTYZNMAAHMKEL-SFHVURJKSA-N 2 0 336.564 4.074 20 0 EIADRP C[C@@H]1CC([NH2+][C@@H]2CCCc3ncccc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168020344 1044380357 /nfs/dbraw/zinc/38/03/57/1044380357.db2.gz MHNNIWZKHMIXGR-PMAPCBKXSA-N 2 0 349.522 4.490 20 0 EIADRP CC1CC[NH+](CCC[NH2+][C@@H](C[C@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000494880275 1044463715 /nfs/dbraw/zinc/46/37/15/1044463715.db2.gz RXSSHALTDWKEBC-NQIIRXRSSA-N 2 0 348.506 4.005 20 0 EIADRP C[C@H]([NH2+]CC1(c2c(F)cccc2F)CCCC1)C1CC[NH+](C)CC1 ZINC000675797704 1044492165 /nfs/dbraw/zinc/49/21/65/1044492165.db2.gz ORXAHCNVVPJNTR-HNNXBMFYSA-N 2 0 336.470 4.097 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H](C)Cc2ccc(Cl)cc2Cl)CC1 ZINC000675800927 1044503518 /nfs/dbraw/zinc/50/35/18/1044503518.db2.gz IEPKFZIXLPGXFK-CYBMUJFWSA-N 2 0 329.315 4.388 20 0 EIADRP C[C@@H](C[NH2+][C@H](C)C1CC[NH+](C)CC1)c1c(Cl)cccc1Cl ZINC000675802977 1044505160 /nfs/dbraw/zinc/50/51/60/1044505160.db2.gz JNPQDGISKNZLDF-QWHCGFSZSA-N 2 0 329.315 4.417 20 0 EIADRP C[C@H](C[NH2+][C@H](C[C@H]1CCOC1)c1ccc(F)cc1)C[NH+]1CCCCC1 ZINC000494926698 1044522949 /nfs/dbraw/zinc/52/29/49/1044522949.db2.gz YSMOKHMCHGJFCK-DBXWQHBBSA-N 2 0 348.506 4.005 20 0 EIADRP C(=C\c1ccncc1)\C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000494995293 1044584511 /nfs/dbraw/zinc/58/45/11/1044584511.db2.gz MCYNXSLYNLJONX-DAXSKMNVSA-N 2 0 347.506 4.083 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C[C@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000495092747 1044665282 /nfs/dbraw/zinc/66/52/82/1044665282.db2.gz IPGZZMDQKMKWKW-WIYYLYMNSA-N 2 0 348.506 4.005 20 0 EIADRP Clc1nccc2cc(C[NH2+]C[C@H]3CCC[N@H+](CC4CC4)C3)sc21 ZINC000895359812 1044665905 /nfs/dbraw/zinc/66/59/05/1044665905.db2.gz KFMDWWYSBPBQHX-CQSZACIVSA-N 2 0 349.931 4.161 20 0 EIADRP Clc1nccc2cc(C[NH2+]C[C@@H]3CCC[N@H+](CC4CC4)C3)sc21 ZINC000895359811 1044666587 /nfs/dbraw/zinc/66/65/87/1044666587.db2.gz KFMDWWYSBPBQHX-AWEZNQCLSA-N 2 0 349.931 4.161 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc2ccncc2s1 ZINC000657828279 1044705907 /nfs/dbraw/zinc/70/59/07/1044705907.db2.gz RGGSDTBXHMIRGQ-AWEZNQCLSA-N 2 0 325.481 4.209 20 0 EIADRP C[C@@H]1C[C@@H](n2c(C[NH3+])cc3ccncc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168030501 1044800416 /nfs/dbraw/zinc/80/04/16/1044800416.db2.gz WHPHSYXZIPBGDK-XEMDLRDOSA-N 2 0 348.494 4.109 20 0 EIADRP C[C@@H]1CC(Nc2ccc(C[NH3+])c(F)c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168031596 1044830241 /nfs/dbraw/zinc/83/02/41/1044830241.db2.gz AJKMJSYVZQENCK-HZPDHXFCSA-N 2 0 341.474 4.138 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+]C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000673600440 1044854219 /nfs/dbraw/zinc/85/42/19/1044854219.db2.gz XCQRJQGARZZKLI-IHWMJMDHSA-N 2 0 326.406 4.040 20 0 EIADRP COC1CCC(CC[NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)CC1 ZINC000543594959 1044878336 /nfs/dbraw/zinc/87/83/36/1044878336.db2.gz KILIBTDAZDLRDC-YLJXDBKYSA-N 2 0 336.564 4.214 20 0 EIADRP C[C@H]1CC([NH2+]CC2Cc3ccccc3C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168033437 1044895736 /nfs/dbraw/zinc/89/57/36/1044895736.db2.gz LPTHDPVZUZIVJU-OALUTQOASA-N 2 0 348.534 4.433 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+]Cc2ccc(-c3ccccc3)o2)ccc1F ZINC000115624448 1044963528 /nfs/dbraw/zinc/96/35/28/1044963528.db2.gz QWOCAUJKSXHZNT-UHFFFAOYSA-N 2 0 338.426 4.437 20 0 EIADRP Fc1ccc(C2=CC[C@H]([NH2+]C3CC[NH+](CC4CC4)CC3)CC2)cc1 ZINC000495395581 1045047664 /nfs/dbraw/zinc/04/76/64/1045047664.db2.gz GCTINNCFUQZNHB-FQEVSTJZSA-N 2 0 328.475 4.226 20 0 EIADRP c1csc(C[N@@H+](CC2CCC3(CC3)CC2)[C@@H]2CC23CC[NH2+]CC3)n1 ZINC000923347538 1045069034 /nfs/dbraw/zinc/06/90/34/1045069034.db2.gz RXDRPDSJOXGKGD-QGZVFWFLSA-N 2 0 345.556 4.058 20 0 EIADRP CC(C)=CCC[C@@H](C)[NH2+]C[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429431040 1045131882 /nfs/dbraw/zinc/13/18/82/1045131882.db2.gz MLPQBICDFGCODU-CTNGQTDRSA-N 2 0 330.516 4.002 20 0 EIADRP CC(C)=CCC[C@@H](C)[NH2+]C[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429431043 1045132247 /nfs/dbraw/zinc/13/22/47/1045132247.db2.gz MLPQBICDFGCODU-TZIWHRDSSA-N 2 0 330.516 4.002 20 0 EIADRP COC1(C[C@H](C)[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CCC1 ZINC000429443337 1045142971 /nfs/dbraw/zinc/14/29/71/1045142971.db2.gz CQKFREACEJJMMX-IRFCIJBXSA-N 2 0 344.543 4.224 20 0 EIADRP C[C@H]([NH2+]CCCN1CCc2ccccc2C1)c1ccc(F)c(F)c1 ZINC000495503687 1045164727 /nfs/dbraw/zinc/16/47/27/1045164727.db2.gz PCVLVUGBUOYOPL-HNNXBMFYSA-N 2 0 330.422 4.064 20 0 EIADRP CCCc1nc(C)c(C[N@H+](CC)Cc2ccc(C[NH+](C)C)cc2)o1 ZINC000626063386 1045167996 /nfs/dbraw/zinc/16/79/96/1045167996.db2.gz BYPXKDSSJSTSFI-UHFFFAOYSA-N 2 0 329.488 4.019 20 0 EIADRP c1ccc2c(c1)cccc2CSCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000611104255 1045250637 /nfs/dbraw/zinc/25/06/37/1045250637.db2.gz PSHBKXVINBBEIP-UXHICEINSA-N 2 0 340.536 4.289 20 0 EIADRP C[C@H]([NH2+]CCCCC(=O)OC(C)(C)C)c1ccc(-n2ccnc2)cc1 ZINC000611367597 1045288680 /nfs/dbraw/zinc/28/86/80/1045288680.db2.gz LPVOHNQZPCHEFQ-INIZCTEOSA-N 2 0 343.471 4.035 20 0 EIADRP C[C@@H](Cc1cccc(F)c1)[N@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001168501372 1045498862 /nfs/dbraw/zinc/49/88/62/1045498862.db2.gz NWQGYCWPOPCJOZ-KRWDZBQOSA-N 2 0 332.507 4.486 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000326084809 1045562810 /nfs/dbraw/zinc/56/28/10/1045562810.db2.gz PSZJVMWLSAOVJQ-OAQYLSRUSA-N 2 0 326.459 4.445 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000397592064 1045678805 /nfs/dbraw/zinc/67/88/05/1045678805.db2.gz KEOPPSKWJPUCND-GOSISDBHSA-N 2 0 338.495 4.258 20 0 EIADRP CC[C@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc2c(c1)CCCO2 ZINC000768107036 1045717401 /nfs/dbraw/zinc/71/74/01/1045717401.db2.gz LFQFHMYBHGOMCR-NRFANRHFSA-N 2 0 342.527 4.459 20 0 EIADRP C[C@H]([NH2+][C@H]1CCSc2ccccc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248407253 1045872920 /nfs/dbraw/zinc/87/29/20/1045872920.db2.gz UDTWLPJFSYPALN-BXWFABGCSA-N 2 0 330.541 4.466 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCC[C@H]2CCCCO2)C3)cc1 ZINC000248887149 1045886984 /nfs/dbraw/zinc/88/69/84/1045886984.db2.gz MKPOAEWZMZTNDP-CIAFKFPVSA-N 2 0 342.527 4.121 20 0 EIADRP FC1(F)CCCC[C@@H]1C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001170206012 1045926020 /nfs/dbraw/zinc/92/60/20/1045926020.db2.gz QGMUZIFQPJXYFS-WOJBJXKFSA-N 2 0 348.481 4.410 20 0 EIADRP C[C@H](Cc1ccccc1Cl)[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC001170257261 1045958659 /nfs/dbraw/zinc/95/86/59/1045958659.db2.gz XIYDSLMNIZNDJA-MRXNPFEDSA-N 2 0 346.902 4.001 20 0 EIADRP Cc1c[nH+]ccc1N([C@@H](C)Cc1ccccc1Cl)C1CC[NH2+]CC1 ZINC001170293854 1045978031 /nfs/dbraw/zinc/97/80/31/1045978031.db2.gz NADYRWNABTZPQB-INIZCTEOSA-N 2 0 343.902 4.233 20 0 EIADRP CC(C)O[C@H]1C[C@H]([NH2+]Cc2cccc(C[NH+]3CCCCC3)c2)C1(C)C ZINC001170397923 1046030714 /nfs/dbraw/zinc/03/07/14/1046030714.db2.gz BEJGTFBTXAPIDW-SFTDATJTSA-N 2 0 344.543 4.354 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[N@H+](C)C[C@@H]2CCC[NH2+]C2)cc1 ZINC000261745944 1046143758 /nfs/dbraw/zinc/14/37/58/1046143758.db2.gz BWMYVDZTRPWFBR-ZWKOTPCHSA-N 2 0 338.495 4.355 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459390202 1046146805 /nfs/dbraw/zinc/14/68/05/1046146805.db2.gz PDWQAYLZMLQUEM-KRWDZBQOSA-N 2 0 339.483 4.190 20 0 EIADRP C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1C(F)(F)F ZINC000459390014 1046164704 /nfs/dbraw/zinc/16/47/04/1046164704.db2.gz IAQATAIBKPDHRP-CQSZACIVSA-N 2 0 349.400 4.420 20 0 EIADRP CCC[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@H](O)c1ccccc1 ZINC000793235712 1046181462 /nfs/dbraw/zinc/18/14/62/1046181462.db2.gz BAAOBPGUSZIDAJ-FGZHOGPDSA-N 2 0 344.543 4.275 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1Cl ZINC000123627610 1046189234 /nfs/dbraw/zinc/18/92/34/1046189234.db2.gz JHBWCTCOICQSRE-AWEZNQCLSA-N 2 0 332.875 4.261 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2N(C)C)c1 ZINC000123976150 1046209475 /nfs/dbraw/zinc/20/94/75/1046209475.db2.gz KLTJIGWBZVBNRL-INIZCTEOSA-N 2 0 343.490 4.194 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)C/C(C)=C/c2ccccc2COC)C[C@H]1C ZINC000508719524 1046378176 /nfs/dbraw/zinc/37/81/76/1046378176.db2.gz NYAFEXDQTIJWHJ-IUPPMXBZSA-N 2 0 330.516 4.041 20 0 EIADRP C[C@@H]([NH2+]CCc1c[nH]c2ccccc12)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508715709 1046380283 /nfs/dbraw/zinc/38/02/83/1046380283.db2.gz XHNHYORWEGNHNP-WIYYLYMNSA-N 2 0 347.506 4.211 20 0 EIADRP C[C@@H]([NH2+]CCc1c[nH]c2ccccc12)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508715707 1046380584 /nfs/dbraw/zinc/38/05/84/1046380584.db2.gz XHNHYORWEGNHNP-NQIIRXRSSA-N 2 0 347.506 4.211 20 0 EIADRP COc1cc(C)cc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000508722036 1046420234 /nfs/dbraw/zinc/42/02/34/1046420234.db2.gz QUTGCHMSSXOLLZ-RXVVDRJESA-N 2 0 338.495 4.004 20 0 EIADRP CCCCOc1cc(C[N@H+](C)[C@@H]2CC[NH+](CC)C[C@@H]2C)ccc1OC ZINC000536658861 1046622648 /nfs/dbraw/zinc/62/26/48/1046622648.db2.gz PPTKFBNCRVCPAE-PKOBYXMFSA-N 2 0 348.531 4.036 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2ccc(-c3ccccc3F)o2)[C@H](C)C1 ZINC000536659052 1046623493 /nfs/dbraw/zinc/62/34/93/1046623493.db2.gz AQNSURGEIHJDTB-BEFAXECRSA-N 2 0 330.447 4.248 20 0 EIADRP CCCCOc1cc(C[N@H+](C)[C@H]2CC[NH+](CC)C[C@@H]2C)ccc1OC ZINC000536658858 1046624402 /nfs/dbraw/zinc/62/44/02/1046624402.db2.gz PPTKFBNCRVCPAE-HKUYNNGSSA-N 2 0 348.531 4.036 20 0 EIADRP CC[N@H+](C[C@@H]1C[C@@H]1c1ccccc1)CC1CCN(c2ccccn2)CC1 ZINC000536661073 1046628612 /nfs/dbraw/zinc/62/86/12/1046628612.db2.gz WSLWEHBOAXVMTF-FCHUYYIVSA-N 2 0 349.522 4.424 20 0 EIADRP CC[N@H+](C[C@H]1C[C@@H]1c1ccccc1)CC1CCN(c2ccccn2)CC1 ZINC000536661074 1046628685 /nfs/dbraw/zinc/62/86/85/1046628685.db2.gz WSLWEHBOAXVMTF-FGZHOGPDSA-N 2 0 349.522 4.424 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cc(C)c(C)cc2OC(F)F)C[C@H]1C ZINC000536662083 1046633326 /nfs/dbraw/zinc/63/33/26/1046633326.db2.gz NSCXMZUIAFZNCO-WBVHZDCISA-N 2 0 340.458 4.209 20 0 EIADRP FC(F)(F)[C@H]1CCC[C@@H](C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000459428614 1046660096 /nfs/dbraw/zinc/66/00/96/1046660096.db2.gz OUQOVBISLUBZND-CABCVRRESA-N 2 0 341.421 4.009 20 0 EIADRP CC[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)C(C)(C)c1ccccc1 ZINC000459434484 1046668527 /nfs/dbraw/zinc/66/85/27/1046668527.db2.gz OVDXWTJAPSLPFH-OAQYLSRUSA-N 2 0 337.511 4.396 20 0 EIADRP Cc1cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc(C)c1O ZINC000379615161 1046702687 /nfs/dbraw/zinc/70/26/87/1046702687.db2.gz AFXKGXWHSUNYHN-WIYYLYMNSA-N 2 0 338.495 4.152 20 0 EIADRP Fc1ccccc1[C@@H]1CC[C@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000459517076 1046742725 /nfs/dbraw/zinc/74/27/25/1046742725.db2.gz RVRKDTXZNQJRIH-AEFFLSMTSA-N 2 0 339.458 4.115 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc2c(c1)COC2 ZINC000536835073 1046810811 /nfs/dbraw/zinc/81/08/11/1046810811.db2.gz XBSOVRBDFJSEDD-PPNDLDFTSA-N 2 0 342.527 4.411 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(-c3ccc(OC)cc3)cc2)[C@H](C)C1 ZINC000536874170 1046836441 /nfs/dbraw/zinc/83/64/41/1046836441.db2.gz CJHDNVFGNKGAKV-VGOFRKELSA-N 2 0 338.495 4.182 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2CCC(C(F)F)CC2)CC1 ZINC000459703901 1046855459 /nfs/dbraw/zinc/85/54/59/1046855459.db2.gz FSEIWWGBPGOKEB-IDMDMSBLSA-N 2 0 328.491 4.443 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2CCC(C(F)F)CC2)CC1 ZINC000459703904 1046855730 /nfs/dbraw/zinc/85/57/30/1046855730.db2.gz FSEIWWGBPGOKEB-YHOLWWCESA-N 2 0 328.491 4.443 20 0 EIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000786834603 1046872261 /nfs/dbraw/zinc/87/22/61/1046872261.db2.gz GMYFXYMKGWSAFS-GHOZHQTGSA-N 2 0 330.516 4.149 20 0 EIADRP C[C@@H]1CCCC[C@H]1C[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000537160732 1046998333 /nfs/dbraw/zinc/99/83/33/1046998333.db2.gz GNFZKWUUZQXYLP-HBFSDRIKSA-N 2 0 342.527 4.391 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCc2nc(Cl)ccc21 ZINC000806127701 1047146591 /nfs/dbraw/zinc/14/65/91/1047146591.db2.gz JEQXPLWCXFTEQT-GOSISDBHSA-N 2 0 343.902 4.354 20 0 EIADRP C(CCC[NH2+][C@@H]1CCCC[C@@H]1[C@@H]1CCOC1)CCC[NH+]1CCCC1 ZINC000788988554 1047342850 /nfs/dbraw/zinc/34/28/50/1047342850.db2.gz SAOZNISVIULIRL-NJDAHSKKSA-N 2 0 336.564 4.218 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1ccccc1 ZINC000129397077 1047377043 /nfs/dbraw/zinc/37/70/43/1047377043.db2.gz BGJQTYQIEDKSJL-QRVBRYPASA-N 2 0 338.495 4.147 20 0 EIADRP COc1ccc(CCC[NH2+][C@H]2CCN(C)[C@@H](c3ccccc3)C2)cc1 ZINC000556058599 1047421996 /nfs/dbraw/zinc/42/19/96/1047421996.db2.gz ABNDWSSEBUJJAJ-RBBKRZOGSA-N 2 0 338.495 4.053 20 0 EIADRP Cc1ccc(C[NH+]2CCC3(C[NH+](Cc4ccccc4)C3)CC2)s1 ZINC001204033726 1047464296 /nfs/dbraw/zinc/46/42/96/1047464296.db2.gz RQBMJAHVFKWTNO-UHFFFAOYSA-N 2 0 326.509 4.155 20 0 EIADRP C[C@@H]1CC[C@H]([NH+]2CCC([NH3+])(Cc3ccc(C(F)(F)F)cc3)CC2)C1 ZINC001170119749 1047474406 /nfs/dbraw/zinc/47/44/06/1047474406.db2.gz BYJRNGOHSCWNRB-PBHICJAKSA-N 2 0 340.433 4.230 20 0 EIADRP C[C@H]([NH2+][C@H]1CCN(C2CC2)[C@H](c2ccccc2)C1)c1cncs1 ZINC000897931039 1047501538 /nfs/dbraw/zinc/50/15/38/1047501538.db2.gz VABOCWNQNJKYNJ-ZVZYQTTQSA-N 2 0 327.497 4.162 20 0 EIADRP CCCC[C@H](COC)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000556233069 1047594813 /nfs/dbraw/zinc/59/48/13/1047594813.db2.gz FOCPHBYJUNQWIO-NYLDSWQDSA-N 2 0 332.532 4.224 20 0 EIADRP Cn1nccc1[C@@H]1CCC[C@@H]([NH2+]CCCCCCC[NH+]2CCCC2)C1 ZINC000790486956 1047596227 /nfs/dbraw/zinc/59/62/27/1047596227.db2.gz RCVYVMVWZNNMAF-WOJBJXKFSA-N 2 0 346.563 4.082 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1cccc(OCC[NH+](C)C)c1 ZINC000556240701 1047606442 /nfs/dbraw/zinc/60/64/42/1047606442.db2.gz YYNADXLTBNJJOK-AGHHOFFYSA-N 2 0 338.495 4.081 20 0 EIADRP C[NH+](C)C1CCC([NH2+]CCCc2ccc(Cl)cc2Cl)CC1 ZINC001168298203 1047679318 /nfs/dbraw/zinc/67/93/18/1047679318.db2.gz FGIQIZXIDJVNDD-UHFFFAOYSA-N 2 0 329.315 4.388 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H](c2ccc(C(F)(F)F)cn2)C2CC2)CC1 ZINC001168305322 1047764346 /nfs/dbraw/zinc/76/43/46/1047764346.db2.gz ICRDNNLDSAOHQB-DQPZFDDXSA-N 2 0 341.421 4.014 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCN(C)[C@@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000550665019 1047810211 /nfs/dbraw/zinc/81/02/11/1047810211.db2.gz CMRGHDSDGSEBPD-FQELHTAISA-N 2 0 344.449 4.493 20 0 EIADRP Cc1cccc(O[C@H](C)C[NH2+][C@H]2CCN(C)[C@@H](c3ccccc3)C2)c1 ZINC000550666091 1047810678 /nfs/dbraw/zinc/81/06/78/1047810678.db2.gz UQPDQSWAOYQUKT-KAGYGMCKSA-N 2 0 338.495 4.187 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]CC3=Cc4ccccc4OC3)CC2)CC1 ZINC000131066330 1047824060 /nfs/dbraw/zinc/82/40/60/1047824060.db2.gz BBXSDNIBYLQHFV-UHFFFAOYSA-N 2 0 340.511 4.095 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)[C@H](O)c1ccccc1 ZINC000824401102 1047866298 /nfs/dbraw/zinc/86/62/98/1047866298.db2.gz BPJSDBSBRXMNOE-PXNSSMCTSA-N 2 0 346.559 4.377 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)[C@@H](O)c1ccccc1 ZINC000824401101 1047866640 /nfs/dbraw/zinc/86/66/40/1047866640.db2.gz BPJSDBSBRXMNOE-FXAWDEMLSA-N 2 0 346.559 4.377 20 0 EIADRP CC(C)COc1ccccc1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000556686648 1047875146 /nfs/dbraw/zinc/87/51/46/1047875146.db2.gz ZSFXNVLCOKJVDK-UHFFFAOYSA-N 2 0 332.532 4.274 20 0 EIADRP Cc1ccc2c(C[NH+]3C[C@@H]4C[NH+](Cc5ccccc5)C[C@H]4C3)c[nH]c2c1 ZINC001136974647 1048007483 /nfs/dbraw/zinc/00/74/83/1048007483.db2.gz HGKGXOOEZPEDRP-SFTDATJTSA-N 2 0 345.490 4.040 20 0 EIADRP Cc1ccc2c(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)c[nH]c2c1 ZINC001136973102 1048015709 /nfs/dbraw/zinc/01/57/09/1048015709.db2.gz MGYQAXVHZNRHQX-LJQANCHMSA-N 2 0 325.500 4.317 20 0 EIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@@H](C)c1ccccc1C(F)(F)F ZINC000824988013 1048018055 /nfs/dbraw/zinc/01/80/55/1048018055.db2.gz GAFOGGJIRFEOCB-FVPDABNVSA-N 2 0 340.433 4.412 20 0 EIADRP CC(C)(C)[C@H]1OCCC[C@H]1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000131736543 1048126533 /nfs/dbraw/zinc/12/65/33/1048126533.db2.gz SLCYCWBSCSUGOZ-PXNSSMCTSA-N 2 0 336.564 4.214 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171109702 1048219494 /nfs/dbraw/zinc/21/94/94/1048219494.db2.gz LMEZNVGDTGRZGV-IOJLRTSASA-N 2 0 334.935 4.440 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(Cl)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000132520800 1048331906 /nfs/dbraw/zinc/33/19/06/1048331906.db2.gz VYNDGZMCSBXFPT-HNNXBMFYSA-N 2 0 332.875 4.131 20 0 EIADRP Cc1ccc(Oc2cccc(C[NH+]3CCC4(C[NH+](C)C4)CC3)c2)cc1 ZINC001144090673 1048405902 /nfs/dbraw/zinc/40/59/02/1048405902.db2.gz NXNFKCHVHMYAHH-UHFFFAOYSA-N 2 0 336.479 4.315 20 0 EIADRP CC[NH+]1CCC(CC2CC[NH+](Cc3cccc(O)c3C)CC2)CC1 ZINC001144121667 1048434563 /nfs/dbraw/zinc/43/45/63/1048434563.db2.gz QECINHOBLMTGRF-UHFFFAOYSA-N 2 0 330.516 4.035 20 0 EIADRP C[NH+](C)CCC(C)(C)[NH2+][C@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171142670 1048452741 /nfs/dbraw/zinc/45/27/41/1048452741.db2.gz CAKBQNDHCRHDHW-AWEZNQCLSA-N 2 0 329.315 4.171 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171145343 1048468276 /nfs/dbraw/zinc/46/82/76/1048468276.db2.gz SZLKRACOFTVNKC-HWOWSKLDSA-N 2 0 341.326 4.313 20 0 EIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccc(SC(F)F)cc3)C2)CC1 ZINC000809754764 1048520337 /nfs/dbraw/zinc/52/03/37/1048520337.db2.gz ANKHPTJUDZVQPL-MRXNPFEDSA-N 2 0 340.483 4.165 20 0 EIADRP Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3ccc([C@@H]4CC[N@H+](C)C4)cc3)c2c1 ZINC001171167783 1048615125 /nfs/dbraw/zinc/61/51/25/1048615125.db2.gz MQQKKLQDVXNWPC-IEBWSBKVSA-N 2 0 347.506 4.248 20 0 EIADRP Cc1ccc(C[NH+]2C[C@@H]3C[NH+](Cc4cccc5cc[nH]c54)C[C@H]3C2)cc1 ZINC001144712432 1048814295 /nfs/dbraw/zinc/81/42/95/1048814295.db2.gz XLAYIONMLXJDRA-FGZHOGPDSA-N 2 0 345.490 4.040 20 0 EIADRP [NH3+]CCN(c1cccc(C2=[NH+]CCC2)c1)C12CC3CC(CC(C3)C1)C2 ZINC001170630420 1049020762 /nfs/dbraw/zinc/02/07/62/1049020762.db2.gz NBFFVHXYCNFCIS-UHFFFAOYSA-N 2 0 337.511 4.003 20 0 EIADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC(C)(C)Sc1ccc(Br)cc1 ZINC000817897289 1049052979 /nfs/dbraw/zinc/05/29/79/1049052979.db2.gz JQXQYJHLSUXHMS-NEPJUHHUSA-N 2 0 345.350 4.035 20 0 EIADRP Cc1ccc(C)c([C@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000817894616 1049053653 /nfs/dbraw/zinc/05/36/53/1049053653.db2.gz NLLVCODARRYFIL-WEYGHZABSA-N 2 0 336.479 4.210 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1csc2ccccc21 ZINC000817900675 1049057100 /nfs/dbraw/zinc/05/71/00/1049057100.db2.gz UYNHKSFFUVJSKB-JSGCOSHPSA-N 2 0 325.481 4.475 20 0 EIADRP [NH3+]CCc1ccc(C[NH2+][C@@H]2CCSc3c(Cl)cccc32)cc1 ZINC000817949619 1049064550 /nfs/dbraw/zinc/06/45/50/1049064550.db2.gz SLRDVKAJNQEJSN-QGZVFWFLSA-N 2 0 332.900 4.168 20 0 EIADRP Cc1c([C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cnn1-c1ccccc1 ZINC000817962511 1049068641 /nfs/dbraw/zinc/06/86/41/1049068641.db2.gz JGSODUYDVFNHTA-HOTGVXAUSA-N 2 0 334.467 4.051 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cc(Cl)c(N)c(Cl)c1 ZINC000817963154 1049070512 /nfs/dbraw/zinc/07/05/12/1049070512.db2.gz ORRGITQTQWGEDJ-WDEREUQCSA-N 2 0 338.282 4.446 20 0 EIADRP COc1cc([C@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)ccc1SC(F)F ZINC000817980993 1049078721 /nfs/dbraw/zinc/07/87/21/1049078721.db2.gz OSSRBKKESGROKV-JSGCOSHPSA-N 2 0 344.471 4.193 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(SC(F)F)cc1 ZINC000817985443 1049081093 /nfs/dbraw/zinc/08/10/93/1049081093.db2.gz KDIUJHJTAHNEJQ-CYUUQNCZSA-N 2 0 326.456 4.040 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cscc2C(F)(F)F)cc1 ZINC000811506999 1049118079 /nfs/dbraw/zinc/11/80/79/1049118079.db2.gz NPLBITOMNDSHDE-UHFFFAOYSA-N 2 0 342.430 4.461 20 0 EIADRP Clc1cccc2c1C[C@H]([NH2+]CC1CC[NH+](CC3CCC3)CC1)CC2 ZINC001170910379 1049178773 /nfs/dbraw/zinc/17/87/73/1049178773.db2.gz GYYGKPCAXJKGFH-LJQANCHMSA-N 2 0 346.946 4.299 20 0 EIADRP CCCC[NH+]1CCC(C[NH2+][C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170910997 1049185281 /nfs/dbraw/zinc/18/52/81/1049185281.db2.gz SUQYYKXWPHUPRX-SFHVURJKSA-N 2 0 334.935 4.299 20 0 EIADRP CCC(CC)[NH+]1CCC([NH2+][C@H]2CCc3c(F)cc(F)cc3C2)CC1 ZINC001171352823 1049506704 /nfs/dbraw/zinc/50/67/04/1049506704.db2.gz BRRWRHQFBYFOGM-KRWDZBQOSA-N 2 0 336.470 4.065 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@H]2CCc3c(F)cc(F)cc3C2)CC1 ZINC001171357408 1049511353 /nfs/dbraw/zinc/51/13/53/1049511353.db2.gz LPYVXVOSVYTSFN-WDSOQIARSA-N 2 0 348.481 4.337 20 0 EIADRP CC(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cc(F)cc(F)c2C1 ZINC001170681252 1049523927 /nfs/dbraw/zinc/52/39/27/1049523927.db2.gz NKUKVLOSACCJQK-KZNAEPCWSA-N 2 0 336.470 4.050 20 0 EIADRP CSC(C)(C)C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000820813090 1049557961 /nfs/dbraw/zinc/55/79/61/1049557961.db2.gz YOROQKGICSMDDA-YQQQUEKLSA-N 2 0 332.557 4.303 20 0 EIADRP CCCCC[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)c1ccccc1 ZINC000773069316 1049564835 /nfs/dbraw/zinc/56/48/35/1049564835.db2.gz NXNBSPAQALVQKW-FKBYEOEOSA-N 2 0 344.543 4.275 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)c1ccc2c(c1)CCO2 ZINC000773079752 1049570267 /nfs/dbraw/zinc/57/02/67/1049570267.db2.gz YVNXBFMWAAPUND-PXNSSMCTSA-N 2 0 330.516 4.030 20 0 EIADRP Fc1cccc2c1CC[C@H]([NH2+]C1CC[NH+](C[C@@H]3CC=CCC3)CC1)C2 ZINC001171419778 1049655651 /nfs/dbraw/zinc/65/56/51/1049655651.db2.gz UWLNMZPOMAETSC-XLIONFOSSA-N 2 0 342.502 4.093 20 0 EIADRP CSCCCCC[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716641418 1049702154 /nfs/dbraw/zinc/70/21/54/1049702154.db2.gz ZVBLVQHJQDBAAB-ZCNNSNEGSA-N 2 0 332.557 4.162 20 0 EIADRP Fc1cc2c(cc1F)C[C@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)CC2 ZINC001171486353 1049717049 /nfs/dbraw/zinc/71/70/49/1049717049.db2.gz BPLIABWPBCWRNO-RTBURBONSA-N 2 0 348.481 4.163 20 0 EIADRP Cc1cccc2c1CC[C@H]([N@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171557400 1049754743 /nfs/dbraw/zinc/75/47/43/1049754743.db2.gz APYGVZYFYLSYRR-UFYCRDLUSA-N 2 0 328.544 4.470 20 0 EIADRP Cc1cccc2c1CC[C@@H]([N@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171557456 1049754826 /nfs/dbraw/zinc/75/48/26/1049754826.db2.gz CEDMNRXDUBVDAG-HMXCVIKNSA-N 2 0 326.528 4.367 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)CCC2 ZINC001171628588 1049762676 /nfs/dbraw/zinc/76/26/76/1049762676.db2.gz BYPDCYYJFSQLEE-LJQANCHMSA-N 2 0 330.516 4.314 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1OC ZINC001171619818 1049766176 /nfs/dbraw/zinc/76/61/76/1049766176.db2.gz RJVUYSHNLKYFHE-AWEZNQCLSA-N 2 0 334.504 4.006 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@H](c2ccnc(Cl)c2)C2CC2)CC1(C)C ZINC001171624483 1049768650 /nfs/dbraw/zinc/76/86/50/1049768650.db2.gz SXNRJVRWQZOCRK-KRWDZBQOSA-N 2 0 335.923 4.427 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH+]2CCC([NH3+])(Cc3ccccc3)CC2)cc1 ZINC001171666031 1049772722 /nfs/dbraw/zinc/77/27/22/1049772722.db2.gz LHZBEFVJRNBCJJ-FQEVSTJZSA-N 2 0 336.523 4.352 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1 ZINC001171664396 1049772928 /nfs/dbraw/zinc/77/29/28/1049772928.db2.gz ZBVYISIZJREAGV-IBGZPJMESA-N 2 0 340.511 4.046 20 0 EIADRP Cc1ccc(CC[C@@H](C)[NH+]2CCC([NH+]3CCC(F)CC3)CC2)cc1 ZINC001171680081 1049777814 /nfs/dbraw/zinc/77/78/14/1049777814.db2.gz PFOJONAANTUGCJ-GOSISDBHSA-N 2 0 332.507 4.214 20 0 EIADRP C[NH2+]CCc1cn(C2CC(C)(C)[NH+](C)C(C)(C)C2)c2ccccc12 ZINC001171641401 1049779126 /nfs/dbraw/zinc/77/91/26/1049779126.db2.gz GBDRJQSZHJLCRA-UHFFFAOYSA-N 2 0 327.516 4.227 20 0 EIADRP C[NH+]1C(C)(C)CC([N@@H+]2CCC[C@@H](OCc3ccccc3)C2)CC1(C)C ZINC001171639456 1049779670 /nfs/dbraw/zinc/77/96/70/1049779670.db2.gz KMIZEHLMSCAQPA-HXUWFJFHSA-N 2 0 344.543 4.319 20 0 EIADRP Cc1cccc2c(CC[NH3+])cn([C@H]3C[C@H](C)[N@@H+](Cc4ccccc4)C3)c21 ZINC001171726356 1049785211 /nfs/dbraw/zinc/78/52/11/1049785211.db2.gz VERMBNJPXMICEV-RXVVDRJESA-N 2 0 347.506 4.286 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171731438 1049787244 /nfs/dbraw/zinc/78/72/44/1049787244.db2.gz BCAYVCOJERKCFZ-RCZSKKKRSA-N 2 0 349.522 4.258 20 0 EIADRP C[N@H+]([C@@H]1Cc2cccc(F)c2C1)C1CC[NH+](C2CCCCC2)CC1 ZINC001171812148 1049809319 /nfs/dbraw/zinc/80/93/19/1049809319.db2.gz LIXFTXGDHWSXSL-LJQANCHMSA-N 2 0 330.491 4.022 20 0 EIADRP CCC[NH+](CCC)CCN[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171964713 1049826695 /nfs/dbraw/zinc/82/66/95/1049826695.db2.gz HGELNKDAIZLUNH-OAQYLSRUSA-N 2 0 345.575 4.141 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)n1cc(CC[NH3+])c2c[nH+]ccc21 ZINC001171967269 1049827524 /nfs/dbraw/zinc/82/75/24/1049827524.db2.gz ZOBSSLMYGACTQC-ZDUSSCGKSA-N 2 0 347.384 4.360 20 0 EIADRP COCC(C)(C)C[NH2+][C@H](C)c1ccc(OC)c(C[NH+]2CCCCC2)c1 ZINC000813883295 1049831395 /nfs/dbraw/zinc/83/13/95/1049831395.db2.gz SFFIHKYGARONKC-QGZVFWFLSA-N 2 0 348.531 4.004 20 0 EIADRP C[C@@H](CCCC(C)(C)O)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171972610 1049834733 /nfs/dbraw/zinc/83/47/33/1049834733.db2.gz RRDFWUDAAWBPHJ-AZUAARDMSA-N 2 0 346.559 4.349 20 0 EIADRP CC1(C)C[C@H]([NH2+]CCCc2cccnc2)CC[N@@H+]1Cc1ccccc1 ZINC001171972825 1049836238 /nfs/dbraw/zinc/83/62/38/1049836238.db2.gz SRQRDIYIQFTWOL-OAQYLSRUSA-N 2 0 337.511 4.047 20 0 EIADRP CC1(C)C[C@@H](NC2(c3cccnc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171977198 1049836844 /nfs/dbraw/zinc/83/68/44/1049836844.db2.gz YHKRTBBEMLWOFN-FQEVSTJZSA-N 2 0 335.495 4.104 20 0 EIADRP CC1(C)C[C@H](N2CC[C@](C)(F)[C@H](F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171976024 1049837118 /nfs/dbraw/zinc/83/71/18/1049837118.db2.gz HQLDSDPMRPKLFW-GGPKGHCWSA-N 2 0 336.470 4.202 20 0 EIADRP CC1(C)C[C@@H](n2cc3ccc(C[NH3+])cc3n2)CC[N@@H+]1Cc1ccccc1 ZINC001171976341 1049837678 /nfs/dbraw/zinc/83/76/78/1049837678.db2.gz RJPKADPWNVBUEV-FQEVSTJZSA-N 2 0 348.494 4.111 20 0 EIADRP CCCOC1CC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171980372 1049839394 /nfs/dbraw/zinc/83/93/94/1049839394.db2.gz DVWSNFQCAGDUHN-FQEVSTJZSA-N 2 0 344.543 4.321 20 0 EIADRP C[NH2+]Cc1ccc(N[C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)cc1 ZINC001171985746 1049840081 /nfs/dbraw/zinc/84/00/81/1049840081.db2.gz ZJJNVBQHDVHAAW-OAQYLSRUSA-N 2 0 337.511 4.261 20 0 EIADRP [NH3+]CCc1ccc(N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC001172062284 1049849648 /nfs/dbraw/zinc/84/96/48/1049849648.db2.gz LUCAPIZOWFWNDK-WBDAEOGXSA-N 2 0 349.522 4.185 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]C2Cc4ccccc4C2)C3)cc1 ZINC001172066677 1049850994 /nfs/dbraw/zinc/85/09/94/1049850994.db2.gz JRHBTYWCRLVJAT-JOZNFPNDSA-N 2 0 346.518 4.329 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCCOC2CCCC2)C3)cc1 ZINC000245778293 1049854414 /nfs/dbraw/zinc/85/44/14/1049854414.db2.gz YLGQGXSELFQXNX-WKCHPHFGSA-N 2 0 342.527 4.121 20 0 EIADRP C[C@@H]1OC2(CC[NH+]([C@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4C)CC2)c2ccccc21 ZINC001172133959 1049854663 /nfs/dbraw/zinc/85/46/63/1049854663.db2.gz UUGCNAIWIKHFIE-INDMIFKZSA-N 2 0 340.511 4.084 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCc1cccc(Cl)c1Cl)C2 ZINC001172103980 1049857356 /nfs/dbraw/zinc/85/73/56/1049857356.db2.gz YJBWADCSVWNWMH-QDMKHBRRSA-N 2 0 327.299 4.141 20 0 EIADRP Cc1ccc2c(c1)C1(CC2)CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)CC1 ZINC001172115489 1049858374 /nfs/dbraw/zinc/85/83/74/1049858374.db2.gz GZTOBWOSJCYMRN-AERCQKQUSA-N 2 0 338.539 4.290 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+]C3C[C@@H]4C=C[C@H](C3)O4)[C@H](C)C2)CC[C@H]1[NH3+] ZINC001172235308 1049870196 /nfs/dbraw/zinc/87/01/96/1049870196.db2.gz XPPFTCOFIOIPJD-IRAMRTJLSA-N 2 0 346.559 4.020 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@H]2CCc3c(Cl)cccc3C2)C[C@](C)(C[NH3+])C1 ZINC001171027798 1049872092 /nfs/dbraw/zinc/87/20/92/1049872092.db2.gz TUDJIGJUGNRZHS-FTRWYGJKSA-N 2 0 334.935 4.331 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H](CC2CCC2)c2cccc(F)c2)CC1 ZINC001172248620 1049872285 /nfs/dbraw/zinc/87/22/85/1049872285.db2.gz KVMXVQPBWSBRPT-OAQYLSRUSA-N 2 0 348.506 4.148 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CC2)[C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171030501 1049875131 /nfs/dbraw/zinc/87/51/31/1049875131.db2.gz MEGFNTRBVUJQJA-KZNAEPCWSA-N 2 0 332.919 4.179 20 0 EIADRP CC[C@@H](C)OCC[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172315279 1049875459 /nfs/dbraw/zinc/87/54/59/1049875459.db2.gz BLJRQWGABSLJAU-PLSULTGPSA-N 2 0 344.543 4.365 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001172322109 1049878306 /nfs/dbraw/zinc/87/83/06/1049878306.db2.gz RUIJTUXHWIEHBU-ZJOUEHCJSA-N 2 0 332.532 4.082 20 0 EIADRP CC[C@@H](C)OCC[C@@H](C)[N@H+](C)C1CCN(Cc2ccccc2)CC1 ZINC001172327957 1049885808 /nfs/dbraw/zinc/88/58/08/1049885808.db2.gz AENGEPFONOVMPI-RTBURBONSA-N 2 0 332.532 4.177 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)[C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171045966 1049898467 /nfs/dbraw/zinc/89/84/67/1049898467.db2.gz VXTDYPZLYUSGGW-GOSISDBHSA-N 2 0 334.935 4.250 20 0 EIADRP CCCCCC[C@@H](CCC)[NH+]1CCN(CC2CC[NH+](C)CC2)CC1 ZINC001172382933 1049903345 /nfs/dbraw/zinc/90/33/45/1049903345.db2.gz IQURWQZRGUOWHC-OAQYLSRUSA-N 2 0 337.596 4.085 20 0 EIADRP CCCCCC[C@H](CCC)[NH2+][C@H](CCC[NH3+])NC(=O)OC(C)(C)C ZINC001172391974 1049905487 /nfs/dbraw/zinc/90/54/87/1049905487.db2.gz UTBMGFHUXHYFHE-IRXDYDNUSA-N 2 0 343.556 4.305 20 0 EIADRP CC[C@@H](CC(C)C)[NH+]1CCC2(CC[N@H+](Cc3cccnc3)C2)CC1 ZINC001172396477 1049907157 /nfs/dbraw/zinc/90/71/57/1049907157.db2.gz DFCJIUURFJMGCW-FQEVSTJZSA-N 2 0 329.532 4.194 20 0 EIADRP [NH3+]C1(Cc2ccccc2)CC[NH+]([C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172558554 1049932596 /nfs/dbraw/zinc/93/25/96/1049932596.db2.gz YRDIIVXMMTXTPR-FGZHOGPDSA-N 2 0 334.507 4.359 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC[C@@H]1CCC[N@H+](C)C1 ZINC001172575649 1049941448 /nfs/dbraw/zinc/94/14/48/1049941448.db2.gz JOBGNSNWNYYBAT-KGLIPLIRSA-N 2 0 344.877 4.261 20 0 EIADRP CC(C)OC(=O)CC[C@@H](C)[NH2+]CCCCCCCCCCC[NH3+] ZINC001172746840 1049970485 /nfs/dbraw/zinc/97/04/85/1049970485.db2.gz UCHXBLZJMGAXDW-GOSISDBHSA-N 2 0 328.541 4.166 20 0 EIADRP CC(C)(C)C[N@H+]([C@H]1Cc2ccc(Cl)cc2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172711926 1049971816 /nfs/dbraw/zinc/97/18/16/1049971816.db2.gz JOMYPMSRUGFIGJ-FHWLQOOXSA-N 2 0 334.935 4.425 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2sc(-c3ccc(C)cc3)nc2C)C1 ZINC000246851461 1050002930 /nfs/dbraw/zinc/00/29/30/1050002930.db2.gz COIYEYQSBOTCQA-WBVHZDCISA-N 2 0 343.540 4.419 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](CC)c2ccc(OC(F)F)cc2)C1 ZINC000246969522 1050007569 /nfs/dbraw/zinc/00/75/69/1050007569.db2.gz IZPAJPSNOYOGFZ-RHSMWYFYSA-N 2 0 326.431 4.061 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccncc1 ZINC000247487662 1050025307 /nfs/dbraw/zinc/02/53/07/1050025307.db2.gz VJZAOXZMVVYRPW-GUDVDZBRSA-N 2 0 337.511 4.410 20 0 EIADRP Cc1nc(-c2ccc(CC[NH2+][C@@H]3C[C@H](C)[N@@H+](C)C[C@H]3C)s2)cs1 ZINC000248050823 1050040351 /nfs/dbraw/zinc/04/03/51/1050040351.db2.gz WFPMFNCRTBEFOW-DVOMOZLQSA-N 2 0 349.569 4.041 20 0 EIADRP CCOc1ccc([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000089215378 1050111846 /nfs/dbraw/zinc/11/18/46/1050111846.db2.gz MEQYLCLINIAOKW-QGZVFWFLSA-N 2 0 339.483 4.048 20 0 EIADRP CCc1ccc([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)s1 ZINC000089214972 1050111861 /nfs/dbraw/zinc/11/18/61/1050111861.db2.gz DDPDUTJRLXTDNM-OAHLLOKOSA-N 2 0 329.513 4.273 20 0 EIADRP CCC(CC)[C@H](C[NH2+]C[C@H]1CCOc2ccccc21)[NH+]1CCCC1 ZINC001177198915 1050158982 /nfs/dbraw/zinc/15/89/82/1050158982.db2.gz ANHYAAVMBPREMG-QUCCMNQESA-N 2 0 330.516 4.043 20 0 EIADRP C[NH+](C)CC1CCC([NH2+]C2CCC(Cc3ccccc3)CC2)CC1 ZINC001172822938 1050163701 /nfs/dbraw/zinc/16/37/01/1050163701.db2.gz PVDAHNGGWHIFMG-UHFFFAOYSA-N 2 0 328.544 4.498 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([N@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172827726 1050166593 /nfs/dbraw/zinc/16/65/93/1050166593.db2.gz DJHSADCWHOYEPM-NJDAHSKKSA-N 2 0 328.544 4.470 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H]1CCCC(C)(C)C1 ZINC001177294135 1050178646 /nfs/dbraw/zinc/17/86/46/1050178646.db2.gz GLPNGCOVDLGVID-IBGZPJMESA-N 2 0 332.532 4.466 20 0 EIADRP CSc1ccc(CNC2CC[NH+](Cc3ccccc3C)CC2)o1 ZINC001177315415 1050190042 /nfs/dbraw/zinc/19/00/42/1050190042.db2.gz ZCCPKQTXKQMKQS-UHFFFAOYSA-N 2 0 330.497 4.064 20 0 EIADRP C[NH+]1CCC(c2ccc(Nc3cc[nH+]c(N4CCCC4)c3)cc2)CC1 ZINC001212688913 1050222993 /nfs/dbraw/zinc/22/29/93/1050222993.db2.gz BQJTUGUVPZZONH-UHFFFAOYSA-N 2 0 336.483 4.235 20 0 EIADRP CC(C)CC[C@@H]1CC[C@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)C1 ZINC001177529924 1050242003 /nfs/dbraw/zinc/24/20/03/1050242003.db2.gz UXAMUHPDTZYRCW-QUCCMNQESA-N 2 0 332.532 4.322 20 0 EIADRP CO[C@@H]1CCC[C@H]([N@H+]2C[C@H]3c4ccccc4[C@H]([NH+](C)C(C)C)[C@H]3C2)C1 ZINC001172943937 1050242279 /nfs/dbraw/zinc/24/22/79/1050242279.db2.gz VGVRMMORFWDIIV-OHJZQYHNSA-N 2 0 342.527 4.055 20 0 EIADRP COc1ccc([C@H]([NH2+]Cc2cccc(C[NH+](C)C)c2)C(C)C)cc1 ZINC000091281217 1050247991 /nfs/dbraw/zinc/24/79/91/1050247991.db2.gz SKAUFPPQXVRZND-OAQYLSRUSA-N 2 0 326.484 4.244 20 0 EIADRP Fc1ccc(/C=C/C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)cc1 ZINC001177582286 1050257002 /nfs/dbraw/zinc/25/70/02/1050257002.db2.gz WLLRACBUWHPWLR-QPJJXVBHSA-N 2 0 330.491 4.473 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+]Cc3cccc4ccccc43)C2)cc1 ZINC001177668928 1050272988 /nfs/dbraw/zinc/27/29/88/1050272988.db2.gz KKSRWJJZCJEDFP-OAQYLSRUSA-N 2 0 344.502 4.494 20 0 EIADRP CC[C@@H]1CCC[C@H]([NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)CC1 ZINC001177673903 1050274363 /nfs/dbraw/zinc/27/43/63/1050274363.db2.gz BMGWQLWKDLZXQU-QUCCMNQESA-N 2 0 332.532 4.466 20 0 EIADRP CCCOC1CCC([NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC1 ZINC001173090719 1050283704 /nfs/dbraw/zinc/28/37/04/1050283704.db2.gz GZGHHQSONSPDET-ITAUSPCMSA-N 2 0 344.543 4.226 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cc(Cl)ccc2OC)c1 ZINC001177737221 1050288527 /nfs/dbraw/zinc/28/85/27/1050288527.db2.gz LAQRAZFCAXPCND-UHFFFAOYSA-N 2 0 332.875 4.090 20 0 EIADRP C(CCC[NH2+]C1CC[NH+](C2CCCCC2)CC1)CCC[NH+]1CCCC1 ZINC001177737870 1050292567 /nfs/dbraw/zinc/29/25/67/1050292567.db2.gz WVUVSXNEDKNNQZ-UHFFFAOYSA-N 3 0 349.607 4.419 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2cc(-c3ccccc3)on2)CC1 ZINC001173103302 1050306332 /nfs/dbraw/zinc/30/63/32/1050306332.db2.gz HSXGIIWSPNCUIV-UHFFFAOYSA-N 2 0 327.472 4.084 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2cc(-c3ccccc3F)no2)CC1 ZINC001173110309 1050307316 /nfs/dbraw/zinc/30/73/16/1050307316.db2.gz MIKMMOBQYYJGSJ-UHFFFAOYSA-N 2 0 345.462 4.223 20 0 EIADRP CC[NH+](CC)C1CCC(Nc2ccc(C[NH3+])c(C(F)(F)F)c2)CC1 ZINC001173108104 1050308220 /nfs/dbraw/zinc/30/82/20/1050308220.db2.gz XRWZMKLCBPRAFO-UHFFFAOYSA-N 2 0 343.437 4.229 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CC2(Cc3cccc(OC)c3)CC2)CC1 ZINC001173109256 1050308427 /nfs/dbraw/zinc/30/84/27/1050308427.db2.gz AODVWGIGLSHION-UHFFFAOYSA-N 2 0 344.543 4.261 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCO[C@](C)(c3ccc(F)cc3)C2)CC1 ZINC001173112573 1050309713 /nfs/dbraw/zinc/30/97/13/1050309713.db2.gz CBYVICPSVABWCZ-CBNMVNINSA-N 2 0 348.506 4.026 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](c2cccnc2Cl)C2CC2)CC1 ZINC001173110650 1050311024 /nfs/dbraw/zinc/31/10/24/1050311024.db2.gz QLLAVTAWPAWMAE-HTWSVDAQSA-N 2 0 335.923 4.429 20 0 EIADRP CC[NH+](CC)C1CCC([N@H+](C)C2CC[NH+](C3CCCCC3)CC2)CC1 ZINC001173117494 1050315725 /nfs/dbraw/zinc/31/57/25/1050315725.db2.gz OBPBLDNYNATAGG-UHFFFAOYSA-N 3 0 349.607 4.368 20 0 EIADRP c1ccc(OC2CCC([NH2+]CCCCC[NH+]3CCCC3)CC2)cc1 ZINC001173201487 1050346030 /nfs/dbraw/zinc/34/60/30/1050346030.db2.gz ZOKOLYRBRPMDNE-UHFFFAOYSA-N 2 0 330.516 4.232 20 0 EIADRP CCc1ccc(C[C@H](C)[NH+]2CCC([NH3+])(Cc3ccccc3)CC2)cc1 ZINC001173249198 1050376424 /nfs/dbraw/zinc/37/64/24/1050376424.db2.gz KGZYYBHVHBGKKZ-IBGZPJMESA-N 2 0 336.523 4.216 20 0 EIADRP CCCC[C@H](CC(C)C)[NH2+]CC1CC[NH+](Cc2cccnc2)CC1 ZINC001173258052 1050382507 /nfs/dbraw/zinc/38/25/07/1050382507.db2.gz YWTKGFNMEBXHBA-OAQYLSRUSA-N 2 0 331.548 4.488 20 0 EIADRP CC[C@@H]1CC[C@@H](n2cc(CC[NH+]3CCC([NH3+])CC3)c3ccccc32)C1 ZINC001173269558 1050390420 /nfs/dbraw/zinc/39/04/20/1050390420.db2.gz XIGTYZNJSVDGSC-YLJYHZDGSA-N 2 0 339.527 4.358 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]C[C@H]3CCOc4ccccc43)CC2)CC1 ZINC001178280885 1050427120 /nfs/dbraw/zinc/42/71/20/1050427120.db2.gz YDFXUNLSDXCTPB-XEVCZEQESA-N 2 0 342.527 4.185 20 0 EIADRP Fc1ccccc1C[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC001178285383 1050429031 /nfs/dbraw/zinc/42/90/31/1050429031.db2.gz QAXIYOGTYUTDBU-KCZVDYSFSA-N 2 0 338.470 4.216 20 0 EIADRP CC[N@H+]([C@@H]1CCOC1)C1CC[NH+]([C@@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173343034 1050432002 /nfs/dbraw/zinc/43/20/02/1050432002.db2.gz GKYKFAJMGBBABW-NHCUHLMSSA-N 2 0 348.575 4.455 20 0 EIADRP c1ccc2c(c1)cccc2C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC001178304611 1050435109 /nfs/dbraw/zinc/43/51/09/1050435109.db2.gz NDQMGNVXRZQVOS-UHFFFAOYSA-N 2 0 331.463 4.241 20 0 EIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1Cl ZINC000092856871 1050480194 /nfs/dbraw/zinc/48/01/94/1050480194.db2.gz IJTIPWHREAGSDW-OAHLLOKOSA-N 2 0 329.875 4.302 20 0 EIADRP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1cccc(OC(F)F)c1 ZINC001178527655 1050491395 /nfs/dbraw/zinc/49/13/95/1050491395.db2.gz DUADDOAFUIGUEN-UHFFFAOYSA-N 2 0 340.458 4.422 20 0 EIADRP CCN1CCC([N@H+](C)C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173688978 1050540000 /nfs/dbraw/zinc/54/00/00/1050540000.db2.gz CSJOHCFGXIULBD-UHFFFAOYSA-N 2 0 326.528 4.229 20 0 EIADRP CC(=O)Oc1ccc(C2CCC([NH2+]CCCCCCC[NH3+])CC2)cc1 ZINC001173786254 1050570466 /nfs/dbraw/zinc/57/04/66/1050570466.db2.gz VUMROYOYFLYGSM-UHFFFAOYSA-N 2 0 346.515 4.137 20 0 EIADRP C[N@H+](CCCC[NH2+]Cc1ccc(SC(F)(F)F)cc1)C1CC1 ZINC001178873180 1050577599 /nfs/dbraw/zinc/57/75/99/1050577599.db2.gz QKHWLVKXJJRDHZ-UHFFFAOYSA-N 2 0 332.435 4.263 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1nc2c(s1)CCCC2 ZINC000093398278 1050585584 /nfs/dbraw/zinc/58/55/84/1050585584.db2.gz KSBHPZQJGDIKMT-CVEARBPZSA-N 2 0 335.561 4.185 20 0 EIADRP c1cncc(-c2cccc(C[N@H+]3CC[C@H](C[NH+]4CCCCC4)C3)c2)c1 ZINC000093683553 1050657895 /nfs/dbraw/zinc/65/78/95/1050657895.db2.gz AETPFLNUINTAGR-HXUWFJFHSA-N 2 0 335.495 4.056 20 0 EIADRP c1ccc(-c2cccc(C[N@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)c2)nc1 ZINC000093683705 1050658638 /nfs/dbraw/zinc/65/86/38/1050658638.db2.gz MDZOXWHVWOZCOR-FQEVSTJZSA-N 2 0 335.495 4.056 20 0 EIADRP CO[C@H]1CCC[C@H]([NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001179278724 1050668936 /nfs/dbraw/zinc/66/89/36/1050668936.db2.gz YHBCDTKZVXKOED-VXKWHMMOSA-N 2 0 344.543 4.226 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]C1CCc2ccccc2CC1 ZINC001179338364 1050679775 /nfs/dbraw/zinc/67/97/75/1050679775.db2.gz GKMNTOZAAUPNIX-WMZHIEFXSA-N 2 0 348.534 4.292 20 0 EIADRP COc1ccc(CN2CC[C@@H](C[NH+]3CCCCC3)C2)cc1C(C)(C)C ZINC001179877577 1050813119 /nfs/dbraw/zinc/81/31/19/1050813119.db2.gz HQRCMDVOPLUTFI-IBGZPJMESA-N 2 0 344.543 4.301 20 0 EIADRP CC[N@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)CC1(OC)CCCCC1 ZINC001179947912 1050827944 /nfs/dbraw/zinc/82/79/44/1050827944.db2.gz ZEZSXAKQSKSRFJ-NRFANRHFSA-N 2 0 344.543 4.180 20 0 EIADRP c1cn2cc(Nc3ccc4c(c3)CC[C@@H]([NH+]3CCCC3)CC4)ccc2[nH+]1 ZINC001174280054 1050860422 /nfs/dbraw/zinc/86/04/22/1050860422.db2.gz PCDOGVMSACWQTB-NRFANRHFSA-N 2 0 346.478 4.421 20 0 EIADRP c1ccc2c(c1)CC[C@@H]2C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC001180076892 1050874402 /nfs/dbraw/zinc/87/44/02/1050874402.db2.gz JZIKSJXOWFSUMD-OAQYLSRUSA-N 2 0 326.528 4.304 20 0 EIADRP COCC[N@H+](C)CCCC1CC[NH+](C[C@H](C)c2ccc(C)cc2)CC1 ZINC001180077800 1050877227 /nfs/dbraw/zinc/87/72/27/1050877227.db2.gz VMKWEUXEBNCHNP-FQEVSTJZSA-N 2 0 346.559 4.169 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(N(C)c3ccccc3)cc2)C1 ZINC000619772503 1050908382 /nfs/dbraw/zinc/90/83/82/1050908382.db2.gz JGHQESKZPMLGOC-FQEVSTJZSA-N 2 0 337.511 4.276 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(C(F)F)c(F)c2)CC1 ZINC001180164848 1050910319 /nfs/dbraw/zinc/91/03/19/1050910319.db2.gz CJYWOWYDLBAIJE-UHFFFAOYSA-N 2 0 328.422 4.316 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)C1CCCC1 ZINC001180301653 1050945452 /nfs/dbraw/zinc/94/54/52/1050945452.db2.gz OUDFYHZMGVUPNG-KVJIRVJXSA-N 2 0 326.528 4.455 20 0 EIADRP Cc1ccc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)s2)cc1 ZINC000620109487 1051024776 /nfs/dbraw/zinc/02/47/76/1051024776.db2.gz JLZQDFKRUGVFEU-QZTJIDSGSA-N 2 0 326.509 4.440 20 0 EIADRP C[C@@H]1CCCc2ccccc2[C@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC001180622199 1051042823 /nfs/dbraw/zinc/04/28/23/1051042823.db2.gz CLRFXDOFHRPPFK-VGSWGCGISA-N 2 0 335.495 4.354 20 0 EIADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1CCCc2cc(SC(F)F)ccc21 ZINC000775380433 1051174799 /nfs/dbraw/zinc/17/47/99/1051174799.db2.gz IPQFGRPCLISZLH-BLLLJJGKSA-N 2 0 328.472 4.309 20 0 EIADRP CC(C)(C)[C@]1(C[NH2+][C@@H]2CSC2(C)C)CC[N@H+](Cc2ccccc2)C1 ZINC001181204821 1051180360 /nfs/dbraw/zinc/18/03/60/1051180360.db2.gz IMBBSNPNWGJUDA-NQIIRXRSSA-N 2 0 346.584 4.408 20 0 EIADRP C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+]CCN1CCCC(C)(C)C1 ZINC001181244097 1051183639 /nfs/dbraw/zinc/18/36/39/1051183639.db2.gz MRBWZECKULEPLX-HNNXBMFYSA-N 2 0 342.449 4.348 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000544573856 1051194655 /nfs/dbraw/zinc/19/46/55/1051194655.db2.gz ZKSAYQHFDGPYIQ-MSOLQXFVSA-N 2 0 326.484 4.081 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@@H]2CCCSC2)ccc1OC ZINC000775397546 1051218023 /nfs/dbraw/zinc/21/80/23/1051218023.db2.gz WDDAHFHITGUISV-CRAIPNDOSA-N 2 0 336.545 4.083 20 0 EIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](CC3([C@@H]4CCCCO4)CCC3)C2)CC1 ZINC001190651128 1051244707 /nfs/dbraw/zinc/24/47/07/1051244707.db2.gz JFEXTMCRUHUJDX-SFTDATJTSA-N 2 0 348.575 4.170 20 0 EIADRP C[NH+](C)CCCC[NH2+]Cc1ccc(Oc2cc(F)cc(F)c2)cc1 ZINC000620761173 1051280806 /nfs/dbraw/zinc/28/08/06/1051280806.db2.gz MSHQTXUQYKAWOM-UHFFFAOYSA-N 2 0 334.410 4.189 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccc[nH]2)ccc1OC ZINC000775425332 1051317234 /nfs/dbraw/zinc/31/72/34/1051317234.db2.gz XTDBTCFPNWNQAY-HZPDHXFCSA-N 2 0 329.488 4.277 20 0 EIADRP COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc[nH]2)cc1C[NH+]1CCCCC1 ZINC000775425299 1051317430 /nfs/dbraw/zinc/31/74/30/1051317430.db2.gz XOENLWBRRLWMMG-SJORKVTESA-N 2 0 341.499 4.421 20 0 EIADRP CC(C)CCOCC[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001191359273 1051441289 /nfs/dbraw/zinc/44/12/89/1051441289.db2.gz SXKLWBYIMWZHRI-JOCHJYFZSA-N 2 0 344.543 4.037 20 0 EIADRP Cc1nc(C[NH+]2CCC3(CC[NH+](C)CC3)CC2)sc1C(C)(C)C ZINC001175219244 1051450563 /nfs/dbraw/zinc/45/05/63/1051450563.db2.gz AJWCJWYKSAMIIQ-UHFFFAOYSA-N 2 0 335.561 4.057 20 0 EIADRP CCC[NH+]1CCC([N@H+](C)CCc2cc(Cl)cc(Cl)c2)CC1 ZINC001191417509 1051452710 /nfs/dbraw/zinc/45/27/10/1051452710.db2.gz OBELJKFOHZKGMK-UHFFFAOYSA-N 2 0 329.315 4.342 20 0 EIADRP Cc1c(C)c(C)c(C[NH+]2CC[C@@H](C[N@H+](C)CC3CC3)C2)c(C)c1C ZINC001191444108 1051459732 /nfs/dbraw/zinc/45/97/32/1051459732.db2.gz IEJFIRAZNXXCQP-NRFANRHFSA-N 2 0 328.544 4.392 20 0 EIADRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2c(Cl)cccc2C(F)(F)F)CC1 ZINC001205570118 1051518971 /nfs/dbraw/zinc/51/89/71/1051518971.db2.gz GGPZBTWBCWWJMX-AWEZNQCLSA-N 2 0 338.776 4.012 20 0 EIADRP C[C@H]([NH2+]CCCCCCC[NH+]1CCCC1)c1nc2ccccc2n1C ZINC000774411744 1051583228 /nfs/dbraw/zinc/58/32/28/1051583228.db2.gz QZFOSXFKZUOYJI-SFHVURJKSA-N 2 0 342.531 4.270 20 0 EIADRP C[C@]1(Cc2ccc(F)c(F)c2)CCC[N@@H+]1CCC[NH+]1CCCCC1 ZINC001175492712 1051618113 /nfs/dbraw/zinc/61/81/13/1051618113.db2.gz QOPDDQYDEPIVLX-HXUWFJFHSA-N 2 0 336.470 4.238 20 0 EIADRP Cc1noc(C)c1[C@@H](C)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000671111878 1051637905 /nfs/dbraw/zinc/63/79/05/1051637905.db2.gz RTONNJVBZIQJLO-APMMTJHUSA-N 2 0 341.499 4.385 20 0 EIADRP CC(C)C[N@H+](CCc1nsc2ccccc21)CC1CC[NH+](C)CC1 ZINC001175601578 1051667518 /nfs/dbraw/zinc/66/75/18/1051667518.db2.gz OXBMLQFGWVNDIZ-UHFFFAOYSA-N 2 0 345.556 4.139 20 0 EIADRP CCc1cccc(C[NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)c1 ZINC001182683869 1051671602 /nfs/dbraw/zinc/67/16/02/1051671602.db2.gz HNIRKEHWZVVIRX-ZRBLBEILSA-N 2 0 334.507 4.392 20 0 EIADRP Clc1ccc(C[NH+]2CCN(c3cc[nH+]cc3)CC2)c2ccccc12 ZINC001192233607 1051674278 /nfs/dbraw/zinc/67/42/78/1051674278.db2.gz HKHUVHGYWYCDDW-UHFFFAOYSA-N 2 0 337.854 4.210 20 0 EIADRP CCc1ccccc1C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000157940698 1051687590 /nfs/dbraw/zinc/68/75/90/1051687590.db2.gz CJEGJBNBHHSJRS-QGZVFWFLSA-N 2 0 326.484 4.040 20 0 EIADRP C[C@H]1c2ccccc2C[C@H]1[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1 ZINC001182805610 1051701377 /nfs/dbraw/zinc/70/13/77/1051701377.db2.gz FGOPHISSJHJAOS-WOSNLTMFSA-N 2 0 326.528 4.348 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+]C2CC(c3ccc(F)cc3F)C2)CC1 ZINC001183146416 1051793996 /nfs/dbraw/zinc/79/39/96/1051793996.db2.gz VRJSCMJAVVRKBY-UHFFFAOYSA-N 2 0 336.470 4.311 20 0 EIADRP C[C@H]1CC[N@H+](CCCc2ccc(Cl)c(Cl)c2)CC[C@H]1C[NH3+] ZINC001205604869 1051795255 /nfs/dbraw/zinc/79/52/55/1051795255.db2.gz YIORDIYVIJNARP-ZFWWWQNUSA-N 2 0 329.315 4.233 20 0 EIADRP CN(C)c1ccc(N2CCC([NH2+]C3(Cc4ccccc4)CC3)CC2)cc1 ZINC000775565816 1051858900 /nfs/dbraw/zinc/85/89/00/1051858900.db2.gz PTSRMQSTCIWNBK-UHFFFAOYSA-N 2 0 349.522 4.086 20 0 EIADRP Cc1cc(C[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)cs1 ZINC001193092683 1051876144 /nfs/dbraw/zinc/87/61/44/1051876144.db2.gz FYZBLEDBKOURSW-IGOJGBNBSA-N 2 0 328.525 4.303 20 0 EIADRP C[C@H]1CC[N@H+](Cc2c(Cl)cccc2C(F)(F)F)CC[C@@H]1C[NH3+] ZINC001205628555 1051915271 /nfs/dbraw/zinc/91/52/71/1051915271.db2.gz VZXUTCYMPLUGOM-NWDGAFQWSA-N 2 0 334.813 4.166 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCC(C)(C)CO1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001184045756 1051943333 /nfs/dbraw/zinc/94/33/33/1051943333.db2.gz QCTHVMYNINRUCM-CEWLAPEOSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CC[C@@H]2CCC(F)(F)C2)CC1 ZINC001184238700 1051976416 /nfs/dbraw/zinc/97/64/16/1051976416.db2.gz FANRHIHDPDPSER-RYRKJORJSA-N 2 0 328.491 4.445 20 0 EIADRP C[NH+](C)[C@@H]1CC[C@@H]2C[N@H+](Cc3cc(F)cc(C(F)(F)F)c3)C[C@H]2C1 ZINC001184303249 1051982227 /nfs/dbraw/zinc/98/22/27/1051982227.db2.gz NZSBTSAGSRRTRN-CKEIUWERSA-N 2 0 344.396 4.007 20 0 EIADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H](CCc3ccccc3)Cc3ccccc3)[C@H]2C1 ZINC001184389488 1052002149 /nfs/dbraw/zinc/00/21/49/1052002149.db2.gz XKFWUXZHWNYIKD-ZJZGAYNASA-N 2 0 348.534 4.160 20 0 EIADRP C[NH+]1CCC2(CCC[N@H+](CCSc3cccc(Cl)c3)C2)CC1 ZINC001193873173 1052022310 /nfs/dbraw/zinc/02/23/10/1052022310.db2.gz SZZALHPMHLCBOM-UHFFFAOYSA-N 2 0 338.948 4.240 20 0 EIADRP Cc1ccc(C[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)c(C)c1 ZINC000164484851 1052031483 /nfs/dbraw/zinc/03/14/83/1052031483.db2.gz MXEYLOPSFDUDIN-GOSISDBHSA-N 2 0 326.484 4.095 20 0 EIADRP Cc1cccc2[nH]cc(CC[NH2+]C3CC[NH+](C4CCCCC4)CC3)c21 ZINC000165217968 1052054988 /nfs/dbraw/zinc/05/49/88/1052054988.db2.gz WCBIABVECYINKA-UHFFFAOYSA-N 2 0 339.527 4.406 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000165888710 1052078756 /nfs/dbraw/zinc/07/87/56/1052078756.db2.gz JRFKXJJDDMJNPE-ZWKOTPCHSA-N 2 0 326.484 4.347 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCCc2ccc(O)cc21 ZINC000336890329 1052107119 /nfs/dbraw/zinc/10/71/19/1052107119.db2.gz NNXMLDJSVYXAMH-JOCHJYFZSA-N 2 0 338.495 4.401 20 0 EIADRP C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1cccc(OC(F)F)c1 ZINC000298513398 1052113491 /nfs/dbraw/zinc/11/34/91/1052113491.db2.gz RBVNMRBCUMXEMG-CQSZACIVSA-N 2 0 347.409 4.003 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccccc1 ZINC000171133060 1052397817 /nfs/dbraw/zinc/39/78/17/1052397817.db2.gz QKLIIJPFYBJZFE-NRFANRHFSA-N 2 0 326.484 4.258 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccccc1 ZINC000171133068 1052397882 /nfs/dbraw/zinc/39/78/82/1052397882.db2.gz QKLIIJPFYBJZFE-OAQYLSRUSA-N 2 0 326.484 4.258 20 0 EIADRP c1cc2c(s1)CCC[C@H]2[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000336707950 1052513273 /nfs/dbraw/zinc/51/32/73/1052513273.db2.gz JFXYQAFAHHBICT-IEBWSBKVSA-N 2 0 326.509 4.237 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cc1OC ZINC000173411289 1052544656 /nfs/dbraw/zinc/54/46/56/1052544656.db2.gz VAXQQKBIQRYQOL-KRWDZBQOSA-N 2 0 334.504 4.011 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cc1OC ZINC000173411302 1052545038 /nfs/dbraw/zinc/54/50/38/1052545038.db2.gz VAXQQKBIQRYQOL-QGZVFWFLSA-N 2 0 334.504 4.011 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)C1 ZINC000339069041 1052552104 /nfs/dbraw/zinc/55/21/04/1052552104.db2.gz QMTQCNBNPDQVNN-RZUBCFFCSA-N 2 0 344.543 4.256 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000671298593 1052590640 /nfs/dbraw/zinc/59/06/40/1052590640.db2.gz RNQHKZKSIOUJQD-ROUUACIJSA-N 2 0 338.417 4.193 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CN[C@H]1CC[NH+](C)C(C)(C)C1 ZINC000623357837 1052632271 /nfs/dbraw/zinc/63/22/71/1052632271.db2.gz CAZRBZRLHWWQQM-NQIIRXRSSA-N 2 0 343.559 4.023 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cc(Cl)ccc1O ZINC000185634330 1052663368 /nfs/dbraw/zinc/66/33/68/1052663368.db2.gz HLMXEGZDLMRZMU-CQSZACIVSA-N 2 0 336.907 4.493 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(Br)cc1 ZINC000177199404 1052674879 /nfs/dbraw/zinc/67/48/79/1052674879.db2.gz STLHGYRENOKRCV-AWEZNQCLSA-N 2 0 347.300 4.362 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCOc1ccccc1-c1ccccc1 ZINC000177933349 1052694249 /nfs/dbraw/zinc/69/42/49/1052694249.db2.gz RGILGGXUTLPYBU-LQWHRVPQSA-N 2 0 338.495 4.051 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCCC[C@@H]2Sc2ccc(F)cc2)C1 ZINC000624008963 1052855410 /nfs/dbraw/zinc/85/54/10/1052855410.db2.gz LWIFCDRUTWPOJY-FXECBMLZSA-N 2 0 336.520 4.159 20 0 EIADRP COc1ccc(C2CCC([NH2+]C[C@H]3CCCC[N@H+](C)C3)CC2)cc1 ZINC000624121874 1052867294 /nfs/dbraw/zinc/86/72/94/1052867294.db2.gz FCTUWUIVOPKRLN-PGYGNJIDSA-N 2 0 330.516 4.043 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)c1ccc(F)cc1C(F)(F)F ZINC000624125005 1052868184 /nfs/dbraw/zinc/86/81/84/1052868184.db2.gz QUOXXPWTDWFLTH-CHWSQXEVSA-N 2 0 332.385 4.227 20 0 EIADRP C[C@@H]([NH2+]Cc1cc(F)cc2cccnc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185722914 1053021613 /nfs/dbraw/zinc/02/16/13/1053021613.db2.gz FBDFHONQBNRCFN-WBVHZDCISA-N 2 0 341.474 4.117 20 0 EIADRP Fc1cc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1Cl ZINC000380910871 1053047240 /nfs/dbraw/zinc/04/72/40/1053047240.db2.gz LQOYBRAFXOJGPH-QGZVFWFLSA-N 2 0 332.850 4.091 20 0 EIADRP Cc1oc2ccccc2c1C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381134585 1053054724 /nfs/dbraw/zinc/05/47/24/1053054724.db2.gz AEUCCACRWBUTMA-LJQANCHMSA-N 2 0 334.463 4.353 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000381210919 1053058449 /nfs/dbraw/zinc/05/84/49/1053058449.db2.gz UMPYGVHSJCBSQG-HMFYCAOWSA-N 2 0 338.495 4.084 20 0 EIADRP CCOc1ccccc1C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381307075 1053066227 /nfs/dbraw/zinc/06/62/27/1053066227.db2.gz BYIFGXXADYLXQX-RXVVDRJESA-N 2 0 338.495 4.086 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1ccc(C(F)F)nc1 ZINC000850438637 1053211404 /nfs/dbraw/zinc/21/14/04/1053211404.db2.gz BYIKHYHAYWNLFS-ODIFPOPNSA-N 2 0 337.458 4.467 20 0 EIADRP COC1([C@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CCC1 ZINC000850470610 1053250087 /nfs/dbraw/zinc/25/00/87/1053250087.db2.gz GAIMRDDYZRJUQQ-XSLAUPDRSA-N 2 0 342.527 4.119 20 0 EIADRP CCCCC[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)C(C)(C)C ZINC000850482765 1053252432 /nfs/dbraw/zinc/25/24/32/1053252432.db2.gz LPWJQRLAFGQAIR-FQEVSTJZSA-N 2 0 338.580 4.462 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@H]2CCOC2(C)C)ccc1OC ZINC000850570787 1053325226 /nfs/dbraw/zinc/32/52/26/1053325226.db2.gz IWTBLYHAACMWCY-QFBILLFUSA-N 2 0 348.531 4.003 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(C)o1 ZINC000383543015 1053352561 /nfs/dbraw/zinc/35/25/61/1053352561.db2.gz UXPFVLFNVNGUBZ-ABSDTBQOSA-N 2 0 326.484 4.458 20 0 EIADRP COc1ccc(CC[C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000764966306 1053402932 /nfs/dbraw/zinc/40/29/32/1053402932.db2.gz ODCACVSTSRXKNH-LJQANCHMSA-N 2 0 332.532 4.118 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)s1 ZINC000765307576 1053502867 /nfs/dbraw/zinc/50/28/67/1053502867.db2.gz ZXFMQNKWSQYDHZ-HOTGVXAUSA-N 2 0 332.513 4.409 20 0 EIADRP C[C@@H](CSC(C)(C)C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000765322153 1053506901 /nfs/dbraw/zinc/50/69/01/1053506901.db2.gz BJFDFWMABMYFSF-KRWDZBQOSA-N 2 0 334.573 4.408 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1cccc(F)c1 ZINC000765358986 1053514262 /nfs/dbraw/zinc/51/42/62/1053514262.db2.gz JLFRFOQWVDDVNN-IRXDYDNUSA-N 2 0 344.474 4.220 20 0 EIADRP C[C@H](Cc1ccc(F)cc1)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000385671929 1053541869 /nfs/dbraw/zinc/54/18/69/1053541869.db2.gz DXSHQXWENFQPIQ-LVCYWYKZSA-N 2 0 340.486 4.257 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)CC1 ZINC000865717323 1053578690 /nfs/dbraw/zinc/57/86/90/1053578690.db2.gz WSVITYJDLIFLTJ-CTNGQTDRSA-N 2 0 329.532 4.208 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2c[nH]nc2-c2cccc(Cl)c2)CC1 ZINC000865765531 1053587712 /nfs/dbraw/zinc/58/77/12/1053587712.db2.gz YVUQSWCNSXZXEX-UHFFFAOYSA-N 2 0 346.906 4.083 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccccc2CC(F)(F)F)CC1 ZINC000865764469 1053588119 /nfs/dbraw/zinc/58/81/19/1053588119.db2.gz AVPDBFQNSJVKMN-UHFFFAOYSA-N 2 0 328.422 4.144 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@@H](C)CCc2cncc3ccccc32)CC1 ZINC000866225837 1053656397 /nfs/dbraw/zinc/65/63/97/1053656397.db2.gz GLJPNSKKKINBKE-SFHVURJKSA-N 2 0 339.527 4.266 20 0 EIADRP C[C@H](NC1CC[NH+](C2CCC2)CC1)c1cc2c(ccnc2Cl)o1 ZINC000866248628 1053665074 /nfs/dbraw/zinc/66/50/74/1053665074.db2.gz FPCYQRHBPFCQTN-LBPRGKRZSA-N 2 0 333.863 4.149 20 0 EIADRP C[C@@H](CCc1cncc2ccccc21)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000866248801 1053665119 /nfs/dbraw/zinc/66/51/19/1053665119.db2.gz GDCXVGJLGSEBSL-KRWDZBQOSA-N 2 0 337.511 4.162 20 0 EIADRP CCCC[N@H+](CCCOC(F)(F)F)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196545110 1053697501 /nfs/dbraw/zinc/69/75/01/1053697501.db2.gz KZQJJCVLMZUEIF-UHFFFAOYSA-N 2 0 338.458 4.324 20 0 EIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1c(C)cc(C)nc1C ZINC001196623981 1053715298 /nfs/dbraw/zinc/71/52/98/1053715298.db2.gz WCYDIWFTANOBTR-UHFFFAOYSA-N 2 0 325.500 4.091 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CC[C@H]2CCSC2)CC1 ZINC000866402254 1053715646 /nfs/dbraw/zinc/71/56/46/1053715646.db2.gz ISFCSLZUDDYPBF-HDYDNRTBSA-N 2 0 332.557 4.162 20 0 EIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)cc1OC ZINC000866517290 1053763612 /nfs/dbraw/zinc/76/36/12/1053763612.db2.gz GEPYKRIHJRJWJK-RXMUNUFUSA-N 2 0 348.531 4.048 20 0 EIADRP C[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ccc(OC(F)F)cc1 ZINC000866515246 1053763930 /nfs/dbraw/zinc/76/39/30/1053763930.db2.gz DWQNWKDBIDQWNY-UQHVZDHRSA-N 2 0 326.431 4.202 20 0 EIADRP COc1ccc2[nH+]c(C)cc(N3C[C@H](CC[NH3+])c4ccccc43)c2c1 ZINC001168547198 1053784139 /nfs/dbraw/zinc/78/41/39/1053784139.db2.gz AXEZWXNEZMGCFX-HNNXBMFYSA-N 2 0 333.435 4.136 20 0 EIADRP C[N@@H+]1CC[C@@H]2CN(CCCCc3ccc(Cl)c(Cl)c3)CC[C@@H]21 ZINC001197031947 1053828573 /nfs/dbraw/zinc/82/85/73/1053828573.db2.gz NFLNZDJNOSRVLI-QAPCUYQASA-N 2 0 341.326 4.342 20 0 EIADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000765704678 1053850917 /nfs/dbraw/zinc/85/09/17/1053850917.db2.gz ZEQKDTGUVDKPLU-OFNKIYASSA-N 2 0 334.507 4.137 20 0 EIADRP Cc1cccc(Cl)c1C[NH2+][C@@H](Cn1ccnc1)c1ccccc1 ZINC001197264770 1053864961 /nfs/dbraw/zinc/86/49/61/1053864961.db2.gz NMCZFEHGMPSJPD-IBGZPJMESA-N 2 0 325.843 4.376 20 0 EIADRP CC[C@H](CCC(F)(F)F)[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000872032509 1054351273 /nfs/dbraw/zinc/35/12/73/1054351273.db2.gz VICIDGYXKIORFS-QZTJIDSGSA-N 2 0 342.449 4.262 20 0 EIADRP CC(C)Cc1ccc(C[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1 ZINC001199383935 1054403097 /nfs/dbraw/zinc/40/30/97/1054403097.db2.gz LMFUXZDYUIJTSW-UHFFFAOYSA-N 2 0 340.511 4.115 20 0 EIADRP CC[C@H]1C[C@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CCO1 ZINC001199630290 1054435941 /nfs/dbraw/zinc/43/59/41/1054435941.db2.gz VKTKJEHVTOKXOB-IRLDBZIGSA-N 2 0 344.543 4.498 20 0 EIADRP C[C@@H]1CCCC[C@H]1C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC001199926911 1054498221 /nfs/dbraw/zinc/49/82/21/1054498221.db2.gz ZOVYVFJPLNGBSK-MOPGFXCFSA-N 2 0 343.559 4.133 20 0 EIADRP c1csc(-c2nc(C[NH2+][C@H]3CCCCC34CC[NH2+]CC4)cs2)c1 ZINC000873232326 1054508636 /nfs/dbraw/zinc/50/86/36/1054508636.db2.gz FMZHAHZPXNJBNW-INIZCTEOSA-N 2 0 347.553 4.274 20 0 EIADRP [NH3+][C@@H](C[C@@H]1CCC[N@H+](Cc2scnc2C2CC2)C1)C1CCCC1 ZINC000873232498 1054508877 /nfs/dbraw/zinc/50/88/77/1054508877.db2.gz RPIAAMVDYVWVOG-YOEHRIQHSA-N 2 0 333.545 4.140 20 0 EIADRP CSc1cccc([C@@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)c2ccc(F)c(F)c2)c1 ZINC000873250427 1054513880 /nfs/dbraw/zinc/51/38/80/1054513880.db2.gz HJHGBUQJLZOKGB-XFHNUULXSA-N 2 0 348.462 4.103 20 0 EIADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H](c2ccccc2Cl)c2cc(F)ccc2F)C1 ZINC000873254942 1054514649 /nfs/dbraw/zinc/51/46/49/1054514649.db2.gz BXABBKLAKAQCFZ-AEDCBLDQSA-N 2 0 336.813 4.035 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)ccc1SC(F)F ZINC000873267886 1054517879 /nfs/dbraw/zinc/51/78/79/1054517879.db2.gz LKQYYSXHJXSHNR-NEPJUHHUSA-N 2 0 344.471 4.049 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(SCC(F)F)cc1 ZINC000873262641 1054518241 /nfs/dbraw/zinc/51/82/41/1054518241.db2.gz AVPLNHNMLVYFQC-LUYZLQTOSA-N 2 0 340.483 4.225 20 0 EIADRP COc1ccc(Cl)cc1C[NH2+]CC1CC[NH+](CCC(C)C)CC1 ZINC001200871938 1054562268 /nfs/dbraw/zinc/56/22/68/1054562268.db2.gz GYMDCWSSMOQDTF-UHFFFAOYSA-N 2 0 338.923 4.196 20 0 EIADRP CN(Cc1cc(-c2ccccc2)on1)Cc1ccc(C[NH+](C)C)cc1 ZINC000859212837 1054645153 /nfs/dbraw/zinc/64/51/53/1054645153.db2.gz CDACKSWMANMKSV-UHFFFAOYSA-N 2 0 335.451 4.035 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2cccc(F)c2F)CC1 ZINC000060377504 1054680337 /nfs/dbraw/zinc/68/03/37/1054680337.db2.gz ZJMKKUHJMDEZJA-UHFFFAOYSA-N 2 0 344.449 4.309 20 0 EIADRP COc1cccc(C[N@@H+]2CCC3(C2)CC[NH+](CC(C)(C)C)CC3)c1 ZINC001201434932 1054808492 /nfs/dbraw/zinc/80/84/92/1054808492.db2.gz FEHWECMOBFNXKR-UHFFFAOYSA-N 2 0 330.516 4.029 20 0 EIADRP CC[C@@H](C)C[NH+]1CCC(OC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001201517157 1054840628 /nfs/dbraw/zinc/84/06/28/1054840628.db2.gz MQZCEUZNCGJLIZ-LJQANCHMSA-N 2 0 344.543 4.178 20 0 EIADRP c1ccc(CCC[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1 ZINC001201673811 1054872852 /nfs/dbraw/zinc/87/28/52/1054872852.db2.gz PTMLRQATNISFCL-HSZRJFAPSA-N 2 0 334.507 4.217 20 0 EIADRP c1ccc(CCC[N@@H+]2CC[C@@H]3C[NH+](Cc4ccccc4)C[C@H]3C2)cc1 ZINC001201672749 1054873360 /nfs/dbraw/zinc/87/33/60/1054873360.db2.gz XEWPHMPDEHYQPR-DHIUTWEWSA-N 2 0 334.507 4.073 20 0 EIADRP CCCCC[NH+]1CCC(OC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001201744390 1054893409 /nfs/dbraw/zinc/89/34/09/1054893409.db2.gz KDMZQLWUIDSQAZ-UHFFFAOYSA-N 2 0 344.543 4.322 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cc3c(ccnc3Cl)o2)CC1 ZINC000876576659 1054931862 /nfs/dbraw/zinc/93/18/62/1054931862.db2.gz PCIZCAJBFRAEMK-UHFFFAOYSA-N 2 0 335.879 4.035 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2cc3c(ccnc3Cl)o2)C1 ZINC000876933409 1054986099 /nfs/dbraw/zinc/98/60/99/1054986099.db2.gz OKPYOSUFNPDUIJ-AWEZNQCLSA-N 2 0 335.879 4.083 20 0 EIADRP Cc1nccn1CCCC[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000173441762 1055006775 /nfs/dbraw/zinc/00/67/75/1055006775.db2.gz VORVKBZZMKRSCZ-CYBMUJFWSA-N 2 0 325.378 4.341 20 0 EIADRP Cc1c(C[NH2+]Cc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)ccnc1F ZINC000862270819 1055042484 /nfs/dbraw/zinc/04/24/84/1055042484.db2.gz TTZDLMNGLMUVBP-INIZCTEOSA-N 2 0 341.474 4.193 20 0 EIADRP Clc1ccc([C@H](C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)OCC2CC2)cc1 ZINC000671764597 1055056703 /nfs/dbraw/zinc/05/67/03/1055056703.db2.gz GLEVDHRNUDVPAP-AQNXPRMDSA-N 2 0 348.918 4.024 20 0 EIADRP FC(F)n1cc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)c2ccccc21 ZINC000863547890 1055228933 /nfs/dbraw/zinc/22/89/33/1055228933.db2.gz RTPONCALGPQUEE-RCCFBDPRSA-N 2 0 347.453 4.437 20 0 EIADRP Cc1n[nH]cc1[C@@H](C)[NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000180143839 1058379046 /nfs/dbraw/zinc/37/90/46/1058379046.db2.gz FXFACPCRCAEDRM-IXDOHACOSA-N 2 0 340.515 4.047 20 0 EIADRP Cc1nccn1C[C@H](C)C[NH2+]CC(c1ccccc1)c1ccccc1 ZINC000180233345 1058482320 /nfs/dbraw/zinc/48/23/20/1058482320.db2.gz BNTFNGAUONRNDG-GOSISDBHSA-N 2 0 333.479 4.249 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]C1CCC([NH+]3CCCCC3)CC1)CCC2 ZINC000766514440 1060470085 /nfs/dbraw/zinc/47/00/85/1060470085.db2.gz XDGLKDAGYCUDOG-AJTFCVKESA-N 2 0 342.527 4.459 20 0 EIADRP CCCCCC(C)(C)C[NH2+][C@H]1CCN(Cc2ccccn2)C[C@H]1C ZINC000766551980 1060538453 /nfs/dbraw/zinc/53/84/53/1060538453.db2.gz XKBKIGQEUNBZDS-QUCCMNQESA-N 2 0 331.548 4.488 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1CCCc3cc(Br)ccc31)C2 ZINC001169101517 1060637211 /nfs/dbraw/zinc/63/72/11/1060637211.db2.gz TZEYQEIFWNTAQB-KYHPRHEASA-N 2 0 349.316 4.041 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1(c3ccc(C(F)(F)F)cc3)CCC1)C2 ZINC001169109524 1060657264 /nfs/dbraw/zinc/65/72/64/1060657264.db2.gz CPGSXIHONXHGHA-OSYLJGHBSA-N 2 0 338.417 4.299 20 0 EIADRP Cc1ccc(C[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc2)cc1 ZINC001169109015 1060658237 /nfs/dbraw/zinc/65/82/37/1060658237.db2.gz GCLNYHFHOLMSNX-GPJHCHHRSA-N 2 0 334.507 4.494 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4C)cc2)cc1 ZINC001169107462 1060658529 /nfs/dbraw/zinc/65/85/29/1060658529.db2.gz HJXNNMLGTVNXAC-MZADTFQBSA-N 2 0 336.479 4.077 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CC[C@@H](c3ccc(Cl)c(Cl)c3)C1)C2 ZINC001169147035 1060665161 /nfs/dbraw/zinc/66/51/61/1060665161.db2.gz RMUHRKPLVPREKM-WCVJEAGWSA-N 2 0 339.310 4.408 20 0 EIADRP C[C@@H](c1ccc(Br)cc1)[N@H+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169160467 1060673504 /nfs/dbraw/zinc/67/35/04/1060673504.db2.gz GHKCVAMGKXBLSQ-SJWGOKEGSA-N 2 0 337.305 4.067 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1ccc([C@H]2CC[N@@H+](C)C2)cc1 ZINC001169690520 1060902874 /nfs/dbraw/zinc/90/28/74/1060902874.db2.gz WSWYFEDAXUMUDI-GHTZIAJQSA-N 2 0 335.495 4.346 20 0 EIADRP C[N@H+](CCCOc1cccc(C(C)(C)C)c1)CCC[NH+]1CCCC1 ZINC001169762056 1060952352 /nfs/dbraw/zinc/95/23/52/1060952352.db2.gz QNNOVHFSYULCQO-UHFFFAOYSA-N 2 0 332.532 4.171 20 0 EIADRP Fc1ccc2c(c1)[C@@H]([NH2+]C1CCN(c3cc[nH+]cc3)CC1)CCS2 ZINC000298267465 526371944 /nfs/dbraw/zinc/37/19/44/526371944.db2.gz GELYDTRYELVIRF-SFHVURJKSA-N 2 0 343.471 4.016 20 0 EIADRP COc1ccc(OC)c([C@@H](C)[NH2+]CCCCC[NH+]2CCCCC2)c1 ZINC000532228810 1032106916 /nfs/dbraw/zinc/10/69/16/1032106916.db2.gz QKHUANIVBRKWKA-QGZVFWFLSA-N 2 0 334.504 4.011 20 0 EIADRP CC[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)CCO1 ZINC000648438130 1032310745 /nfs/dbraw/zinc/31/07/45/1032310745.db2.gz RFZZXRRBHPRODL-LEWJYISDSA-N 2 0 330.516 4.110 20 0 EIADRP Clc1cc2cccnc2c(CN2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000172575425 1032327467 /nfs/dbraw/zinc/32/74/67/1032327467.db2.gz POVUZWURWFTYCH-IBGZPJMESA-N 2 0 343.902 4.339 20 0 EIADRP C(=C/C[N@@H+]1CCC[C@H]1c1ccncc1)\C[NH+]1CCC[C@H]1c1ccncc1 ZINC000245601468 1032333407 /nfs/dbraw/zinc/33/34/07/1032333407.db2.gz MMSJPTZXSMTSFJ-HNSCLNPNSA-N 2 0 348.494 4.007 20 0 EIADRP CCN1CC[NH+](CCCC[NH2+][C@H](C)c2ccccc2C(C)(C)C)CC1 ZINC000532845864 1032357011 /nfs/dbraw/zinc/35/70/11/1032357011.db2.gz XGMPUVZVEXOWIW-LJQANCHMSA-N 2 0 345.575 4.052 20 0 EIADRP Cc1csc([C@H](C)N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC000245707358 1032404761 /nfs/dbraw/zinc/40/47/61/1032404761.db2.gz MQXXGXRFTKJVJF-DSLXNQLJSA-N 2 0 341.524 4.298 20 0 EIADRP C[C@H](C[NH2+][C@H](C)c1ccc(-n2ccnc2)cc1)COCc1ccccc1 ZINC000389899382 1032427458 /nfs/dbraw/zinc/42/74/58/1032427458.db2.gz ARXSPZCSYSOHDD-RTBURBONSA-N 2 0 349.478 4.376 20 0 EIADRP C[C@H]([NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C)C1CC(F)(F)C1 ZINC000529547951 1032439440 /nfs/dbraw/zinc/43/94/40/1032439440.db2.gz ZHAGYXRYZAPTAB-OAGGEKHMSA-N 2 0 336.470 4.166 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(OC)cc1 ZINC000120894967 1032456083 /nfs/dbraw/zinc/45/60/83/1032456083.db2.gz WVHKSBASHJGCOJ-HXUWFJFHSA-N 2 0 330.447 4.137 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(F)cc1F ZINC000120924353 1032474827 /nfs/dbraw/zinc/47/48/27/1032474827.db2.gz CUTZZWKATPOIAL-IBGZPJMESA-N 2 0 336.401 4.406 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1cc(Cl)c(N)c(Cl)c1 ZINC000760166312 1032511425 /nfs/dbraw/zinc/51/14/25/1032511425.db2.gz DKPOGMRHOMNDOC-WCFLWFBJSA-N 2 0 330.303 4.099 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@H+](C)CC1CC[NH2+]CC1 ZINC000178981785 1032545753 /nfs/dbraw/zinc/54/57/53/1032545753.db2.gz DCFKTOJDCHSTLB-OAHLLOKOSA-N 2 0 329.513 4.111 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1ccnn1C1CCC1 ZINC000925229958 1032593503 /nfs/dbraw/zinc/59/35/03/1032593503.db2.gz SDIRBGFBMROAQR-AOCRQIFASA-N 2 0 330.520 4.056 20 0 EIADRP C[C@@H](c1ccc(CN2CCC3(CCC[N@@H+]3C)CC2)cc1)C(F)(F)F ZINC000450646696 1032601314 /nfs/dbraw/zinc/60/13/14/1032601314.db2.gz SDRRPCMUTBSBAR-HNNXBMFYSA-N 2 0 340.433 4.413 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](CC)c2ccc(F)cc2)[C@@H](C)C1 ZINC000121298503 1032623187 /nfs/dbraw/zinc/62/31/87/1032623187.db2.gz ADSMFFUVCAJAEV-VDGAXYAQSA-N 2 0 336.495 4.003 20 0 EIADRP CC[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1F ZINC000180808689 1032645387 /nfs/dbraw/zinc/64/53/87/1032645387.db2.gz ZCMREIDIDJVVMW-HXUWFJFHSA-N 2 0 327.447 4.178 20 0 EIADRP CCC1(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CCOCC1 ZINC000512396972 1032664778 /nfs/dbraw/zinc/66/47/78/1032664778.db2.gz XVRRFJOWCCLKSY-PZJWPPBQSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1cscn1 ZINC000537944565 1019084763 /nfs/dbraw/zinc/08/47/63/1019084763.db2.gz GHSOJDIGEDRANI-RYRKJORJSA-N 2 0 329.513 4.094 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH+]2CC[C@@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001208613704 1019462342 /nfs/dbraw/zinc/46/23/42/1019462342.db2.gz YMUBJSLFCPVHKF-DZGCQCFKSA-N 2 0 327.299 4.125 20 0 EIADRP C[C@@H](c1cccc(Br)c1)[N@H+](C)CCC[NH+]1CCCCC1 ZINC001209452986 1020363356 /nfs/dbraw/zinc/36/33/56/1020363356.db2.gz BHAOPFMVHLUCJN-HNNXBMFYSA-N 2 0 339.321 4.318 20 0 EIADRP Cc1cc2ccccc2c(N2Cc3ccccc3C3(CC[NH2+]CC3)C2)[nH+]1 ZINC001167161014 1020437276 /nfs/dbraw/zinc/43/72/76/1020437276.db2.gz QCXYAZORUPCOQK-UHFFFAOYSA-N 2 0 343.474 4.185 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)C1 ZINC000538060500 1020512371 /nfs/dbraw/zinc/51/23/71/1020512371.db2.gz ZOMVNJIHEARLML-SJKOYZFVSA-N 2 0 327.299 4.376 20 0 EIADRP O[C@@H]1CCC[C@H]1[NH+]1CCC([NH2+]C2CCC(C3CCCCC3)CC2)CC1 ZINC000683470521 1020849620 /nfs/dbraw/zinc/84/96/20/1020849620.db2.gz QNZQRJBTXDCTRT-SLMMIHQXSA-N 2 0 348.575 4.093 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2coc(-c3ccccc3F)n2)CC1 ZINC000625281716 1020871921 /nfs/dbraw/zinc/87/19/21/1020871921.db2.gz UJEGTJQCEKWYLF-UHFFFAOYSA-N 2 0 345.462 4.035 20 0 EIADRP CC(C)[C@@H]1CC[C@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000579939186 1020905469 /nfs/dbraw/zinc/90/54/69/1020905469.db2.gz ORECVWPARJEOEJ-FCHUYYIVSA-N 2 0 344.543 4.082 20 0 EIADRP CC(C)Oc1ccc([C@H]2CCC[C@@H]2[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1 ZINC000655805181 1020971974 /nfs/dbraw/zinc/97/19/74/1020971974.db2.gz KBUAMTBNQHKRAW-PLWAMTLXSA-N 2 0 330.516 4.040 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655806537 1020973354 /nfs/dbraw/zinc/97/33/54/1020973354.db2.gz XYUZZTFQHZBYHN-RVSPLBMKSA-N 2 0 347.503 4.248 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1 ZINC000655806415 1020975954 /nfs/dbraw/zinc/97/59/54/1020975954.db2.gz UWSXTAFRXUYSED-ABSDTBQOSA-N 2 0 338.495 4.353 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)C1 ZINC000655805906 1020976475 /nfs/dbraw/zinc/97/64/75/1020976475.db2.gz URAMQBWDRCDCCB-ZIFCJYIRSA-N 2 0 328.500 4.143 20 0 EIADRP C[C@H](Cc1ccccn1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@H]21 ZINC000655834516 1020997619 /nfs/dbraw/zinc/99/76/19/1020997619.db2.gz PHQMRUPKEOVFJT-MSYGRNIXSA-N 2 0 349.522 4.045 20 0 EIADRP CC(C)(C)O[C@H]1C[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000655839152 1021005511 /nfs/dbraw/zinc/00/55/11/1021005511.db2.gz NXHGOVHJRSLDBU-YXOJAJARSA-N 2 0 342.527 4.118 20 0 EIADRP COc1cc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)ccc1C ZINC000683704987 1021125077 /nfs/dbraw/zinc/12/50/77/1021125077.db2.gz HVBOAOUOUSVLMZ-OAQYLSRUSA-N 2 0 338.495 4.005 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1nc(Br)cs1 ZINC000834487862 1021672079 /nfs/dbraw/zinc/67/20/79/1021672079.db2.gz PFHGUCBPLUQSGE-NWDGAFQWSA-N 2 0 348.354 4.067 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(C)c1 ZINC000414064966 1021774824 /nfs/dbraw/zinc/77/48/24/1021774824.db2.gz NUPMDZMPLFFIDZ-SFHVURJKSA-N 2 0 338.495 4.450 20 0 EIADRP CCc1ccccc1[C@H](N)C[NH2+][C@@H]1CCC[C@H](c2ncccc2C)C1 ZINC000580302501 1021830837 /nfs/dbraw/zinc/83/08/37/1021830837.db2.gz WXTRPZISMMDWRZ-QKNQBKEWSA-N 2 0 337.511 4.268 20 0 EIADRP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000580362764 1021906041 /nfs/dbraw/zinc/90/60/41/1021906041.db2.gz BYCRSVREXAMZFJ-RVDMUPIBSA-N 2 0 340.433 4.382 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1nc(-c2ccccc2)cs1)C1CC[NH+](C)CC1 ZINC000089553667 1021928224 /nfs/dbraw/zinc/92/82/24/1021928224.db2.gz KRQVOGNXGQSGER-CABCVRRESA-N 2 0 329.513 4.191 20 0 EIADRP COc1ccccc1[C@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)c1ccccc1 ZINC000089554976 1021933758 /nfs/dbraw/zinc/93/37/58/1021933758.db2.gz LDWRYKZKUPTYLC-VGOFRKELSA-N 2 0 338.495 4.105 20 0 EIADRP C[NH+](C/C=C/C[N@@H+](C)Cc1ccc(F)cc1)Cc1ccc(F)cc1 ZINC000613391079 1021936659 /nfs/dbraw/zinc/93/66/59/1021936659.db2.gz JCXIERXLPYNVKR-ONEGZZNKSA-N 2 0 330.422 4.085 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccc(F)cc1F ZINC000171126649 1022063449 /nfs/dbraw/zinc/06/34/49/1022063449.db2.gz ZMJARDWHTLVACX-HNNXBMFYSA-N 2 0 348.437 4.146 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]CC[C@H]2CCC[N@H+](C)C2)sc1Br ZINC000414193283 1022086975 /nfs/dbraw/zinc/08/69/75/1022086975.db2.gz SYLISOSGWOFARE-CHWSQXEVSA-N 2 0 345.350 4.202 20 0 EIADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1csc(-c2ccccc2F)n1 ZINC000414193960 1022089615 /nfs/dbraw/zinc/08/96/15/1022089615.db2.gz UCIIGDPNIDCMKY-HUUCEWRRSA-N 2 0 347.503 4.332 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)C(F)(F)F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000549032159 1022159320 /nfs/dbraw/zinc/15/93/20/1022159320.db2.gz LNPKMDUPMZZCSE-GDBMZVCRSA-N 2 0 328.422 4.075 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@H](C)C2)cnc1F ZINC000892579935 1022303644 /nfs/dbraw/zinc/30/36/44/1022303644.db2.gz DEGMKNPEERHLLD-INIZCTEOSA-N 2 0 341.474 4.051 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCc2ccc(Cl)cc2)C1 ZINC001167424316 1022316488 /nfs/dbraw/zinc/31/64/88/1022316488.db2.gz HDRVFCXYGZVGRE-IEBWSBKVSA-N 2 0 334.935 4.469 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H]2CCCc3cc(OC(F)F)ccc32)CC1 ZINC000122968170 1022336097 /nfs/dbraw/zinc/33/60/97/1022336097.db2.gz YYNRRTFQWAUREU-GOSISDBHSA-N 2 0 338.442 4.129 20 0 EIADRP CC1CC[NH+](CCCC[NH2+][C@@H](c2ccccc2)C2CCOCC2)CC1 ZINC000782757331 1022353027 /nfs/dbraw/zinc/35/30/27/1022353027.db2.gz OFJZFFBYJBMNOV-QFIPXVFZSA-N 2 0 344.543 4.256 20 0 EIADRP c1c2ccccc2[nH]c1C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000684019784 1022357974 /nfs/dbraw/zinc/35/79/74/1022357974.db2.gz BNBRTTCJUURWBH-UHFFFAOYSA-N 2 0 325.500 4.256 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1ccc(-n2ccnc2)cc1 ZINC000467198082 1022552000 /nfs/dbraw/zinc/55/20/00/1022552000.db2.gz WONBLGHWLGTKIZ-YLJYHZDGSA-N 2 0 339.483 4.405 20 0 EIADRP C[NH+]1CCC2(CCC[N@@H+]2Cc2cc(-c3ccccc3)cs2)CC1 ZINC000472597814 1022738493 /nfs/dbraw/zinc/73/84/93/1022738493.db2.gz DHECAJXMCTZXSE-UHFFFAOYSA-N 2 0 326.509 4.475 20 0 EIADRP FC(F)(F)[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc(-n2ccnc2)cs1 ZINC000580952663 1022741015 /nfs/dbraw/zinc/74/10/15/1022741015.db2.gz ORFDCXMNLRVVSY-KGLIPLIRSA-N 2 0 329.391 4.145 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2cccs2)ccc1OC ZINC000182220918 1022789072 /nfs/dbraw/zinc/78/90/72/1022789072.db2.gz BMZPYQNOVQUAGM-OAHLLOKOSA-N 2 0 332.513 4.449 20 0 EIADRP CC(C)(C)[C@@H]1C[C@H]([NH2+]C2CC[NH+](CC3CCCCC3)CC2)CCO1 ZINC000378407955 1022804992 /nfs/dbraw/zinc/80/49/92/1022804992.db2.gz YRZPDMJZTKPXAI-UXHICEINSA-N 2 0 336.564 4.214 20 0 EIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000423386644 1022864524 /nfs/dbraw/zinc/86/45/24/1022864524.db2.gz MDRPMNGYTJLNEQ-UZGDPCLZSA-N 2 0 331.287 4.009 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1cnn(C)c1 ZINC000156181849 1023092238 /nfs/dbraw/zinc/09/22/38/1023092238.db2.gz UJLZUMHKENOZQR-LAUBAEHRSA-N 2 0 340.515 4.035 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](CC)c2cccc(F)c2)[C@@H](C)C1 ZINC000188019266 1023133164 /nfs/dbraw/zinc/13/31/64/1023133164.db2.gz ZJIIEAWNBLZGIC-DBVUQKKJSA-N 2 0 336.495 4.003 20 0 EIADRP C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccc(-c3ccccc3F)o2)C1 ZINC000584687841 1023189843 /nfs/dbraw/zinc/18/98/43/1023189843.db2.gz PXEIDOKANLTINQ-KXBFYZLASA-N 2 0 328.431 4.002 20 0 EIADRP Cc1cccc(N2CCC([NH2+][C@H](C)[C@@H]3C[C@H]3c3cccs3)CC2)n1 ZINC000417300766 1023248659 /nfs/dbraw/zinc/24/86/59/1023248659.db2.gz AYPNLCNLYVHTGB-BPQIPLTHSA-N 2 0 341.524 4.202 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000376672596 1023254092 /nfs/dbraw/zinc/25/40/92/1023254092.db2.gz OJELGPNBPZUIOD-DENIHFKCSA-N 2 0 335.495 4.035 20 0 EIADRP CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](C)c2cccc(C[NH+](C)C)c2)c1 ZINC000924600425 1023332497 /nfs/dbraw/zinc/33/24/97/1023332497.db2.gz STNHVQYKPADABV-CVEARBPZSA-N 2 0 339.483 4.118 20 0 EIADRP C[C@@H](CCc1ccco1)[NH2+]C[C@@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000310066028 1023336266 /nfs/dbraw/zinc/33/62/66/1023336266.db2.gz BLFIVZQJFQKBSH-GHTZIAJQSA-N 2 0 326.484 4.103 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)C1 ZINC000584819127 1023346486 /nfs/dbraw/zinc/34/64/86/1023346486.db2.gz DWIHZDUNRLXAJE-RXVVDRJESA-N 2 0 326.459 4.041 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000415013416 1023389166 /nfs/dbraw/zinc/38/91/66/1023389166.db2.gz KWLWOOCJDCXPCH-ZDUSSCGKSA-N 2 0 329.469 4.163 20 0 EIADRP C[C@@H](NCc1nsc2ccccc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000660258048 1023394939 /nfs/dbraw/zinc/39/49/39/1023394939.db2.gz YVVYQIVNLLVQSE-HUUCEWRRSA-N 2 0 329.513 4.039 20 0 EIADRP CC(C)COc1cccc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)c1 ZINC000415052439 1023409628 /nfs/dbraw/zinc/40/96/28/1023409628.db2.gz LFQSFEICJBGBJL-NRFANRHFSA-N 2 0 326.484 4.291 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1ccc(Br)cc1)c1ccccc1 ZINC000415052350 1023410132 /nfs/dbraw/zinc/41/01/32/1023410132.db2.gz KSTOVPMHWRRFFQ-KRWDZBQOSA-N 2 0 333.273 4.019 20 0 EIADRP [NH3+]C1CCC([NH2+]Cc2ccccc2COc2ccccc2Cl)CC1 ZINC000415074099 1023426581 /nfs/dbraw/zinc/42/65/81/1023426581.db2.gz BWYDNEIXMHQTGH-UHFFFAOYSA-N 2 0 344.886 4.279 20 0 EIADRP COc1cccc([C@@H](N[C@H]2CCC[NH2+]CC2)c2ccccc2Cl)c1 ZINC000415081241 1023429116 /nfs/dbraw/zinc/42/91/16/1023429116.db2.gz KMPMLBIQVCXSGS-OXJNMPFZSA-N 2 0 344.886 4.170 20 0 EIADRP C[C@@H](C[C@H]1CCC[NH2+]1)[NH2+]Cc1cccc(COCc2ccccc2)c1 ZINC000415082733 1023432157 /nfs/dbraw/zinc/43/21/57/1023432157.db2.gz OSJVMIPGIYEDCR-PGRDOPGGSA-N 2 0 338.495 4.024 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000415086541 1023435691 /nfs/dbraw/zinc/43/56/91/1023435691.db2.gz UTFYGRVNUUIHTN-PBHICJAKSA-N 2 0 329.513 4.220 20 0 EIADRP COc1cccc([C@H]([NH2+]CC2CC[NH2+]CC2)c2ccccc2Cl)c1 ZINC000415086694 1023436560 /nfs/dbraw/zinc/43/65/60/1023436560.db2.gz SMUDKZFPJLUGNE-FQEVSTJZSA-N 2 0 344.886 4.027 20 0 EIADRP c1ccc(OC2CCCC2)c(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)c1 ZINC000415095479 1023440760 /nfs/dbraw/zinc/44/07/60/1023440760.db2.gz ZXIBBDKWFLAVJV-SLFFLAALSA-N 2 0 328.500 4.018 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cc(Br)ccc1F ZINC000019914642 1023453148 /nfs/dbraw/zinc/45/31/48/1023453148.db2.gz OXHOOAJRZPTUJZ-ZDUSSCGKSA-N 2 0 345.300 4.188 20 0 EIADRP Cc1ccc(C)c(OC2CC[NH+](CC[C@H]3CCCC[N@H+]3C)CC2)c1 ZINC000472759388 1023511876 /nfs/dbraw/zinc/51/18/76/1023511876.db2.gz KSDKAWSCMDLUBD-LJQANCHMSA-N 2 0 330.516 4.021 20 0 EIADRP c1nc(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)sc1-c1ccccc1 ZINC000656783626 1023518718 /nfs/dbraw/zinc/51/87/18/1023518718.db2.gz RLJFTLSRMHHNMX-GOSISDBHSA-N 2 0 341.524 4.022 20 0 EIADRP c1csc(-c2ncc(C[N@@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)s2)c1 ZINC000656786410 1023526882 /nfs/dbraw/zinc/52/68/82/1023526882.db2.gz SFRIPJHBTBWQRJ-OAHLLOKOSA-N 2 0 347.553 4.083 20 0 EIADRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCC[N@H+](Cc3cccc(C4CCCC4)c3)C2)C1 ZINC000656786434 1023532435 /nfs/dbraw/zinc/53/24/35/1023532435.db2.gz MNUMTVRDIVJSBK-BHDDXSALSA-N 2 0 342.527 4.063 20 0 EIADRP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)C1 ZINC000684378554 1023585960 /nfs/dbraw/zinc/58/59/60/1023585960.db2.gz MJOCKHSHCOBULE-NHCUHLMSSA-N 2 0 330.516 4.110 20 0 EIADRP C[C@@H]([NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310081720 1023590608 /nfs/dbraw/zinc/59/06/08/1023590608.db2.gz JTWWQSHTFVIRIJ-UTKZUKDTSA-N 2 0 326.459 4.389 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@H]3CCC[C@H](c4cccnc4)C3)C2)cc1 ZINC000500382546 1023769475 /nfs/dbraw/zinc/76/94/75/1023769475.db2.gz HQVZFYDPXTVPIL-GIWBLDEGSA-N 2 0 349.522 4.220 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1cncc(F)c1 ZINC000164187137 1023802247 /nfs/dbraw/zinc/80/22/47/1023802247.db2.gz XTHAUQXYVHOVJU-KRWDZBQOSA-N 2 0 341.474 4.448 20 0 EIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2cc3cnccc3o2)C[N@@H+]1Cc1ccccc1 ZINC000651743247 1023965530 /nfs/dbraw/zinc/96/55/30/1023965530.db2.gz NHJUMPSJZARPAI-PKOBYXMFSA-N 2 0 349.478 4.218 20 0 EIADRP COc1cccc([C@H](C)[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000430710901 1023966103 /nfs/dbraw/zinc/96/61/03/1023966103.db2.gz UYBMRFRSVCJWNL-AZUAARDMSA-N 2 0 338.495 4.210 20 0 EIADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000510671958 1024207829 /nfs/dbraw/zinc/20/78/29/1024207829.db2.gz ROOZVPMIOSWFJY-NVXWUHKLSA-N 2 0 342.449 4.348 20 0 EIADRP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000510673083 1024208427 /nfs/dbraw/zinc/20/84/27/1024208427.db2.gz YMOKLAIZALSYGV-QHAWAJNXSA-N 2 0 332.507 4.059 20 0 EIADRP CC(C)c1ccc(-c2nc(C[NH+]3CCC([C@@H](C)[NH3+])CC3)cs2)cc1 ZINC000430965797 1024306831 /nfs/dbraw/zinc/30/68/31/1024306831.db2.gz MHQZPPUULBTLGH-OAHLLOKOSA-N 2 0 343.540 4.493 20 0 EIADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCCN(Cc2cccs2)C1 ZINC000510719947 1024312274 /nfs/dbraw/zinc/31/22/74/1024312274.db2.gz KMJLHEZDTASOJB-AOIWGVFYSA-N 2 0 338.536 4.468 20 0 EIADRP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1CCCN(Cc2cccs2)C1 ZINC000510719949 1024312791 /nfs/dbraw/zinc/31/27/91/1024312791.db2.gz KMJLHEZDTASOJB-JENIJYKNSA-N 2 0 338.536 4.468 20 0 EIADRP Cc1cc(OCCC[C@H](C)[NH2+][C@@H]2CCN(C)[C@H](C)C2)ccc1Cl ZINC000510738280 1024378320 /nfs/dbraw/zinc/37/83/20/1024378320.db2.gz VGMPBVKTDJRKKI-GVDBMIGSSA-N 2 0 338.923 4.268 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CCN(C)[C@@H](C)C1 ZINC000510737092 1024379249 /nfs/dbraw/zinc/37/92/49/1024379249.db2.gz RVTIFRMEUHRMFC-KEYYUXOJSA-N 2 0 328.422 4.099 20 0 EIADRP Cc1cccc([C@H]([NH2+]CC2CC[NH+](C)CC2)c2cccc(F)c2)c1 ZINC000510753283 1024387187 /nfs/dbraw/zinc/38/71/87/1024387187.db2.gz QPHFSTUEAGRBJM-NRFANRHFSA-N 2 0 326.459 4.155 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CCC1CC[NH+](C)CC1 ZINC000510755349 1024401461 /nfs/dbraw/zinc/40/14/61/1024401461.db2.gz OTPHXBRJSSCXGJ-OAHLLOKOSA-N 2 0 342.449 4.348 20 0 EIADRP Cc1cc(F)ccc1-c1ccc(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)o1 ZINC000092072518 1024594751 /nfs/dbraw/zinc/59/47/51/1024594751.db2.gz ZPQHQZNHRNACNO-OAHLLOKOSA-N 2 0 339.414 4.497 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](CNCc2ccc(Sc3ccccn3)o2)C1 ZINC000510874855 1024700388 /nfs/dbraw/zinc/70/03/88/1024700388.db2.gz QQQHDUPPFYFYPX-MRXNPFEDSA-N 2 0 345.512 4.036 20 0 EIADRP CC(C)c1ccc([C@H](C)[N@@H+]2CCC[C@H]([C@H]3C[C@@H]([NH3+])CCO3)C2)cc1 ZINC000652350438 1024701118 /nfs/dbraw/zinc/70/11/18/1024701118.db2.gz YMHSDDVBIKOYEF-LRGNLBRXSA-N 2 0 330.516 4.089 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@H](C)C[C@H]1c1ccccc1 ZINC000348835691 1024720926 /nfs/dbraw/zinc/72/09/26/1024720926.db2.gz AVRCSSOZFISROU-IERDGZPVSA-N 2 0 332.451 4.159 20 0 EIADRP c1ccc(C[C@@H]([NH2+]Cc2cccc3c2CC[NH2+]C3)c2ccccc2)cc1 ZINC000662280508 1025027629 /nfs/dbraw/zinc/02/76/29/1025027629.db2.gz FQLWEFUJASCDGZ-XMMPIXPASA-N 2 0 342.486 4.406 20 0 EIADRP C[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc(Cl)cc1Cl ZINC000662283802 1025033027 /nfs/dbraw/zinc/03/30/27/1025033027.db2.gz VLNUIRMLWGKFDT-LBPRGKRZSA-N 2 0 335.278 4.490 20 0 EIADRP Cc1ccc(-c2nc(C[N@H+]3CCC[C@@H](C)[C@H]3CCC[NH3+])cs2)o1 ZINC000662318117 1025072555 /nfs/dbraw/zinc/07/25/55/1025072555.db2.gz WHRPRQVGSRFCRI-CZUORRHYSA-N 2 0 333.501 4.051 20 0 EIADRP COCC[C@H]([NH2+]CC[C@H]1CCC[N@@H+]1C)c1ccc(Cl)c(Cl)c1 ZINC000342056368 1025079084 /nfs/dbraw/zinc/07/90/84/1025079084.db2.gz HOIVARJXZMWINM-PBHICJAKSA-N 2 0 345.314 4.145 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)C1 ZINC000663466308 1025391218 /nfs/dbraw/zinc/39/12/18/1025391218.db2.gz QWSPOIUYEAHDQO-NJYVYQBISA-N 2 0 341.543 4.128 20 0 EIADRP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663470229 1025413292 /nfs/dbraw/zinc/41/32/92/1025413292.db2.gz TWWIHJDOQUGEGP-RHSMWYFYSA-N 2 0 335.561 4.348 20 0 EIADRP CC[C@H](c1ccccc1)[NH+]1CCN(C[C@H]2CCCC[N@@H+]2C(C)C)CC1 ZINC001167508354 1025754253 /nfs/dbraw/zinc/75/42/53/1025754253.db2.gz GQPYXPHHLCLNTL-FGZHOGPDSA-N 2 0 343.559 4.018 20 0 EIADRP CC[C@@H](c1ccccc1)[NH+]1CCN(C[C@H]2CCCC[N@@H+]2C(C)C)CC1 ZINC001167508357 1025755298 /nfs/dbraw/zinc/75/52/98/1025755298.db2.gz GQPYXPHHLCLNTL-YADHBBJMSA-N 2 0 343.559 4.018 20 0 EIADRP Fc1ccc(/C=C\C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1F ZINC000512031831 1025802244 /nfs/dbraw/zinc/80/22/44/1025802244.db2.gz RETKJGKDSFJANE-PLNGDYQASA-N 2 0 334.454 4.365 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(C(=O)c2ccccc2F)CC1 ZINC001167834561 1025822284 /nfs/dbraw/zinc/82/22/84/1025822284.db2.gz KVLIARBZEQGPJJ-KRWDZBQOSA-N 2 0 348.506 4.231 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](CC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001167838964 1025852656 /nfs/dbraw/zinc/85/26/56/1025852656.db2.gz XGONZEJYRFVWEM-IFMALSPDSA-N 2 0 345.575 4.093 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cc(Cl)cc(Cl)c1OC(F)F ZINC000415014819 1025855345 /nfs/dbraw/zinc/85/53/45/1025855345.db2.gz MYOAIIPTPQPDAU-SECBINFHSA-N 2 0 341.229 4.202 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@H](Cc2ccc(OC)cc2)C1 ZINC001167839905 1025856187 /nfs/dbraw/zinc/85/61/87/1025856187.db2.gz COTPULONLFKIGA-PZJWPPBQSA-N 2 0 346.559 4.460 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+]Cc1cccc(OCc2ccccc2Cl)c1 ZINC000415020244 1025858285 /nfs/dbraw/zinc/85/82/85/1025858285.db2.gz JKKWUUGWQMBIDA-OAHLLOKOSA-N 2 0 332.875 4.136 20 0 EIADRP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccc(OC(F)F)cc1 ZINC000319773486 1025858902 /nfs/dbraw/zinc/85/89/02/1025858902.db2.gz FKIHICHZNXZGPQ-CABCVRRESA-N 2 0 326.431 4.203 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+]1CC=C(c2ccc(OC)cc2)CC1 ZINC001167841353 1025882426 /nfs/dbraw/zinc/88/24/26/1025882426.db2.gz KXJAGGWCGCGYPS-GOSISDBHSA-N 2 0 330.516 4.295 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@H](Cc2cccc(OC)c2)C1 ZINC001167841623 1025886523 /nfs/dbraw/zinc/88/65/23/1025886523.db2.gz NEKYNVCMKZZVFX-TZIWHRDSSA-N 2 0 346.559 4.460 20 0 EIADRP CCn1cc([C@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)cn1 ZINC000157652883 1025904013 /nfs/dbraw/zinc/90/40/13/1025904013.db2.gz LMFYQAPROZAPJH-ROUUACIJSA-N 2 0 340.515 4.128 20 0 EIADRP Clc1cc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C2CC2)ccn1 ZINC001167968801 1025912016 /nfs/dbraw/zinc/91/20/16/1025912016.db2.gz VOOZSLFJTARSMU-AQDPXUSMSA-N 2 0 345.918 4.181 20 0 EIADRP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1cccc(OC(F)F)c1 ZINC000319783456 1025927283 /nfs/dbraw/zinc/92/72/83/1025927283.db2.gz GVGYZWIQMXHPNC-HUUCEWRRSA-N 2 0 326.431 4.203 20 0 EIADRP C[C@H](C[NH2+][C@H]1CCN(C2CC2)[C@@H](c2ccccc2)C1)c1ccncc1 ZINC000638718846 1026032879 /nfs/dbraw/zinc/03/28/79/1026032879.db2.gz MMLXTZDIKYUINP-PIPMEXSNSA-N 2 0 335.495 4.143 20 0 EIADRP C[C@@H]([NH3+])Cc1cn(C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c2ccccc12 ZINC001167969848 1026054076 /nfs/dbraw/zinc/05/40/76/1026054076.db2.gz GFLGTLFIRQWVMS-AZCLRUCKSA-N 2 0 337.511 4.109 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CCCc3ccc(F)cc32)ccc1F ZINC000344163408 1026085591 /nfs/dbraw/zinc/08/55/91/1026085591.db2.gz HRNDOIKGEYVAJW-FQEVSTJZSA-N 2 0 330.422 4.194 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2sccc2OC)cc1 ZINC000472166114 1026167515 /nfs/dbraw/zinc/16/75/15/1026167515.db2.gz TXOWQLRABKVKSG-OAHLLOKOSA-N 2 0 332.513 4.449 20 0 EIADRP COc1cccc(CCC[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@@H]3C)C2)c1 ZINC000303950947 1026298078 /nfs/dbraw/zinc/29/80/78/1026298078.db2.gz VRMRGZNYEFNSAA-PZJWPPBQSA-N 2 0 344.543 4.214 20 0 EIADRP CC(C)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)Cc1ccc(F)cc1 ZINC001167977477 1026333115 /nfs/dbraw/zinc/33/31/15/1026333115.db2.gz CQUWGIVHLUVQPH-SEJPIABJSA-N 2 0 344.518 4.389 20 0 EIADRP COc1cccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C2CC2)c1 ZINC001167981665 1026369324 /nfs/dbraw/zinc/36/93/24/1026369324.db2.gz DKLAIQSBKPXUAW-RKKYOWQMSA-N 2 0 340.511 4.141 20 0 EIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000582328343 1026453613 /nfs/dbraw/zinc/45/36/13/1026453613.db2.gz VBLBLQNFEDQMQK-NVXWUHKLSA-N 2 0 342.449 4.346 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000582328344 1026453967 /nfs/dbraw/zinc/45/39/67/1026453967.db2.gz VBLBLQNFEDQMQK-RDJZCZTQSA-N 2 0 342.449 4.346 20 0 EIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000279499982 1026461720 /nfs/dbraw/zinc/46/17/20/1026461720.db2.gz MNBSVWZKAPDWHM-VKRLORBYSA-N 2 0 330.516 4.005 20 0 EIADRP Cc1cc(F)ccc1-c1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)o1 ZINC000506907520 1026502575 /nfs/dbraw/zinc/50/25/75/1026502575.db2.gz CMVIFQJYBBHHSI-UHFFFAOYSA-N 2 0 330.447 4.168 20 0 EIADRP C[NH+](C)CC1CC[NH+](Cc2ccc(F)c(-c3cccs3)c2)CC1 ZINC000506892810 1026506057 /nfs/dbraw/zinc/50/60/57/1026506057.db2.gz FYWANGNCRYIFJY-UHFFFAOYSA-N 2 0 332.488 4.328 20 0 EIADRP Cc1ccc(C2(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)CCCC2)c(C)c1 ZINC000645503619 1026613435 /nfs/dbraw/zinc/61/34/35/1026613435.db2.gz QQMNIGTYMOXCLE-PMACEKPBSA-N 2 0 326.528 4.332 20 0 EIADRP Cc1cccc2[nH]c(C[NH2+][C@@H](C)[C@@H]3CCC[N@@H+](C4CCC4)C3)cc21 ZINC000657428867 1026629493 /nfs/dbraw/zinc/62/94/93/1026629493.db2.gz CQLSRBFZCNQMFZ-DLBZAZTESA-N 2 0 325.500 4.219 20 0 EIADRP Fc1ccc(C[N@H+](Cc2ccsc2)[C@H]2CC23CC[NH2+]CC3)cc1 ZINC000432666731 1026699921 /nfs/dbraw/zinc/69/99/21/1026699921.db2.gz FOYNEZMQYYHLQA-SFHVURJKSA-N 2 0 330.472 4.032 20 0 EIADRP CC(C)n1nccc1C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000279827617 1026715929 /nfs/dbraw/zinc/71/59/29/1026715929.db2.gz GRQHUUSRLIDBOE-UHFFFAOYSA-N 2 0 340.515 4.130 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1nc(-c2ccccc2)cs1 ZINC000236857730 1026732945 /nfs/dbraw/zinc/73/29/45/1026732945.db2.gz HSYBPIKSCIZZHB-MRXNPFEDSA-N 2 0 331.529 4.410 20 0 EIADRP C[NH+](C)[C@H](CNc1cc[nH+]c2cc(F)ccc12)c1cccc(F)c1 ZINC000500473278 1026777119 /nfs/dbraw/zinc/77/71/19/1026777119.db2.gz OXZVIPBEOHEYHW-LJQANCHMSA-N 2 0 327.378 4.228 20 0 EIADRP C[NH+](C)[C@@H](CNc1cc[nH+]c2cc(F)ccc12)c1cccc(F)c1 ZINC000500473277 1026777674 /nfs/dbraw/zinc/77/76/74/1026777674.db2.gz OXZVIPBEOHEYHW-IBGZPJMESA-N 2 0 327.378 4.228 20 0 EIADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cc(Cl)ccc1OC(F)F ZINC000507475878 1026809008 /nfs/dbraw/zinc/80/90/08/1026809008.db2.gz IGYXVXSBVHBXJI-LBPRGKRZSA-N 2 0 346.849 4.324 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)CCCS2 ZINC000187964684 1026862465 /nfs/dbraw/zinc/86/24/65/1026862465.db2.gz IIFXFDGMSHGQPO-QFBILLFUSA-N 2 0 348.556 4.332 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H]3CCCc4cccnc43)CC2)c1 ZINC000684955983 1026893621 /nfs/dbraw/zinc/89/36/21/1026893621.db2.gz UWNAFWOJYIVLQC-LJQANCHMSA-N 2 0 341.524 4.022 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1nc2ccccc2n1C ZINC000091368214 1026906848 /nfs/dbraw/zinc/90/68/48/1026906848.db2.gz NYCQJMQNMIRROT-AOCRQIFASA-N 2 0 340.515 4.021 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc2ccc(F)c(F)c2n1 ZINC000638864322 1026909258 /nfs/dbraw/zinc/90/92/58/1026909258.db2.gz SAHMMMWROHVOKT-AWEZNQCLSA-N 2 0 335.442 4.113 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)cc1 ZINC000519707747 1026965094 /nfs/dbraw/zinc/96/50/94/1026965094.db2.gz GCRBTZWIIHMIQS-SFHVURJKSA-N 2 0 349.503 4.436 20 0 EIADRP C[C@@H](Cn1ccnc1)[NH2+]CCCCc1ccc(Cl)c(Cl)c1 ZINC000474480442 1027112683 /nfs/dbraw/zinc/11/26/83/1027112683.db2.gz UYMOKYIAETZXGF-ZDUSSCGKSA-N 2 0 326.271 4.191 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H]2CCCSc3ccc(OC)cc32)CC1 ZINC000582764882 1027286611 /nfs/dbraw/zinc/28/66/11/1027286611.db2.gz LYYDCSGDGPRDHI-IBGZPJMESA-N 2 0 348.556 4.334 20 0 EIADRP Cc1cc(C)c(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1C ZINC000657612744 1027302810 /nfs/dbraw/zinc/30/28/10/1027302810.db2.gz QZYBDANNDIHMPC-UHFFFAOYSA-N 2 0 337.511 4.009 20 0 EIADRP Cc1cc(N[C@@H]2CC[N@H+](Cc3ccc(C(F)(F)F)cc3)C2)cc[nH+]1 ZINC000302570442 1027337325 /nfs/dbraw/zinc/33/73/25/1027337325.db2.gz PHNBPSQXZSXLTL-QGZVFWFLSA-N 2 0 335.373 4.095 20 0 EIADRP COc1ccccc1[C@@H](CNc1cc[nH+]c(C)c1)[NH+]1CCCCC1 ZINC000302569678 1027337471 /nfs/dbraw/zinc/33/74/71/1027337471.db2.gz OWEOKYAOHYJSED-LJQANCHMSA-N 2 0 325.456 4.038 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CCc3ccccc3C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168039974 1027353020 /nfs/dbraw/zinc/35/30/20/1027353020.db2.gz JEZKLHMOMIMYEP-BBIADKPPSA-N 2 0 334.507 4.486 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2cccnc21)c1cccc(OCC[NH+](C)C)c1 ZINC000120505152 1027523249 /nfs/dbraw/zinc/52/32/49/1027523249.db2.gz WUFDVIHXCNLERI-QGZVFWFLSA-N 2 0 349.478 4.026 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474814763 1027537908 /nfs/dbraw/zinc/53/79/08/1027537908.db2.gz DPGHMMAIHRQAML-AIEDFZFUSA-N 2 0 326.937 4.356 20 0 EIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000152449913 1027549901 /nfs/dbraw/zinc/54/99/01/1027549901.db2.gz LGWNCVYBXKCSMZ-QUCCMNQESA-N 2 0 340.536 4.414 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cc(F)ccc1F ZINC000112518298 1027580357 /nfs/dbraw/zinc/58/03/57/1027580357.db2.gz IGCLSWLMNYQJDA-OAHLLOKOSA-N 2 0 330.422 4.411 20 0 EIADRP C[C@H]([NH2+][C@H](CC(F)(F)F)c1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC000090969071 1027641114 /nfs/dbraw/zinc/64/11/14/1027641114.db2.gz JFRPPHGBXUNQKX-BLLLJJGKSA-N 2 0 332.385 4.139 20 0 EIADRP C[C@@H](CCc1ccc(Cl)s1)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000475576491 1027694216 /nfs/dbraw/zinc/69/42/16/1027694216.db2.gz UNMUYRSFQJESHB-NFOMZHRRSA-N 2 0 326.937 4.329 20 0 EIADRP CCOC[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000474874643 1027718374 /nfs/dbraw/zinc/71/83/74/1027718374.db2.gz BVESUQMUTGBEAR-YJMBLLCNSA-N 2 0 344.543 4.082 20 0 EIADRP C[NH2+]Cc1cn(C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c2ccc(C)cc12 ZINC001167994804 1027735872 /nfs/dbraw/zinc/73/58/72/1027735872.db2.gz PYMUHNVVHVTVOB-YOFSQIOKSA-N 2 0 337.511 4.247 20 0 EIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1 ZINC000474892988 1027745969 /nfs/dbraw/zinc/74/59/69/1027745969.db2.gz VXWLFKQJZKSFSH-IRXDYDNUSA-N 2 0 326.484 4.039 20 0 EIADRP COc1ccccc1[C@H]1CCC[N@@H+]1C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995603 1027786539 /nfs/dbraw/zinc/78/65/39/1027786539.db2.gz KONNVLVUFMAMAI-KXZRCVDZSA-N 2 0 340.511 4.238 20 0 EIADRP c1ccc(C[NH+]2CCC[C@H]3C[N@H+](CCCc4cccnc4)CC[C@H]32)cc1 ZINC001167646335 1027827576 /nfs/dbraw/zinc/82/75/76/1027827576.db2.gz AUFPPRKHFPYAQU-XZOQPEGZSA-N 2 0 349.522 4.001 20 0 EIADRP Cc1ccc2cc(C[NH2+][C@@H](C)[C@@H]3CCC[N@@H+](C4CCC4)C3)ccc2n1 ZINC000189427131 1028133865 /nfs/dbraw/zinc/13/38/65/1028133865.db2.gz CAJGRTOOAQKREW-FXAWDEMLSA-N 2 0 337.511 4.286 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@H]1Cc1ccccc1C ZINC000346192040 1028318162 /nfs/dbraw/zinc/31/81/62/1028318162.db2.gz XLFZJBCVFPLEPX-QFIPXVFZSA-N 2 0 346.478 4.091 20 0 EIADRP C[NH+](C)CC[C@@H]([NH2+]Cc1ccc(OC(F)F)c(Cl)c1)C(C)(C)C ZINC000523864476 1028434159 /nfs/dbraw/zinc/43/41/59/1028434159.db2.gz PLWIQLHITMRMFG-OAHLLOKOSA-N 2 0 348.865 4.397 20 0 EIADRP Cc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)C[C@H]3CCC(F)(F)C3)C2)s1 ZINC000583325121 1028519467 /nfs/dbraw/zinc/51/94/67/1028519467.db2.gz APPVRYBLUIIIQQ-JKSUJKDBSA-N 2 0 342.499 4.246 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000650713036 1028861595 /nfs/dbraw/zinc/86/15/95/1028861595.db2.gz CEAHRGYAPRYJKS-CVEARBPZSA-N 2 0 326.406 4.060 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)Cc2cccc(C(F)(F)F)c2)CC1 ZINC000281815919 1028875294 /nfs/dbraw/zinc/87/52/94/1028875294.db2.gz ZIMNZMAMIVUGKS-AWEZNQCLSA-N 2 0 328.422 4.099 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCCCOC(C)(C)C)CC1 ZINC000475056468 1028948958 /nfs/dbraw/zinc/94/89/58/1028948958.db2.gz IYRYAWJTVZSHPZ-UHFFFAOYSA-N 2 0 346.559 4.426 20 0 EIADRP CCCOC1CC[NH+]([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168051002 1028992306 /nfs/dbraw/zinc/99/23/06/1028992306.db2.gz FEVVBHOUUVETDB-CEQLMSFQSA-N 2 0 344.543 4.319 20 0 EIADRP C[C@@H]1CC([N@@H+]2CC[C@@H](c3ccccn3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168051812 1029065431 /nfs/dbraw/zinc/06/54/31/1029065431.db2.gz ISBVQZHYSFCBEA-SFHLNBCPSA-N 2 0 349.522 4.313 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@@H](c3ccccn3)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168051810 1029066222 /nfs/dbraw/zinc/06/62/22/1029066222.db2.gz ISBVQZHYSFCBEA-NPDDRXJXSA-N 2 0 349.522 4.313 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@H](c2cccc(F)c2)c2cccc(Cl)c2)CC1 ZINC000650746869 1029084909 /nfs/dbraw/zinc/08/49/09/1029084909.db2.gz MOXQWIUNFXWCKN-SFHVURJKSA-N 2 0 332.850 4.287 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccccc1OC(F)F ZINC000650753223 1029147226 /nfs/dbraw/zinc/14/72/26/1029147226.db2.gz JBJOJVMXTJRWCG-INIZCTEOSA-N 2 0 338.373 4.127 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(COC)cc2)CC1)CC1CC1 ZINC000536139233 1029245668 /nfs/dbraw/zinc/24/56/68/1029245668.db2.gz CCDZNXXIAMRDGN-UHFFFAOYSA-N 2 0 344.543 4.167 20 0 EIADRP C[NH+]1CCC2(CCC[N@@H+]2Cc2ccc(-c3ccccc3F)o2)CC1 ZINC000475130303 1029277085 /nfs/dbraw/zinc/27/70/85/1029277085.db2.gz VIHIXIPSLBNUMU-UHFFFAOYSA-N 2 0 328.431 4.146 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)CCS2 ZINC000343471350 1029321002 /nfs/dbraw/zinc/32/10/02/1029321002.db2.gz TUFFXURMILMSDW-SJLPKXTDSA-N 2 0 336.545 4.188 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)CCS2 ZINC000343494394 1029367301 /nfs/dbraw/zinc/36/73/01/1029367301.db2.gz FIHMCEFVRORSJR-LPHOPBHVSA-N 2 0 348.556 4.334 20 0 EIADRP C[C@H]1C[C@@H](NCc2cc(Cl)ccc2OC2CCCC2)CC[N@@H+]1C ZINC000525207853 1029514483 /nfs/dbraw/zinc/51/44/83/1029514483.db2.gz RFDBKVYVIQJXKK-YOEHRIQHSA-N 2 0 336.907 4.234 20 0 EIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)c1 ZINC000158563854 1029522866 /nfs/dbraw/zinc/52/28/66/1029522866.db2.gz OLGXFWKXISFRPE-BZSNNMDCSA-N 2 0 345.531 4.054 20 0 EIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]Cc2ccc3ncccc3c2)CC1 ZINC000475339029 1029553170 /nfs/dbraw/zinc/55/31/70/1029553170.db2.gz XMICWEZVLAPRJH-HTAPYJJXSA-N 2 0 337.511 4.368 20 0 EIADRP C[C@H]([NH2+]C1CC(N2CCC(C(F)(F)F)CC2)C1)C1C(C)(C)C1(C)C ZINC000475354999 1029571198 /nfs/dbraw/zinc/57/11/98/1029571198.db2.gz UILRYSULPRYBRG-GRTSSRMGSA-N 2 0 346.481 4.452 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)CCCO2 ZINC000359938934 1029603719 /nfs/dbraw/zinc/60/37/19/1029603719.db2.gz AMPAWYZQWOAJIZ-YLJYHZDGSA-N 2 0 346.515 4.153 20 0 EIADRP Fc1ccccc1-c1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)o1 ZINC000446882972 1029618025 /nfs/dbraw/zinc/61/80/25/1029618025.db2.gz DAEUIWOVQNNFET-UHFFFAOYSA-N 2 0 328.431 4.050 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1cccc(C2CC2)c1 ZINC000708502471 1029744005 /nfs/dbraw/zinc/74/40/05/1029744005.db2.gz HNSCXKKPRRKWIP-MBSDFSHPSA-N 2 0 334.507 4.422 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1cc2cnccc2o1 ZINC000657851750 1029792410 /nfs/dbraw/zinc/79/24/10/1029792410.db2.gz QZLOALMLENDVSV-QGZVFWFLSA-N 2 0 349.478 4.391 20 0 EIADRP Cc1cc(N2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c2cc(F)ccc2[nH+]1 ZINC000301793065 1029809772 /nfs/dbraw/zinc/80/97/72/1029809772.db2.gz RQKBFVPMNMBWAL-YWZLYKJASA-N 2 0 339.458 4.135 20 0 EIADRP FC(F)(F)c1cccc([C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)C2CC2)c1 ZINC000091284505 1029882351 /nfs/dbraw/zinc/88/23/51/1029882351.db2.gz UDAASVJVOSSRAX-SCLBCKFNSA-N 2 0 338.417 4.230 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000091333287 1029884374 /nfs/dbraw/zinc/88/43/74/1029884374.db2.gz AGBXUTCNOOKOBH-KRWDZBQOSA-N 2 0 326.406 4.088 20 0 EIADRP Cc1cc(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)ccc1Oc1cccnc1 ZINC000092072961 1029899608 /nfs/dbraw/zinc/89/96/08/1029899608.db2.gz SQRBVBWPQOOVLG-GOSISDBHSA-N 2 0 348.450 4.285 20 0 EIADRP CCN1CCC[C@@H](C[N@H+](C)CCC2=CCCCC2)[C@@H]1c1cnn(C)c1 ZINC000450795163 1029986238 /nfs/dbraw/zinc/98/62/38/1029986238.db2.gz SWOFJTQGDDUQOY-PZJWPPBQSA-N 2 0 344.547 4.015 20 0 EIADRP c1nc(C2CC2)sc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000093769362 1029991240 /nfs/dbraw/zinc/99/12/40/1029991240.db2.gz DXUUMSHRBRQNMR-UHFFFAOYSA-N 2 0 333.545 4.109 20 0 EIADRP c1ccc(C2CCC([NH2+]C3CCN(c4cc[nH+]cc4)CC3)CC2)cc1 ZINC000392254614 1030066280 /nfs/dbraw/zinc/06/62/80/1030066280.db2.gz IDEFWQKPPFYRSZ-UHFFFAOYSA-N 2 0 335.495 4.366 20 0 EIADRP Fc1ccc([C@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2ccccc2)cc1 ZINC000447549287 1030153311 /nfs/dbraw/zinc/15/33/11/1030153311.db2.gz DTIURRYKCOJUPU-JOCHJYFZSA-N 2 0 338.470 4.379 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(Br)c(Cl)c1 ZINC000657877295 1030155201 /nfs/dbraw/zinc/15/52/01/1030155201.db2.gz PUYOODWCPKWMGA-NEPJUHHUSA-N 2 0 345.712 4.095 20 0 EIADRP Clc1ccc2c(c1Cl)CC[C@@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447574941 1030160661 /nfs/dbraw/zinc/16/06/61/1030160661.db2.gz XFQMZPFWBCYYDV-KRWDZBQOSA-N 2 0 339.310 4.445 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCc2c(F)cccc2Cl)[C@H](C)C1 ZINC000447728300 1030291272 /nfs/dbraw/zinc/29/12/72/1030291272.db2.gz LBGSGTHZSMZWOD-KDOFPFPSSA-N 2 0 326.887 4.074 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCc2c(F)cccc2Cl)[C@@H](C)C1 ZINC000447728302 1030294839 /nfs/dbraw/zinc/29/48/39/1030294839.db2.gz LBGSGTHZSMZWOD-KSSFIOAISA-N 2 0 326.887 4.074 20 0 EIADRP CC(C)[NH+]1CCC([N@H+](C)CCCc2c(F)cccc2Cl)CC1 ZINC000447798676 1030330236 /nfs/dbraw/zinc/33/02/36/1030330236.db2.gz ZQNCFEWXFNCNNI-UHFFFAOYSA-N 2 0 326.887 4.216 20 0 EIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccc(F)cc3C(F)(F)F)C2)CC1 ZINC000685462796 1030341859 /nfs/dbraw/zinc/34/18/59/1030341859.db2.gz FLHPLUOTMCXRFE-CQSZACIVSA-N 2 0 344.396 4.008 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1cccc2cccnc21 ZINC000708571134 1030390631 /nfs/dbraw/zinc/39/06/31/1030390631.db2.gz QRYGAPPCCUQJCV-AVRDEDQJSA-N 2 0 345.490 4.093 20 0 EIADRP CSc1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000685621683 1030575918 /nfs/dbraw/zinc/57/59/18/1030575918.db2.gz UHOMEKIUUAFIRS-MRXNPFEDSA-N 2 0 332.538 4.082 20 0 EIADRP Cc1nccn1CCCC[N@H+](CCC(F)(F)F)Cc1ccccc1 ZINC000191237731 1030610662 /nfs/dbraw/zinc/61/06/62/1030610662.db2.gz HLPIJMHBOUYULI-UHFFFAOYSA-N 2 0 339.405 4.426 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000527348869 1030635799 /nfs/dbraw/zinc/63/57/99/1030635799.db2.gz BSHMWCCXLXWXSK-NHCUHLMSSA-N 2 0 338.495 4.053 20 0 EIADRP CC(C)Oc1ccccc1[C@@H](C)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000392620158 1030636498 /nfs/dbraw/zinc/63/64/98/1030636498.db2.gz BZCKLEWTUOXZJE-QGZVFWFLSA-N 2 0 339.483 4.188 20 0 EIADRP CC[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000658027979 1030776132 /nfs/dbraw/zinc/77/61/32/1030776132.db2.gz BHTOSNKYBKKERI-OOKSDGMUSA-N 2 0 340.433 4.241 20 0 EIADRP c1cc2ccc(C[NH2+]Cc3ccccc3C[NH+]3CCCCC3)cc2[nH]1 ZINC000527633978 1030787450 /nfs/dbraw/zinc/78/74/50/1030787450.db2.gz SUKAMGVZLWGFOC-UHFFFAOYSA-N 2 0 333.479 4.444 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+]Cc3ccc4cc[nH]c4c3)CC2)c1 ZINC000527651281 1030802555 /nfs/dbraw/zinc/80/25/55/1030802555.db2.gz VGCQFZIUTLXHOZ-UHFFFAOYSA-N 2 0 339.508 4.231 20 0 EIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2noc3ccccc32)CC1 ZINC000658067241 1030814138 /nfs/dbraw/zinc/81/41/38/1030814138.db2.gz TWKXKVPSLCGKKJ-JXFKEZNVSA-N 2 0 341.499 4.003 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)[C@@H]1CCCC[C@H]1C ZINC000658164161 1030860608 /nfs/dbraw/zinc/86/06/08/1030860608.db2.gz MUAAOPDCAGWDCV-DBXWQHBBSA-N 2 0 329.532 4.098 20 0 EIADRP c1ccc([C@H]2CCC[C@H]2[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658168776 1030864452 /nfs/dbraw/zinc/86/44/52/1030864452.db2.gz YSOOTCPXIWSFSZ-DHIUTWEWSA-N 2 0 349.522 4.220 20 0 EIADRP CC(C)CC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)C1CC1 ZINC000658166181 1030864664 /nfs/dbraw/zinc/86/46/64/1030864664.db2.gz MXPIGJBPADPPEN-NRFANRHFSA-N 2 0 329.532 4.098 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)[C@@H]1C[C@H]1c1ccccc1 ZINC000658166172 1030864930 /nfs/dbraw/zinc/86/49/30/1030864930.db2.gz MVXIPYXZJDPJPX-TZYHBYERSA-N 2 0 349.522 4.075 20 0 EIADRP C[C@]1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)CC1(F)F ZINC000658219634 1030885810 /nfs/dbraw/zinc/88/58/10/1030885810.db2.gz CJANBTSUOQPLGU-NCXUSEDFSA-N 2 0 334.454 4.065 20 0 EIADRP CC(C)(C)O[C@@H]1C[C@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C12CCC2 ZINC000658255849 1030928209 /nfs/dbraw/zinc/92/82/09/1030928209.db2.gz WOSDQJHISCPTBZ-RBUKOAKNSA-N 2 0 334.548 4.109 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CC[C@@H]2CCCOC2)ccc1OC ZINC000527930124 1030971880 /nfs/dbraw/zinc/97/18/80/1030971880.db2.gz PVHNLVVAKDDYHW-ROUUACIJSA-N 2 0 348.531 4.004 20 0 EIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3c[nH]c4ccccc34)CC2)C1 ZINC000532442229 1031069410 /nfs/dbraw/zinc/06/94/10/1031069410.db2.gz MUPBXMMTFOEKQR-PXNSSMCTSA-N 2 0 339.527 4.343 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(OCc3ccccc3)cc2)[C@@H](C)C1 ZINC000532459607 1031112827 /nfs/dbraw/zinc/11/28/27/1031112827.db2.gz MDFXGJZBQIDVMJ-PGRDOPGGSA-N 2 0 338.495 4.086 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCSCc1cccc2ccccc21 ZINC000532477058 1031207026 /nfs/dbraw/zinc/20/70/26/1031207026.db2.gz MPKQUSUOBDUGEJ-LLGFUMIMSA-N 2 0 342.552 4.391 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CCCC[NH+](C)C ZINC000532489900 1031220228 /nfs/dbraw/zinc/22/02/28/1031220228.db2.gz IKSUJISPGXFXOX-CYBMUJFWSA-N 2 0 335.492 4.250 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2cc3cccnc3o2)CC1 ZINC000449020753 1031384189 /nfs/dbraw/zinc/38/41/89/1031384189.db2.gz AINQXQDEUWWVBK-UHFFFAOYSA-N 2 0 349.478 4.172 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H]2CCCOc3c(Cl)cccc32)c1 ZINC000123616495 1031473391 /nfs/dbraw/zinc/47/33/91/1031473391.db2.gz ORRVCZDDZQUFDO-IBGZPJMESA-N 2 0 344.886 4.405 20 0 EIADRP CC[C@@H]([NH2+]CC1(N[C@H](C)c2ccccc2)CCOCC1)C1CCC1 ZINC000449155198 1031483421 /nfs/dbraw/zinc/48/34/21/1031483421.db2.gz KNYXFAHVINABJS-YLJYHZDGSA-N 2 0 330.516 4.055 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)c1ccc(OC)cc1 ZINC000123932752 1031496117 /nfs/dbraw/zinc/49/61/17/1031496117.db2.gz FBYOOBUWLXNYMH-NRFANRHFSA-N 2 0 326.484 4.388 20 0 EIADRP COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000531712254 1031499893 /nfs/dbraw/zinc/49/98/93/1031499893.db2.gz OVNBZZOKMNEVFG-OAHLLOKOSA-N 2 0 330.447 4.055 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)CC1 ZINC000449163137 1031504717 /nfs/dbraw/zinc/50/47/17/1031504717.db2.gz LJGBCPYARCDWKK-KSZLIROESA-N 2 0 336.564 4.069 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCC[C@H]3OCC[C@H]32)CC1 ZINC000449189392 1031506285 /nfs/dbraw/zinc/50/62/85/1031506285.db2.gz UPQJMUYAUNASSX-IPMKNSEASA-N 2 0 336.564 4.213 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCCc1ccc(Cl)cc1Cl ZINC000531738280 1031514751 /nfs/dbraw/zinc/51/47/51/1031514751.db2.gz FUHJTXZAAOBUOM-IGCXYCKISA-N 2 0 329.315 4.244 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCCc1ccc(Cl)cc1Cl ZINC000531738282 1031516675 /nfs/dbraw/zinc/51/66/75/1031516675.db2.gz FUHJTXZAAOBUOM-PBFPGSCMSA-N 2 0 329.315 4.244 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccoc1 ZINC000531719687 1031521031 /nfs/dbraw/zinc/52/10/31/1031521031.db2.gz BDUKLOVQIQUWBW-OAHLLOKOSA-N 2 0 332.875 4.496 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H]2CCCC(F)(F)C2)CC1 ZINC000449183946 1031523929 /nfs/dbraw/zinc/52/39/29/1031523929.db2.gz GPAAQCYIZGOOTA-APWZRJJASA-N 2 0 336.470 4.250 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)c1ccncn1 ZINC000453071183 1031539032 /nfs/dbraw/zinc/53/90/32/1031539032.db2.gz DBAQWKHFUVCVSB-QGZVFWFLSA-N 2 0 346.478 4.056 20 0 EIADRP C[C@H]1CC[C@@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)c2sccc21 ZINC000453061648 1031551278 /nfs/dbraw/zinc/55/12/78/1031551278.db2.gz LEHIGAGFPFVRLD-HNAYVOBHSA-N 2 0 344.524 4.417 20 0 EIADRP C[C@H](CC(F)(F)F)[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449249483 1031564178 /nfs/dbraw/zinc/56/41/78/1031564178.db2.gz LVJZINZFTZKKHI-HUUCEWRRSA-N 2 0 328.422 4.013 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CCO1 ZINC000449255025 1031573271 /nfs/dbraw/zinc/57/32/71/1031573271.db2.gz ZLEYEFMFUWYLHL-MOPGFXCFSA-N 2 0 338.580 4.459 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCC[C@H]2CCCCO2)CC1 ZINC000449241747 1031576980 /nfs/dbraw/zinc/57/69/80/1031576980.db2.gz CMGINWABOUQYFU-DENIHFKCSA-N 2 0 344.543 4.021 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@@H]2CCO[C@@H](C3CC3)C2)CC1 ZINC000449247439 1031583058 /nfs/dbraw/zinc/58/30/58/1031583058.db2.gz GFEXEYBFHUKCII-RTBURBONSA-N 2 0 336.564 4.213 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)c2sccc21 ZINC000453094783 1031591281 /nfs/dbraw/zinc/59/12/81/1031591281.db2.gz SZDKZRZDUTVPIA-QAPCUYQASA-N 2 0 344.524 4.417 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@@H]2CCC(F)(F)C2)CC1 ZINC000449298098 1031603931 /nfs/dbraw/zinc/60/39/31/1031603931.db2.gz FSRJSPRAZOAGOQ-SJLPKXTDSA-N 2 0 336.470 4.107 20 0 EIADRP COCC[C@@H]([NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1)C(C)(C)C ZINC000449312759 1031629390 /nfs/dbraw/zinc/62/93/90/1031629390.db2.gz NFQQKNWSQVMAJP-WIYYLYMNSA-N 2 0 346.559 4.123 20 0 EIADRP COCC1CCC([NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000449338109 1031655381 /nfs/dbraw/zinc/65/53/81/1031655381.db2.gz RNKCRZBIFMILQM-ORFBVSJDSA-N 2 0 344.543 4.084 20 0 EIADRP COCCC(C)(C)C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@H]21 ZINC000453198903 1031710056 /nfs/dbraw/zinc/71/00/56/1031710056.db2.gz PESYJQNADREOQK-HBMCJLEFSA-N 2 0 344.543 4.082 20 0 EIADRP FC1(F)CC(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)C1 ZINC000453242258 1031796323 /nfs/dbraw/zinc/79/63/23/1031796323.db2.gz PYGGRXLLNVIYBE-QRVBRYPASA-N 2 0 334.454 4.065 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449561691 1031848032 /nfs/dbraw/zinc/84/80/32/1031848032.db2.gz XHFFIDVNXQQLDE-FENUFBNTSA-N 2 0 338.417 4.324 20 0 EIADRP Cc1nccn1CCCC[N@@H+](C)CCCOc1ccc(Cl)cc1 ZINC000119351214 1031878945 /nfs/dbraw/zinc/87/89/45/1031878945.db2.gz WHUCLQPBBBYHMT-UHFFFAOYSA-N 2 0 335.879 4.026 20 0 EIADRP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000453351985 1031880450 /nfs/dbraw/zinc/88/04/50/1031880450.db2.gz NAIGBMBZPCDAOI-MGNMYUMUSA-N 2 0 338.948 4.426 20 0 EIADRP C[C@H](C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C)c1c(Cl)cccc1Cl ZINC000531963663 1031883950 /nfs/dbraw/zinc/88/39/50/1031883950.db2.gz LNNLFEFSMYYNES-NFFDBFGFSA-N 2 0 329.315 4.415 20 0 EIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000531970875 1031904391 /nfs/dbraw/zinc/90/43/91/1031904391.db2.gz ZDINZSKSVGJXEE-MJBXVCDLSA-N 2 0 345.314 4.081 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@H](Cc1ccccc1)c1ccccc1 ZINC000531993771 1031960813 /nfs/dbraw/zinc/96/08/13/1031960813.db2.gz LEIBZYUZJOKJCW-VKGYTVAMSA-N 2 0 336.523 4.331 20 0 EIADRP C[N@H+](CCCSc1ccccc1Cl)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000512559952 1033378784 /nfs/dbraw/zinc/37/87/84/1033378784.db2.gz BAORETBWXOHZKO-XYPWUTKMSA-N 2 0 338.948 4.379 20 0 EIADRP Cn1cncc1CCC[N@H+](Cc1ccc(Cl)c(Cl)c1)C1CC1 ZINC000575427212 1033439852 /nfs/dbraw/zinc/43/98/52/1033439852.db2.gz MOICHHYLTFQDCC-UHFFFAOYSA-N 2 0 338.282 4.324 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1ccns1 ZINC000924862642 1033447219 /nfs/dbraw/zinc/44/72/19/1033447219.db2.gz XBWOZOKSGPZZKS-INIZCTEOSA-N 2 0 329.513 4.370 20 0 EIADRP FC1(F)CCC([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)CC1 ZINC000512632311 1033556480 /nfs/dbraw/zinc/55/64/80/1033556480.db2.gz YZSBOIQZBGAPKD-DFQSSKMNSA-N 2 0 348.481 4.455 20 0 EIADRP FC(F)(F)CCC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000512653430 1033621041 /nfs/dbraw/zinc/62/10/41/1033621041.db2.gz FHIFODHMDTVILA-FGTMMUONSA-N 2 0 340.433 4.219 20 0 EIADRP Cc1nccn1CCC[N@@H+](C)[C@@H](C)c1nc2ccccc2n1C(F)F ZINC000411403189 1033883400 /nfs/dbraw/zinc/88/34/00/1033883400.db2.gz VUZKSRKVSHIELL-ZDUSSCGKSA-N 2 0 347.413 4.019 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2ncc(C(F)(F)F)s2)CC1 ZINC000433336179 1034254029 /nfs/dbraw/zinc/25/40/29/1034254029.db2.gz UBIBCUKLZVONJB-UHFFFAOYSA-N 2 0 349.466 4.010 20 0 EIADRP C[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc(F)c(F)c1 ZINC000469099938 1034900004 /nfs/dbraw/zinc/90/00/04/1034900004.db2.gz ZCIOFOBBMOZGDQ-HRAATJIYSA-N 2 0 344.449 4.008 20 0 EIADRP c1cc2c(cccc2C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)[nH]1 ZINC000513437900 1034945004 /nfs/dbraw/zinc/94/50/04/1034945004.db2.gz GROSGYUDHDQGST-GOSISDBHSA-N 2 0 325.500 4.256 20 0 EIADRP CCc1nc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cs1 ZINC000513546755 1035029275 /nfs/dbraw/zinc/02/92/75/1035029275.db2.gz ZPSJVNKCPWTJRS-SJLPKXTDSA-N 2 0 343.540 4.096 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H](c2ccccc2)c2ccc(F)cc2)CC1 ZINC000513679011 1035107684 /nfs/dbraw/zinc/10/76/84/1035107684.db2.gz TWHBMZFYBXBHOU-XVAXZDLZSA-N 2 0 326.459 4.378 20 0 EIADRP C[C@H](c1ccccc1F)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501049480 1035358515 /nfs/dbraw/zinc/35/85/15/1035358515.db2.gz JHLICUHVRMTBQA-MRXNPFEDSA-N 2 0 327.447 4.130 20 0 EIADRP C[N@@H+](Cc1ccc(Cl)s1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501048709 1035358558 /nfs/dbraw/zinc/35/85/58/1035358558.db2.gz SCRSNNIXQVNFEW-UHFFFAOYSA-N 2 0 335.904 4.145 20 0 EIADRP C[C@@H](c1c(F)cccc1F)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501060327 1035364061 /nfs/dbraw/zinc/36/40/61/1035364061.db2.gz AGADWKCKRJDQMG-HNNXBMFYSA-N 2 0 345.437 4.269 20 0 EIADRP CCc1ccc(CC[N@H+](C)CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000501064519 1035366006 /nfs/dbraw/zinc/36/60/06/1035366006.db2.gz XLIXZFKQVJCEOK-UHFFFAOYSA-N 2 0 337.511 4.035 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000501378237 1035433364 /nfs/dbraw/zinc/43/33/64/1035433364.db2.gz PACLTWOMMVQFQZ-XAPVIXHLSA-N 2 0 343.559 4.456 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+]C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000501419516 1035441768 /nfs/dbraw/zinc/44/17/68/1035441768.db2.gz GZYHKHYRHXXEET-IPJDOKCGSA-N 2 0 326.406 4.040 20 0 EIADRP CCc1cc(OC)ccc1C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000501453146 1035447654 /nfs/dbraw/zinc/44/76/54/1035447654.db2.gz RZKZKNCOOYOLJK-UHFFFAOYSA-N 2 0 330.516 4.144 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000501466377 1035450151 /nfs/dbraw/zinc/45/01/51/1035450151.db2.gz JNXGAHNQKXKFCR-PXXUHZIESA-N 2 0 326.406 4.181 20 0 EIADRP CC(C)OC[C@H](C)[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000501477585 1035452639 /nfs/dbraw/zinc/45/26/39/1035452639.db2.gz WEEQUNLSKNCNCR-SFHVURJKSA-N 2 0 340.511 4.318 20 0 EIADRP CC(C)OC[C@@H](C)[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000501477583 1035453041 /nfs/dbraw/zinc/45/30/41/1035453041.db2.gz WEEQUNLSKNCNCR-GOSISDBHSA-N 2 0 340.511 4.318 20 0 EIADRP C[N@@H+](Cc1ccccc1OCc1ccccc1)CC1CC[NH+](C)CC1 ZINC000513716694 1035456659 /nfs/dbraw/zinc/45/66/59/1035456659.db2.gz GPQRJIDJBLJXOB-UHFFFAOYSA-N 2 0 338.495 4.039 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[N@H+](C)CC[C@@H]2CC[NH2+]C2)cc1 ZINC000420294551 1035492712 /nfs/dbraw/zinc/49/27/12/1035492712.db2.gz BBEGUNNBGNMCFG-MSOLQXFVSA-N 2 0 338.495 4.355 20 0 EIADRP CSCC1(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000595073427 1035556177 /nfs/dbraw/zinc/55/61/77/1035556177.db2.gz SLDWDSCGUNGRBI-MJGOQNOKSA-N 2 0 332.557 4.020 20 0 EIADRP C[C@H](c1ccc(OC(F)F)cc1)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000501770134 1035576678 /nfs/dbraw/zinc/57/66/78/1035576678.db2.gz MWPJNGVCLMIWON-OAHLLOKOSA-N 2 0 340.458 4.403 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC1(c2ccccc2)CCCCC1 ZINC000575115336 1035707709 /nfs/dbraw/zinc/70/77/09/1035707709.db2.gz YHMUJLHZAJRIJR-QGZVFWFLSA-N 2 0 337.511 4.401 20 0 EIADRP CCCCCOc1cc(C[N@H+](C)CC2CC[NH+](C)CC2)ccc1OC ZINC000513723835 1035717419 /nfs/dbraw/zinc/71/74/19/1035717419.db2.gz AZXCCRDUHYJAOB-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1ccnc(Cl)c1 ZINC000163781559 1035865345 /nfs/dbraw/zinc/86/53/45/1035865345.db2.gz FHPRRDOUWBWHJN-HNNXBMFYSA-N 2 0 331.891 4.428 20 0 EIADRP CC(C)SCC[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000485497119 1035948549 /nfs/dbraw/zinc/94/85/49/1035948549.db2.gz WUDIQOZJMVXOES-UHFFFAOYSA-N 2 0 332.557 4.116 20 0 EIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@H]1CCCC12CCOCC2 ZINC000502250871 1036008866 /nfs/dbraw/zinc/00/88/66/1036008866.db2.gz GFPVHTIOBKOETM-NRFANRHFSA-N 2 0 342.527 4.111 20 0 EIADRP C[C@@H](N[C@@H](C)c1cnn(C2CCCC2)c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000502469655 1036245577 /nfs/dbraw/zinc/24/55/77/1036245577.db2.gz CWWZEARNNUJVNN-SQNIBIBYSA-N 2 0 344.547 4.302 20 0 EIADRP COc1ccccc1/C=C\C[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000588178437 1036288956 /nfs/dbraw/zinc/28/89/56/1036288956.db2.gz PCQCCHIJZIWOLQ-WQLSENKSSA-N 2 0 338.495 4.338 20 0 EIADRP FC(F)C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000421366213 1036310699 /nfs/dbraw/zinc/31/06/99/1036310699.db2.gz CABBPINJHWCHMG-GOSISDBHSA-N 2 0 331.410 4.037 20 0 EIADRP Cc1c(F)cccc1-c1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)o1 ZINC000421376950 1036329923 /nfs/dbraw/zinc/32/99/23/1036329923.db2.gz SFBDLESWULQARW-UHFFFAOYSA-N 2 0 330.447 4.357 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC12CCSCC2)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000421384974 1036343133 /nfs/dbraw/zinc/34/31/33/1036343133.db2.gz QAJVINTXXXXKEL-DFQSSKMNSA-N 2 0 344.568 4.020 20 0 EIADRP c1nc(C2CCCCC2)sc1C[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000572243021 1036469642 /nfs/dbraw/zinc/46/96/42/1036469642.db2.gz HHUBFJPLNPPRPW-SJORKVTESA-N 2 0 333.545 4.012 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000502696048 1036512283 /nfs/dbraw/zinc/51/22/83/1036512283.db2.gz BMJSLHZGLUHBPA-NYVOZVTQSA-N 2 0 344.543 4.213 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)oc1C ZINC000502707185 1036541936 /nfs/dbraw/zinc/54/19/36/1036541936.db2.gz DBHCFATWKYOYKP-QGZVFWFLSA-N 2 0 342.483 4.222 20 0 EIADRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000502710996 1036568477 /nfs/dbraw/zinc/56/84/77/1036568477.db2.gz ZSXSMSZQCHJROS-SIKLNZKXSA-N 2 0 344.543 4.357 20 0 EIADRP CC[N@H+](Cc1cccc(C(F)(F)F)c1)C1CC[NH+](CC2CC2)CC1 ZINC001168388694 1036721820 /nfs/dbraw/zinc/72/18/20/1036721820.db2.gz GJELUANPBCYUNE-UHFFFAOYSA-N 2 0 340.433 4.402 20 0 EIADRP COc1cc(Cl)ccc1[C@H](C)[NH2+]C1CCN(c2ccccn2)CC1 ZINC000421821365 1036777986 /nfs/dbraw/zinc/77/79/86/1036777986.db2.gz RBKHISDYSAUUTD-AWEZNQCLSA-N 2 0 345.874 4.063 20 0 EIADRP CC(C)C[NH2+]C[C@@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000503043718 1036884205 /nfs/dbraw/zinc/88/42/05/1036884205.db2.gz HDLPTYWMRGXHNR-RDJZCZTQSA-N 2 0 328.422 4.334 20 0 EIADRP CC1CC[NH+](Cc2ccc(C[NH2+]C/C=C/c3ccncc3)cc2)CC1 ZINC000486935194 1036900649 /nfs/dbraw/zinc/90/06/49/1036900649.db2.gz ZKEYAQNACLFCQJ-NSCUHMNNSA-N 2 0 335.495 4.117 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+]C[C@H]2CCSC2)C1 ZINC000486982935 1036935421 /nfs/dbraw/zinc/93/54/21/1036935421.db2.gz VJVFQPOHCWERLG-KZNAEPCWSA-N 2 0 332.557 4.007 20 0 EIADRP CC1CC[NH+](Cc2ccccc2C[NH2+]C/C=C\c2ccncc2)CC1 ZINC000486990978 1036939011 /nfs/dbraw/zinc/93/90/11/1036939011.db2.gz SAVBGXHYBZRHIL-PLNGDYQASA-N 2 0 335.495 4.117 20 0 EIADRP Cc1ccccc1C[N@@H+]1CCCN(c2cc[nH+]c3ccccc32)CC1 ZINC000599496016 1037031387 /nfs/dbraw/zinc/03/13/87/1037031387.db2.gz RDPCSMXLCGQDIP-UHFFFAOYSA-N 2 0 331.463 4.256 20 0 EIADRP C[C@@H](Cn1ccnc1)[NH2+]Cc1cn(Cc2ccccc2)c2ccccc12 ZINC000590612064 1037117144 /nfs/dbraw/zinc/11/71/44/1037117144.db2.gz WYJCRWHVABEDJS-SFHVURJKSA-N 2 0 344.462 4.064 20 0 EIADRP COc1ccc2cc(C[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)ccc2c1 ZINC000604770810 1037512335 /nfs/dbraw/zinc/51/23/35/1037512335.db2.gz JYBOZZVDAKZFIZ-FQEVSTJZSA-N 2 0 328.500 4.304 20 0 EIADRP C[NH+]1CCC(CC[NH2+]Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000591709002 1037556505 /nfs/dbraw/zinc/55/65/05/1037556505.db2.gz FHRFNRQOKOAVGL-UHFFFAOYSA-N 2 0 332.488 4.376 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](CC2CCCC2)CC1)[C@@H]1C[C@H]1c1cccs1 ZINC000669418427 1037572702 /nfs/dbraw/zinc/57/27/02/1037572702.db2.gz XMICPRCWBUUDIR-AYOQOUSVSA-N 2 0 332.557 4.484 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)CS1 ZINC000488412617 1037580425 /nfs/dbraw/zinc/58/04/25/1037580425.db2.gz OZIFVYLVFCZPIW-WMZOPIPTSA-N 2 0 338.586 4.080 20 0 EIADRP CC(C)[C@H]1C[C@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)CS1 ZINC000488412615 1037581437 /nfs/dbraw/zinc/58/14/37/1037581437.db2.gz OZIFVYLVFCZPIW-FUHWJXTLSA-N 2 0 338.586 4.080 20 0 EIADRP CC(C)[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CS1 ZINC000488436641 1037591946 /nfs/dbraw/zinc/59/19/46/1037591946.db2.gz YAGQONXUJIIPBB-VNPDGQOTSA-N 2 0 344.568 4.302 20 0 EIADRP c1c2ccccc2oc1CNC[C@H]1CC[N@@H+](CCc2ccccc2)C1 ZINC000488514664 1037644180 /nfs/dbraw/zinc/64/41/80/1037644180.db2.gz NSHFXKBSPKWZMM-LJQANCHMSA-N 2 0 334.463 4.087 20 0 EIADRP C[C@H]([NH2+][C@@H]1CS[C@@H](C(C)(C)C)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000488551025 1037663877 /nfs/dbraw/zinc/66/38/77/1037663877.db2.gz ZOHQJIUJKFPPCB-FRYIKTPZSA-N 2 0 346.584 4.407 20 0 EIADRP c1ccc(SCC[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cc1 ZINC000605149967 1037694892 /nfs/dbraw/zinc/69/48/92/1037694892.db2.gz XVGZECRTDOQXAC-UHFFFAOYSA-N 2 0 332.557 4.367 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c(C)c1 ZINC000422713324 1037810927 /nfs/dbraw/zinc/81/09/27/1037810927.db2.gz PNLPDRHYECLCMQ-WEYGHZABSA-N 2 0 336.479 4.210 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](c1ccc(F)cc1)C1CCC1 ZINC000422718235 1037813451 /nfs/dbraw/zinc/81/34/51/1037813451.db2.gz PMSBLRFWBQWYJS-VBKZILBWSA-N 2 0 327.447 4.180 20 0 EIADRP CCc1ccc([C@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422741919 1037822788 /nfs/dbraw/zinc/82/27/88/1037822788.db2.gz FPGMCERHCOVOBM-XUEUYAKLSA-N 2 0 336.479 4.156 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000422747402 1037823639 /nfs/dbraw/zinc/82/36/39/1037823639.db2.gz YLEUNGLZSPPJOR-WWGRRREGSA-N 2 0 347.503 4.296 20 0 EIADRP Cc1c2ccccc2oc1C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422748889 1037825312 /nfs/dbraw/zinc/82/53/12/1037825312.db2.gz WQCLRHGHHZHJIG-GCJKJVERSA-N 2 0 348.446 4.087 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cc2ccccc2o1 ZINC000422768535 1037828741 /nfs/dbraw/zinc/82/87/41/1037828741.db2.gz NZUULJMBPZZYBU-QXATTWAWSA-N 2 0 348.446 4.339 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422777828 1037830190 /nfs/dbraw/zinc/83/01/90/1037830190.db2.gz GHALVKVBOHPXRG-LATSOQNDSA-N 2 0 336.479 4.296 20 0 EIADRP COc1cccc([C@@H]([NH2+][C@@H](C)CCC[NH3+])c2ccccc2Cl)c1 ZINC000422776014 1037830217 /nfs/dbraw/zinc/83/02/17/1037830217.db2.gz BVQRLMXSYKEFPU-IFXJQAMLSA-N 2 0 332.875 4.155 20 0 EIADRP COc1ccccc1[C@@H]([NH2+][C@H](C)CCC[NH3+])c1ccccc1Cl ZINC000422778032 1037831148 /nfs/dbraw/zinc/83/11/48/1037831148.db2.gz GWVQZBJYDDAKDO-KUHUBIRLSA-N 2 0 332.875 4.155 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@H+](C)C[C@@H]1CC[NH2+][C@@H](C)C1 ZINC000414690880 1037832212 /nfs/dbraw/zinc/83/22/12/1037832212.db2.gz AXIFKXRPEDTUOG-BHYGNILZSA-N 2 0 343.540 4.499 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+]C3CCC(C[NH3+])CC3)cc2)cs1 ZINC000422801864 1037836132 /nfs/dbraw/zinc/83/61/32/1037836132.db2.gz GJJMEQVDWBZKKG-UQHVZDHRSA-N 2 0 329.513 4.287 20 0 EIADRP Cc1cccc(Oc2cc(C[NH2+][C@@H](C)CCCC[NH3+])ccn2)c1C ZINC000422803456 1037836997 /nfs/dbraw/zinc/83/69/97/1037836997.db2.gz GALINCAJCATNPS-INIZCTEOSA-N 2 0 327.472 4.098 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(Cl)s1 ZINC000422807361 1037837302 /nfs/dbraw/zinc/83/73/02/1037837302.db2.gz MMMJLSILKPCPHR-WPKBUWHJSA-N 2 0 348.899 4.308 20 0 EIADRP COc1ccccc1[C@H](CC(C)C)[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422825933 1037841986 /nfs/dbraw/zinc/84/19/86/1037841986.db2.gz QFLMOVBVDAIJPA-JXFKEZNVSA-N 2 0 341.499 4.295 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000422866234 1037849090 /nfs/dbraw/zinc/84/90/90/1037849090.db2.gz PWSANVQUJRYODH-IAGOWNOFSA-N 2 0 339.483 4.107 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCCOc1ccc2ccccc2c1 ZINC000422886487 1037853926 /nfs/dbraw/zinc/85/39/26/1037853926.db2.gz JELIRGZBCNHKPS-MRXNPFEDSA-N 2 0 349.478 4.122 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422884768 1037854374 /nfs/dbraw/zinc/85/43/74/1037854374.db2.gz FPUPXQDLMHQYHL-DTWYCDNDSA-N 2 0 341.524 4.361 20 0 EIADRP CCCCCOc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1OC ZINC000422889861 1037856877 /nfs/dbraw/zinc/85/68/77/1037856877.db2.gz HBCNFPVGGQIKFP-YJJAZYOBSA-N 2 0 346.515 4.198 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000422908731 1037863533 /nfs/dbraw/zinc/86/35/33/1037863533.db2.gz DSLWZXCLVYZEKB-KCQAQPDRSA-N 2 0 347.503 4.296 20 0 EIADRP COc1ccccc1Oc1ccc(C[NH2+][C@@H](C)CCCC[NH3+])cc1 ZINC000422908178 1037863576 /nfs/dbraw/zinc/86/35/76/1037863576.db2.gz MCPAENBGSDAVKZ-INIZCTEOSA-N 2 0 328.456 4.095 20 0 EIADRP CO[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422911803 1037865794 /nfs/dbraw/zinc/86/57/94/1037865794.db2.gz LOPNYHHTODRSAB-FTNBBQJZSA-N 2 0 330.859 4.150 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)ccc1F ZINC000422921444 1037868936 /nfs/dbraw/zinc/86/89/36/1037868936.db2.gz PUVDPGSUIITNAQ-DLVCFXQMSA-N 2 0 340.442 4.041 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccccc1OCCC(C)C ZINC000422939433 1037875975 /nfs/dbraw/zinc/87/59/75/1037875975.db2.gz RMRPNZKXOHFHMZ-INIZCTEOSA-N 2 0 341.499 4.124 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1ccc(Br)cc1 ZINC000422943515 1037882709 /nfs/dbraw/zinc/88/27/09/1037882709.db2.gz KOJJMGYTDFNCMK-RDTXWAMCSA-N 2 0 347.300 4.256 20 0 EIADRP [NH3+][C@H]1CCCCC[C@H]1[NH2+]CCc1csc(-c2ccc(Cl)cc2)n1 ZINC000423017589 1037901385 /nfs/dbraw/zinc/90/13/85/1037901385.db2.gz WSUGXIOHQFMPCH-DLBZAZTESA-N 2 0 349.931 4.256 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1CCCOc2cc(Cl)ccc21 ZINC000423019845 1037906645 /nfs/dbraw/zinc/90/66/45/1037906645.db2.gz XKHGJYMLOKTAIR-UGSOOPFHSA-N 2 0 345.874 4.067 20 0 EIADRP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+]C1CCC(C[NH3+])CC1 ZINC000423026214 1037909761 /nfs/dbraw/zinc/90/97/61/1037909761.db2.gz PRZQNZUFMMSOHR-HESLUPGFSA-N 2 0 328.422 4.305 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCCCCc1ccc(F)cc1 ZINC000423066534 1037927941 /nfs/dbraw/zinc/92/79/41/1037927941.db2.gz WZCBIQNETQFHGR-HNNXBMFYSA-N 2 0 329.463 4.051 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1CCC(F)(F)CC1 ZINC000503864810 1037949274 /nfs/dbraw/zinc/94/92/74/1037949274.db2.gz WHCQLJBKTOXWRK-LPHOPBHVSA-N 2 0 336.470 4.312 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccc(-c2ccco2)cc1F ZINC000423086807 1037949840 /nfs/dbraw/zinc/94/98/40/1037949840.db2.gz OFDGTCQCZXSOIJ-ZDUSSCGKSA-N 2 0 339.414 4.099 20 0 EIADRP C[C@@H]1CC[NH2+]CC[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000423095003 1037952917 /nfs/dbraw/zinc/95/29/17/1037952917.db2.gz DATCRFHAJUVVQS-GDLHICMESA-N 2 0 327.299 4.217 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000423097865 1037956986 /nfs/dbraw/zinc/95/69/86/1037956986.db2.gz BOOQVNWPYWWHFK-XYPHTWIQSA-N 2 0 328.422 4.449 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C1CC(c2ccc(F)c(Cl)c2)C1 ZINC000423099658 1037958771 /nfs/dbraw/zinc/95/87/71/1037958771.db2.gz MGEOSJPMBHURKK-XEBKBJJBSA-N 2 0 347.865 4.238 20 0 EIADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000423100582 1037961031 /nfs/dbraw/zinc/96/10/31/1037961031.db2.gz HCVXLRKMZGHJND-XJKSGUPXSA-N 2 0 335.904 4.071 20 0 EIADRP CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1[NH2+][C@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000423101824 1037963315 /nfs/dbraw/zinc/96/33/15/1037963315.db2.gz DFRGJPBIGBFZBZ-QAGBHRCTSA-N 2 0 336.479 4.072 20 0 EIADRP Cc1cc([C@@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)ccc1F ZINC000423146629 1037998680 /nfs/dbraw/zinc/99/86/80/1037998680.db2.gz PUVDPGSUIITNAQ-JJXUHFIVSA-N 2 0 340.442 4.041 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H](Cc1ccccc1)c1nc2ccccc2s1 ZINC000423162329 1038020462 /nfs/dbraw/zinc/02/04/62/1038020462.db2.gz PCGKMOONBVANJQ-CRAIPNDOSA-N 2 0 339.508 4.297 20 0 EIADRP Cc1cc([C@H](Cc2ccccc2Cl)[NH2+]C2CC[NH2+]CC2)cs1 ZINC000423186398 1038020893 /nfs/dbraw/zinc/02/08/93/1038020893.db2.gz NYDDGOSWDLEVJW-SFHVURJKSA-N 2 0 334.916 4.335 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CC2([NH3+])CCCCCC2)CC1 ZINC000423198817 1038050600 /nfs/dbraw/zinc/05/06/00/1038050600.db2.gz ICGWLCJEDZLFOF-UHFFFAOYSA-N 3 0 343.559 4.071 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc2ccccc2c1OC(F)F ZINC000423218178 1038060591 /nfs/dbraw/zinc/06/05/91/1038060591.db2.gz VHGJKGMAGBFVBQ-UONOGXRCSA-N 2 0 334.410 4.091 20 0 EIADRP CSC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1 ZINC000423218963 1038062476 /nfs/dbraw/zinc/06/24/76/1038062476.db2.gz SQQSSTMXXXVKOX-XPKDYRNWSA-N 2 0 346.462 4.087 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1OC(F)F)[C@H]1CCC[NH2+]C1 ZINC000423216134 1038064094 /nfs/dbraw/zinc/06/40/94/1038064094.db2.gz NYYKJWSDNNZZFI-YCPHGPKFSA-N 2 0 348.437 4.480 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)CC1 ZINC000498422121 1038067650 /nfs/dbraw/zinc/06/76/50/1038067650.db2.gz KWUHOWBEAHXPQD-NRFANRHFSA-N 2 0 330.491 4.473 20 0 EIADRP Fc1ccc(C([NH2+]CC[C@@H]2CCC[NH2+]C2)c2ccc(F)cc2)cc1 ZINC000423260991 1038072844 /nfs/dbraw/zinc/07/28/44/1038072844.db2.gz RCXUBRGSMZMHGK-HNNXBMFYSA-N 2 0 330.422 4.034 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423264074 1038074339 /nfs/dbraw/zinc/07/43/39/1038074339.db2.gz XZTCDZXTPGJXNB-NVXWUHKLSA-N 2 0 343.540 4.467 20 0 EIADRP Fc1ccc([C@@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2ccccc2Cl)cc1 ZINC000423248551 1038081826 /nfs/dbraw/zinc/08/18/26/1038081826.db2.gz NIDLYUCAVUZDIU-IFXJQAMLSA-N 2 0 332.850 4.158 20 0 EIADRP Fc1cccc([C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2cccc(Cl)c2)c1 ZINC000423247870 1038082020 /nfs/dbraw/zinc/08/20/20/1038082020.db2.gz LVXIWRFMPOYUOJ-IFXJQAMLSA-N 2 0 332.850 4.158 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]CC[C@@H]3CCC[NH2+]C3)cs2)cs1 ZINC000423260768 1038087740 /nfs/dbraw/zinc/08/77/40/1038087740.db2.gz QQVIPDSBCBXFJY-OCCSQVGLSA-N 2 0 335.542 4.220 20 0 EIADRP CC(C)[C@@H](COCc1ccccc1)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000423293690 1038095620 /nfs/dbraw/zinc/09/56/20/1038095620.db2.gz RXUMSWWKBFPFQZ-DYESRHJHSA-N 2 0 326.484 4.037 20 0 EIADRP [NH3+][C@H](C[NH2+][C@H]1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1)C1CC1 ZINC000423315525 1038115713 /nfs/dbraw/zinc/11/57/13/1038115713.db2.gz IWPRQOJDMRVMFA-ZACQAIPSSA-N 2 0 326.406 4.059 20 0 EIADRP COCCC[C@@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)c1ccc(F)cc1 ZINC000423294312 1038121656 /nfs/dbraw/zinc/12/16/56/1038121656.db2.gz TZTMYEMHKIJTTG-FOIQADDNSA-N 2 0 330.447 4.103 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423345300 1038133852 /nfs/dbraw/zinc/13/38/52/1038133852.db2.gz YPZSBFPTINLMBL-ZDUSSCGKSA-N 2 0 347.503 4.298 20 0 EIADRP Fc1cccc([C@H]([NH2+]CC2=CC[NH2+]CC2)c2cccc(Cl)c2)c1 ZINC000423328942 1038140125 /nfs/dbraw/zinc/14/01/25/1038140125.db2.gz AZLHBDCSSVQAST-LJQANCHMSA-N 2 0 330.834 4.078 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H]2CC[C@@H](C[NH3+])C2)CCC3)cc1 ZINC000574310513 1038163225 /nfs/dbraw/zinc/16/32/25/1038163225.db2.gz STVQCSMUMUECFI-HYVNUMGLSA-N 2 0 341.524 4.213 20 0 EIADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H](Cc1ccccc1Cl)c1cccs1 ZINC000423362616 1038176188 /nfs/dbraw/zinc/17/61/88/1038176188.db2.gz BIWMMTFTMIXDKU-XOKHGSTOSA-N 2 0 334.916 4.273 20 0 EIADRP C[C@H]1C[C@H]([NH2+]C2CCC(c3cccc(C(F)(F)F)c3)CC2)CC[NH2+]1 ZINC000423377839 1038190547 /nfs/dbraw/zinc/19/05/47/1038190547.db2.gz KNWHUARWQYUTEW-VDEYCQILSA-N 2 0 340.433 4.462 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(Cl)ccc1OC ZINC000423385960 1038197848 /nfs/dbraw/zinc/19/78/48/1038197848.db2.gz LNOUCNWBJIEXLW-GOSISDBHSA-N 2 0 330.859 4.193 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[NH2+]C[C@@H]2C)CCC3)cc1 ZINC000423395840 1038202067 /nfs/dbraw/zinc/20/20/67/1038202067.db2.gz NPUYQDKSPQQPHQ-USXIJHARSA-N 2 0 341.524 4.084 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H]2CC[NH2+]C[C@@H]2C)CCC3)cc1 ZINC000423395832 1038202851 /nfs/dbraw/zinc/20/28/51/1038202851.db2.gz NPUYQDKSPQQPHQ-BHYGNILZSA-N 2 0 341.524 4.084 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)CC[NH2+]1 ZINC000423376767 1038206665 /nfs/dbraw/zinc/20/66/65/1038206665.db2.gz LDSICDYJOQAHAL-IOASZLSFSA-N 2 0 345.487 4.057 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]Cc2cccc3c2CCCN3)cc1 ZINC000423421613 1038208173 /nfs/dbraw/zinc/20/81/73/1038208173.db2.gz YDSKUUXWQSBTOE-INIZCTEOSA-N 2 0 346.478 4.390 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000423444689 1038225645 /nfs/dbraw/zinc/22/56/45/1038225645.db2.gz LXLOFJCCFZWHPP-GCJKJVERSA-N 2 0 349.522 4.045 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000423437797 1038235918 /nfs/dbraw/zinc/23/59/18/1038235918.db2.gz QRZLOXWQDVLBFW-KXBFYZLASA-N 2 0 331.891 4.126 20 0 EIADRP CSC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccc(C(F)(F)F)cc1 ZINC000423439063 1038237519 /nfs/dbraw/zinc/23/75/19/1038237519.db2.gz SDWSWXLTGWBAQJ-SWLSCSKDSA-N 2 0 334.451 4.217 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+][C@@H](C)CCC[NH3+])CCC3)cc1 ZINC000423458985 1038240205 /nfs/dbraw/zinc/24/02/05/1038240205.db2.gz QTVWHLBHAIEAKU-HOCLYGCPSA-N 2 0 329.513 4.213 20 0 EIADRP FCCC[C@@H]1CCC[C@H]1[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000423467458 1038245404 /nfs/dbraw/zinc/24/54/04/1038245404.db2.gz IYTMEFHQWWHVNF-RAUXBKROSA-N 2 0 336.470 4.027 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]CCC[C@@H]3CCC[NH2+]3)cs2)cs1 ZINC000423469572 1038245559 /nfs/dbraw/zinc/24/55/59/1038245559.db2.gz COSBYMXYXKBWDG-IUODEOHRSA-N 2 0 335.542 4.363 20 0 EIADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(SCC(F)F)cc1 ZINC000423476710 1038247726 /nfs/dbraw/zinc/24/77/26/1038247726.db2.gz JIYOVKAAPSTNOT-UKRRQHHQSA-N 2 0 328.472 4.227 20 0 EIADRP C[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cc(Cl)ccc1OC(F)F ZINC000423477596 1038249850 /nfs/dbraw/zinc/24/98/50/1038249850.db2.gz KCUWRRWMSVSQCY-DGCLKSJQSA-N 2 0 332.822 4.124 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423481774 1038251966 /nfs/dbraw/zinc/25/19/66/1038251966.db2.gz ONPLDJJYVWSHDG-QAPCUYQASA-N 2 0 343.540 4.225 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423486449 1038258951 /nfs/dbraw/zinc/25/89/51/1038258951.db2.gz STQODKMARJOLHZ-WMLDXEAASA-N 2 0 329.513 4.301 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000423523105 1038278262 /nfs/dbraw/zinc/27/82/62/1038278262.db2.gz VMTPESQOIQEGPW-LEWJYISDSA-N 2 0 338.495 4.487 20 0 EIADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccccc1OCc1ccccc1 ZINC000423559818 1038282844 /nfs/dbraw/zinc/28/28/44/1038282844.db2.gz PGYJOSROHSGCAK-SFHVURJKSA-N 2 0 336.479 4.226 20 0 EIADRP FC(F)(F)c1cccc([C@H]2CCC[C@H]2[NH2+]CCC2=CC[NH2+]CC2)c1 ZINC000423541622 1038289132 /nfs/dbraw/zinc/28/91/32/1038289132.db2.gz SLLZMWAEGCGANV-QZTJIDSGSA-N 2 0 338.417 4.241 20 0 EIADRP CC[N@@H+]1CC[C@H](CN[C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000490168566 1038366231 /nfs/dbraw/zinc/36/62/31/1038366231.db2.gz XJWDOVWJSQMGBJ-QRWLVFNGSA-N 2 0 346.877 4.500 20 0 EIADRP Fc1ccc(OCCCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000480764460 1038790867 /nfs/dbraw/zinc/79/08/67/1038790867.db2.gz XNNRODFJHOHMHA-UHFFFAOYSA-N 2 0 348.506 4.371 20 0 EIADRP c1ccc2c(c1)sc1c2CCC[C@@H]1[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000480758672 1038800268 /nfs/dbraw/zinc/80/02/68/1038800268.db2.gz NRWBESLRUYPHRP-KSSFIOAISA-N 2 0 326.509 4.353 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CCO[C@H](C(C)(C)C)C3)CC2)C1 ZINC000539064332 1038809218 /nfs/dbraw/zinc/80/92/18/1038809218.db2.gz AJXYNXNAEJYTCX-LMCOJAPRSA-N 2 0 336.564 4.213 20 0 EIADRP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000504893364 1038840209 /nfs/dbraw/zinc/84/02/09/1038840209.db2.gz DTTBYTDDZPZHRO-DYESRHJHSA-N 2 0 338.495 4.274 20 0 EIADRP CC(C[NH+](C)CCc1cccs1)C[N@H+](C)CCc1cccs1 ZINC000608576176 1038854762 /nfs/dbraw/zinc/85/47/62/1038854762.db2.gz IUMGNPCZYNACEG-UHFFFAOYSA-N 2 0 336.570 4.095 20 0 EIADRP CC[NH+](CC)[C@@H](CNC1CC[NH+](C2CCCCC2)CC1)c1ccco1 ZINC000119070470 1038863301 /nfs/dbraw/zinc/86/33/01/1038863301.db2.gz ABHKIWGADCWOOS-FQEVSTJZSA-N 2 0 347.547 4.049 20 0 EIADRP CC(C)[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cccc(C(F)(F)F)c1 ZINC000539162851 1038864703 /nfs/dbraw/zinc/86/47/03/1038864703.db2.gz MLXCARWRSAMKGX-KDOFPFPSSA-N 2 0 340.433 4.476 20 0 EIADRP CC(C)[C@H]([NH2+]CC1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000539204152 1038878574 /nfs/dbraw/zinc/87/85/74/1038878574.db2.gz QWSYLNQOHIBMSZ-KRWDZBQOSA-N 2 0 328.422 4.334 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCSCc1ccc(Cl)cc1Cl ZINC000539296781 1038946088 /nfs/dbraw/zinc/94/60/88/1038946088.db2.gz LCWGAQDDCUDUBA-WBMJQRKESA-N 2 0 347.355 4.156 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc3cc(OC)ccc3c2)C1 ZINC000481023383 1038959009 /nfs/dbraw/zinc/95/90/09/1038959009.db2.gz NDLRMRVNLVIEHW-SJORKVTESA-N 2 0 326.484 4.231 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(OC(F)F)c(Cl)c2)cc1 ZINC000414802845 1038967023 /nfs/dbraw/zinc/96/70/23/1038967023.db2.gz BWYDXRVSWRKLBI-NSHDSACASA-N 2 0 340.801 4.251 20 0 EIADRP C[NH+](C)C1CCC([N@@H+]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001168334886 1039057003 /nfs/dbraw/zinc/05/70/03/1039057003.db2.gz ZFNKEDJMTKGVEB-UHFFFAOYSA-N 2 0 327.299 4.224 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1ccccc1OC ZINC000120445488 1039108108 /nfs/dbraw/zinc/10/81/08/1039108108.db2.gz PRMWEUXDLVBEKK-KRWDZBQOSA-N 2 0 326.484 4.388 20 0 EIADRP C[C@@H]([NH2+]CCCCc1cccc(C(F)(F)F)c1)[C@H]1CCC[NH2+]C1 ZINC000414819314 1039153753 /nfs/dbraw/zinc/15/37/53/1039153753.db2.gz HEVOINRIHIJWBF-ZBFHGGJFSA-N 2 0 328.422 4.006 20 0 EIADRP C[C@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000120988308 1039262312 /nfs/dbraw/zinc/26/23/12/1039262312.db2.gz DNAMMQKMZUQZMJ-RNODOKPDSA-N 2 0 330.422 4.050 20 0 EIADRP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000120988457 1039263233 /nfs/dbraw/zinc/26/32/33/1039263233.db2.gz DNAMMQKMZUQZMJ-XCLFUZPHSA-N 2 0 330.422 4.050 20 0 EIADRP C[C@H]1Cc2ccc(F)cc2[C@H]1[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000120988602 1039264115 /nfs/dbraw/zinc/26/41/15/1039264115.db2.gz DNAMMQKMZUQZMJ-RBZFPXEDSA-N 2 0 330.422 4.050 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)c(C)c1OC ZINC000552225099 1039275386 /nfs/dbraw/zinc/27/53/86/1039275386.db2.gz AICKNZZEGWEGDU-FUHWJXTLSA-N 2 0 348.531 4.175 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](Cc2ccccc2)c2sccc2C)C1 ZINC000481314193 1039285437 /nfs/dbraw/zinc/28/54/37/1039285437.db2.gz BNPWDZBOPYSXCH-RTBURBONSA-N 2 0 328.525 4.272 20 0 EIADRP COc1ccccc1[C@@H](C)NC1CC[NH+](Cc2ccccc2C)CC1 ZINC000481333298 1039310345 /nfs/dbraw/zinc/31/03/45/1039310345.db2.gz RWSXOIRORFQTRH-GOSISDBHSA-N 2 0 338.495 4.319 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2ccc(Br)cc2Cl)CC1 ZINC000552247261 1039315673 /nfs/dbraw/zinc/31/56/73/1039315673.db2.gz IGAYVGPVYCMTNF-UHFFFAOYSA-N 2 0 345.712 4.065 20 0 EIADRP Cc1ccnc([C@H](C)[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000552277139 1039351822 /nfs/dbraw/zinc/35/18/22/1039351822.db2.gz PJUCXQMDZIZKDG-DYXWJJEUSA-N 2 0 337.511 4.341 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(N[C@@H]2CC[NH+](C)[C@@H]3CCC[C@H]32)cc1 ZINC000552276354 1039353223 /nfs/dbraw/zinc/35/32/23/1039353223.db2.gz UNCGNKJUYDYSCW-XYEHWOGUSA-N 2 0 341.543 4.346 20 0 EIADRP FC(F)(F)Oc1cccc(C[NH2+]CCCCC[NH+]2CCCCC2)c1 ZINC000500890653 1039356147 /nfs/dbraw/zinc/35/61/47/1039356147.db2.gz DYQSAHJLLOZDML-UHFFFAOYSA-N 2 0 344.421 4.331 20 0 EIADRP CC(C)COc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000481433270 1039423830 /nfs/dbraw/zinc/42/38/30/1039423830.db2.gz JNHIVPCXRFKVDQ-KRWDZBQOSA-N 2 0 330.516 4.389 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000121892480 1039526897 /nfs/dbraw/zinc/52/68/97/1039526897.db2.gz MIZZYFSLPUJHNR-JXFKEZNVSA-N 2 0 328.500 4.098 20 0 EIADRP Cc1cc(N2CC[NH+](C(c3ccccc3)c3ccccc3)CC2)cc[nH+]1 ZINC000478271006 1039599842 /nfs/dbraw/zinc/59/98/42/1039599842.db2.gz YCSHOBSHEOONBU-UHFFFAOYSA-N 2 0 343.474 4.302 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cccc(C)c1 ZINC000514105734 1039611398 /nfs/dbraw/zinc/61/13/98/1039611398.db2.gz SWTXMXKGQUFBIV-OAQYLSRUSA-N 2 0 326.484 4.176 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1C ZINC000122323368 1039637755 /nfs/dbraw/zinc/63/77/55/1039637755.db2.gz LPDAIRYUKFSSCT-GOSISDBHSA-N 2 0 326.484 4.095 20 0 EIADRP Cc1cc(C)cc([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)c1 ZINC000122274871 1039639343 /nfs/dbraw/zinc/63/93/43/1039639343.db2.gz AQDLFNYGPDZCAK-SFHVURJKSA-N 2 0 326.484 4.095 20 0 EIADRP COc1ccc2oc(C[NH2+]CCCC[N@@H+]3CCC[C@@H](C)C3)cc2c1 ZINC000478349066 1039688349 /nfs/dbraw/zinc/68/83/49/1039688349.db2.gz ZJGWGKJZWZZMMZ-MRXNPFEDSA-N 2 0 330.472 4.043 20 0 EIADRP COc1ccc2oc(C[NH2+]CCCC[N@@H+]3CCCC[C@@H]3C)cc2c1 ZINC000478346932 1039688538 /nfs/dbraw/zinc/68/85/38/1039688538.db2.gz UXWHIZCWJIJSPV-INIZCTEOSA-N 2 0 330.472 4.186 20 0 EIADRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccccc1OCc1ccccc1 ZINC000643534145 1039716273 /nfs/dbraw/zinc/71/62/73/1039716273.db2.gz MPXRXDIJCWIYPJ-UWJYYQICSA-N 2 0 336.479 4.058 20 0 EIADRP Clc1sc(Cl)c2c1CCC[C@H]2[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000643536946 1039748796 /nfs/dbraw/zinc/74/87/96/1039748796.db2.gz XLZAWOZYFUOROT-MNOVXSKESA-N 2 0 331.312 4.164 20 0 EIADRP CCc1ccc([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1 ZINC000481718388 1039774632 /nfs/dbraw/zinc/77/46/32/1039774632.db2.gz AEVPBSOSUSIAEV-KRWDZBQOSA-N 2 0 326.484 4.040 20 0 EIADRP CCCCOc1cc(C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)ccc1OC ZINC000061003181 1039780609 /nfs/dbraw/zinc/78/06/09/1039780609.db2.gz TWLQGALVCMHWIZ-UHFFFAOYSA-N 2 0 348.531 4.273 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(C)c(C)c2)[C@@H](C)C1 ZINC000481734914 1039800570 /nfs/dbraw/zinc/80/05/70/1039800570.db2.gz XPIFMUXVOPGPFB-ZVDOUQERSA-N 2 0 332.532 4.091 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCc2ccccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000505465509 1039804355 /nfs/dbraw/zinc/80/43/55/1039804355.db2.gz VRNJWMOSSZGMJE-BWAGFHJFSA-N 2 0 334.507 4.217 20 0 EIADRP COC[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1cccc(Cl)c1F ZINC000550881861 1039809903 /nfs/dbraw/zinc/80/99/03/1039809903.db2.gz DYJPDGUHWZODOV-KRWDZBQOSA-N 2 0 342.886 4.022 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H](c2cccnc2)C2CCC2)C1 ZINC000481922284 1039895702 /nfs/dbraw/zinc/89/57/02/1039895702.db2.gz XUYVXBVHIKKIPK-UEXGIBASSA-N 2 0 329.532 4.271 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CCCC[NH+](C)C ZINC000481975069 1039924277 /nfs/dbraw/zinc/92/42/77/1039924277.db2.gz QKJYVFCZUQCXFD-HNNXBMFYSA-N 2 0 331.529 4.035 20 0 EIADRP Cc1cc(C[NH+](C)C)cc(N[C@@H]2CC[N@H+](C)[C@@H](c3ccccc3)C2)c1 ZINC000551147670 1040006769 /nfs/dbraw/zinc/00/67/69/1040006769.db2.gz HNIDGWRGKPLORZ-IFMALSPDSA-N 2 0 337.511 4.304 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCCCC[NH+]2CCCC2)cc1 ZINC000551262646 1040120085 /nfs/dbraw/zinc/12/00/85/1040120085.db2.gz FMOHFPNCJJHTDJ-IOMROCGXSA-N 2 0 330.516 4.043 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccc(OC(F)F)cc1 ZINC000482328901 1040178021 /nfs/dbraw/zinc/17/80/21/1040178021.db2.gz IVLIDVYIAYJZSV-MAUKXSAKSA-N 2 0 340.458 4.449 20 0 EIADRP C[C@@H](NC[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000482441684 1040247974 /nfs/dbraw/zinc/24/79/74/1040247974.db2.gz VPIMHNQDQPTRNK-AEFFLSMTSA-N 2 0 344.449 4.180 20 0 EIADRP CCc1ccc([C@@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)s1 ZINC000482454130 1040265948 /nfs/dbraw/zinc/26/59/48/1040265948.db2.gz WNSXEGKEYIWYGR-MRXNPFEDSA-N 2 0 346.540 4.492 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)s1 ZINC000482462791 1040271350 /nfs/dbraw/zinc/27/13/50/1040271350.db2.gz XMIQLEIDEPGICQ-IEBWSBKVSA-N 2 0 328.525 4.272 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](CC)c2ccccc2OC(F)F)CC1 ZINC000482506928 1040305880 /nfs/dbraw/zinc/30/58/80/1040305880.db2.gz HSSXBLJKNNRVPI-QGZVFWFLSA-N 2 0 340.458 4.451 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C2CC(OC(C)(C)C)C2)CC1 ZINC000520877990 1040327927 /nfs/dbraw/zinc/32/79/27/1040327927.db2.gz HAYDIOHZJLVFAF-UHFFFAOYSA-N 2 0 344.543 4.177 20 0 EIADRP C[C@H](C[NH2+][C@H](C)c1ccc(C2CCCCC2)cc1)N1CC[NH+](C)CC1 ZINC000482555434 1040358211 /nfs/dbraw/zinc/35/82/11/1040358211.db2.gz RCJGLSDLDBBLEY-RTBURBONSA-N 2 0 343.559 4.021 20 0 EIADRP CC[C@H](C[N@@H+](Cc1scnc1C)C[C@@H]1CC[NH2+]C1)c1ccccc1 ZINC000435447648 1040394414 /nfs/dbraw/zinc/39/44/14/1040394414.db2.gz HVSMZVGYXGXIGI-QZTJIDSGSA-N 2 0 343.540 4.057 20 0 EIADRP C[C@@H]([NH2+]CCCc1ccccc1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000479528655 1040426527 /nfs/dbraw/zinc/42/65/27/1040426527.db2.gz JMBRLDXZDHQGEE-QGZVFWFLSA-N 2 0 344.474 4.050 20 0 EIADRP Cc1cc2[nH]c(C[NH2+]Cc3ccc(Cn4ccnc4)cc3)cc2c(C)c1 ZINC000479546743 1040450754 /nfs/dbraw/zinc/45/07/54/1040450754.db2.gz XLFHMSDHCGQJFK-UHFFFAOYSA-N 2 0 344.462 4.319 20 0 EIADRP CSc1ccc(CC[NH2+]C2CCN(Cc3ccccc3)CC2)cc1 ZINC000435734669 1040589570 /nfs/dbraw/zinc/58/95/70/1040589570.db2.gz GZVDEXOVJMRONT-UHFFFAOYSA-N 2 0 340.536 4.205 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)c1cccs1)c1cccc(OCC[NH+](C)C)c1 ZINC000483121814 1040700307 /nfs/dbraw/zinc/70/03/07/1040700307.db2.gz RCFUFRJNBLBPHV-INIZCTEOSA-N 2 0 346.540 4.317 20 0 EIADRP CN(Cc1ccccc1)[C@@H](C[NH2+]Cc1cccc2cc[nH]c21)C1CC1 ZINC000479878600 1040741556 /nfs/dbraw/zinc/74/15/56/1040741556.db2.gz CLFBMNZNCMBQHL-NRFANRHFSA-N 2 0 333.479 4.168 20 0 EIADRP C[C@H]([NH2+][C@@H]1CSc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000483177810 1040747096 /nfs/dbraw/zinc/74/70/96/1040747096.db2.gz QDATVOINPSXIJF-HNAYVOBHSA-N 2 0 342.508 4.125 20 0 EIADRP C[C@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1cccc(OC(F)F)c1 ZINC000483201214 1040759924 /nfs/dbraw/zinc/75/99/24/1040759924.db2.gz PKQSOPNNXDTTFM-XJKSGUPXSA-N 2 0 328.447 4.305 20 0 EIADRP COCC(C)(C)CCC[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000554088512 1040797505 /nfs/dbraw/zinc/79/75/05/1040797505.db2.gz LPSQSZLDHCFMFP-UHFFFAOYSA-N 2 0 346.559 4.472 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cc(Cl)cc(Cl)c2OC)C[C@@H]1C ZINC000539816806 1040808880 /nfs/dbraw/zinc/80/88/80/1040808880.db2.gz DIRFXEZYNUPJKL-SWLSCSKDSA-N 2 0 345.314 4.307 20 0 EIADRP COc1ccc2ccccc2c1C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000539819511 1040814415 /nfs/dbraw/zinc/81/44/15/1040814415.db2.gz FCOQCJCCNNMUAG-IBGZPJMESA-N 2 0 338.495 4.299 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC(N[C@H]2CCCc3c(O)cccc32)CC1 ZINC000483431997 1040856587 /nfs/dbraw/zinc/85/65/87/1040856587.db2.gz FWASCXAQGRWKJI-CZAAIQMYSA-N 2 0 342.527 4.402 20 0 EIADRP CC[NH+]1CCC(CC[NH2+]Cc2ccccc2OC2CCCC2)CC1 ZINC000462764069 1040899781 /nfs/dbraw/zinc/89/97/81/1040899781.db2.gz NEWYDKDVUYBYNC-UHFFFAOYSA-N 2 0 330.516 4.220 20 0 EIADRP COc1ccccc1[C@@H](C)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000537938692 1040902107 /nfs/dbraw/zinc/90/21/07/1040902107.db2.gz LHYBFXXATBWUON-LMDPOFIKSA-N 2 0 330.516 4.389 20 0 EIADRP CC[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)C1CCOCC1 ZINC000537940133 1040905431 /nfs/dbraw/zinc/90/54/31/1040905431.db2.gz VNUXUOXSFYICHU-DWLFOUALSA-N 2 0 344.543 4.082 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H]2CCCc3ccc(O)cc32)CC1 ZINC000462811462 1040961528 /nfs/dbraw/zinc/96/15/28/1040961528.db2.gz WRQMLKFSGCWHIH-NRFANRHFSA-N 2 0 330.516 4.117 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1ccc(Cl)s1 ZINC000537991006 1040969122 /nfs/dbraw/zinc/96/91/22/1040969122.db2.gz QBXCBWGKXUQIKK-CRAIPNDOSA-N 2 0 348.943 4.444 20 0 EIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+][C@H]2CC[C@H]2C2CC2)CC1 ZINC000554360893 1041035208 /nfs/dbraw/zinc/03/52/08/1041035208.db2.gz NOJUEJRABOUHFF-ICSRJNTNSA-N 2 0 332.919 4.330 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@@H](C[NH2+][C@H](c3ccccc3)C3CC3)C2)cc1 ZINC000538103100 1041059754 /nfs/dbraw/zinc/05/97/54/1041059754.db2.gz UCVDGXKNAXNMFA-NZQKXSOJSA-N 2 0 334.507 4.292 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)[C@@H](C)C1 ZINC000436317362 1041087290 /nfs/dbraw/zinc/08/72/90/1041087290.db2.gz UZEUBPKAFHZRKB-IKICRFKJSA-N 2 0 340.433 4.271 20 0 EIADRP C[C@@H]([NH2+][C@@H](c1cccs1)C1CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000480230091 1041106268 /nfs/dbraw/zinc/10/62/68/1041106268.db2.gz QXYJGIAMXHNENU-FOIQADDNSA-N 2 0 344.524 4.490 20 0 EIADRP Fc1cccc(CC2(C[NH2+]C3CC[NH+](CC4CC4)CC3)CCC2)c1 ZINC001168368548 1041112590 /nfs/dbraw/zinc/11/25/90/1041112590.db2.gz LFLINGJVKKQYGD-UHFFFAOYSA-N 2 0 330.491 4.003 20 0 EIADRP C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000480267479 1041139885 /nfs/dbraw/zinc/13/98/85/1041139885.db2.gz SCIHNVCCTQFTQF-VFNWGFHPSA-N 2 0 326.459 4.301 20 0 EIADRP C[C@@H]([NH2+][C@H](c1cccs1)C1CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000480274215 1041151039 /nfs/dbraw/zinc/15/10/39/1041151039.db2.gz MJNBBJHFPRIZTM-QRWLVFNGSA-N 2 0 344.524 4.490 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@@H]3C)cc2)cs1 ZINC000480272828 1041152600 /nfs/dbraw/zinc/15/26/00/1041152600.db2.gz DYRDXGVCGBITEV-QCUYGVNKSA-N 2 0 343.540 4.498 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000484305284 1041192866 /nfs/dbraw/zinc/19/28/66/1041192866.db2.gz VFIIDBSKJHHGPW-OCCSQVGLSA-N 2 0 333.303 4.001 20 0 EIADRP Cc1nccn1C[C@H](C)C[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000540170106 1041212246 /nfs/dbraw/zinc/21/22/46/1041212246.db2.gz YSABVYQJEXRRNP-VXGBXAGGSA-N 2 0 326.271 4.485 20 0 EIADRP CCC[C@@H](Cc1ccccc1)[NH2+]CC1(N2CCCCC2)CCOCC1 ZINC000540170075 1041212886 /nfs/dbraw/zinc/21/28/86/1041212886.db2.gz YPCJTHBRBQKVHN-NRFANRHFSA-N 2 0 344.543 4.023 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@@H+]2C)cc1 ZINC000538259734 1041219716 /nfs/dbraw/zinc/21/97/16/1041219716.db2.gz NEMQVUHNXZRIPY-XLIONFOSSA-N 2 0 338.495 4.497 20 0 EIADRP CSc1ccccc1[C@@H](C)[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000194855240 1041234197 /nfs/dbraw/zinc/23/41/97/1041234197.db2.gz LXKMWLKWPWOPQE-MRXNPFEDSA-N 2 0 344.524 4.200 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1cccc(O)c1 ZINC000194850331 1041236024 /nfs/dbraw/zinc/23/60/24/1041236024.db2.gz BECWMRSHCLBGMU-ROUUACIJSA-N 2 0 338.495 4.475 20 0 EIADRP C[C@H](NC1(C[NH2+][C@H]2CCC23CCOCC3)CCCC1)c1ccccc1 ZINC000554559547 1041245242 /nfs/dbraw/zinc/24/52/42/1041245242.db2.gz DFEYIPKKNDJOLT-ICSRJNTNSA-N 2 0 342.527 4.199 20 0 EIADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)C1 ZINC000484472554 1041246688 /nfs/dbraw/zinc/24/66/88/1041246688.db2.gz KVMMPHJPXGJDCA-CKEIUWERSA-N 2 0 342.405 4.035 20 0 EIADRP Cc1c(CC[NH3+])c2ccccc2n1C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167960793 1041248778 /nfs/dbraw/zinc/24/87/78/1041248778.db2.gz CYHZPYCWVVCAKB-DFNIBXOVSA-N 2 0 337.511 4.029 20 0 EIADRP c1ccc(C[C@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C2CC2)cc1 ZINC000484490418 1041262378 /nfs/dbraw/zinc/26/23/78/1041262378.db2.gz QEIATDOXEMDNHX-QFIPXVFZSA-N 2 0 326.528 4.394 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccc(Oc2ccc(F)cc2)cc1 ZINC000480445712 1041305517 /nfs/dbraw/zinc/30/55/17/1041305517.db2.gz OMUYKTOXCRVFEZ-YWZLYKJASA-N 2 0 328.431 4.048 20 0 EIADRP C[N@H+](C[C@@H]1C[C@H]1c1ccccc1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000463089037 1041325441 /nfs/dbraw/zinc/32/54/41/1041325441.db2.gz PGEYQDXHYOLBLN-PUHATCMVSA-N 2 0 334.507 4.244 20 0 EIADRP CC(C)COc1ccccc1C[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000516078760 1041379213 /nfs/dbraw/zinc/37/92/13/1041379213.db2.gz DEDKPVWAUYRKPI-UHFFFAOYSA-N 2 0 326.484 4.073 20 0 EIADRP C/C(=C/c1ccccc1OC(F)F)C[NH2+]CCC1CC[NH+](C)CC1 ZINC000516119841 1041408808 /nfs/dbraw/zinc/40/88/08/1041408808.db2.gz XJTWSMJDVBRXMH-SQFISAMPSA-N 2 0 338.442 4.013 20 0 EIADRP CC(C)[NH+](CCCN[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1)C(C)C ZINC000463208587 1041419954 /nfs/dbraw/zinc/41/99/54/1041419954.db2.gz XOVOXKNCPMLHOB-IRLDBZIGSA-N 3 0 345.575 4.138 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)c(OC)c1 ZINC000480608406 1041420243 /nfs/dbraw/zinc/42/02/43/1041420243.db2.gz KUTNPWBQVZABKY-SJORKVTESA-N 2 0 334.504 4.009 20 0 EIADRP CC(C)[NH+](CCCN[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC000463208588 1041420373 /nfs/dbraw/zinc/42/03/73/1041420373.db2.gz XOVOXKNCPMLHOB-RBBKRZOGSA-N 3 0 345.575 4.138 20 0 EIADRP COc1cc(C)c([C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1OC ZINC000480614637 1041425777 /nfs/dbraw/zinc/42/57/77/1041425777.db2.gz NRVBPIBIDIRDGM-SFHVURJKSA-N 2 0 348.531 4.175 20 0 EIADRP CC(C)C[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)CCO1 ZINC000538579549 1041430846 /nfs/dbraw/zinc/43/08/46/1041430846.db2.gz XACSQFSAXHDBFI-FYZZASKESA-N 2 0 336.564 4.213 20 0 EIADRP Cc1sc([C@@H](C)[NH2+]C2CC(C[NH3+])C2)nc1-c1ccc(Cl)cc1 ZINC000904363814 1041459436 /nfs/dbraw/zinc/45/94/36/1041459436.db2.gz NPSPENZESJVVHA-CKQAKLJMSA-N 2 0 335.904 4.160 20 0 EIADRP Fc1cc(C[NH2+][C@H]2CCCCC23CC[NH2+]CC3)ccc1C(F)F ZINC000904385111 1041465557 /nfs/dbraw/zinc/46/55/57/1041465557.db2.gz SMWZAUQEVSORNN-INIZCTEOSA-N 2 0 326.406 4.165 20 0 EIADRP C[C@H]([NH2+]C1(Cc2ccccc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000480692505 1041476167 /nfs/dbraw/zinc/47/61/67/1041476167.db2.gz ASDBOOZMTQCQNQ-UGKGYDQZSA-N 2 0 334.507 4.262 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Br)cc2C)C[C@H]1C ZINC000538718055 1041487679 /nfs/dbraw/zinc/48/76/79/1041487679.db2.gz RUEVPYXSJWBQJQ-PBHICJAKSA-N 2 0 339.321 4.062 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1ccncc1F ZINC000516322178 1041507227 /nfs/dbraw/zinc/50/72/27/1041507227.db2.gz PXULEEHFQUWLLE-KRWDZBQOSA-N 2 0 341.474 4.448 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc3c[nH]nc3c2)CC1 ZINC000538725055 1041516065 /nfs/dbraw/zinc/51/60/65/1041516065.db2.gz RMLQDPQPABXLPQ-QGZVFWFLSA-N 2 0 340.515 4.039 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(c3ccc(C(F)(F)F)cc3)CC2)[C@@H](C)C1 ZINC000437073876 1041624421 /nfs/dbraw/zinc/62/44/21/1041624421.db2.gz HOMIJMQEDIWFMD-YOEHRIQHSA-N 2 0 340.433 4.057 20 0 EIADRP Cc1cc(NCc2cccc(C[NH+]3CCCC3)c2)c2ccccc2[nH+]1 ZINC000506056072 1041814942 /nfs/dbraw/zinc/81/49/42/1041814942.db2.gz JVUVNHGXIBFOEV-UHFFFAOYSA-N 2 0 331.463 4.173 20 0 EIADRP CC[C@H](C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000402486992 1041819552 /nfs/dbraw/zinc/81/95/52/1041819552.db2.gz ASRVHNKRKAKRDR-SOLBZPMBSA-N 2 0 342.449 4.465 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+]CC(Cc2ccccc2)Cc2ccccc2)C1 ZINC000517001604 1041838796 /nfs/dbraw/zinc/83/87/96/1041838796.db2.gz LBFGLZJWBZSMSM-QFIPXVFZSA-N 2 0 336.523 4.019 20 0 EIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2C[C@H](c3ccccc3)C2(C)C)C[C@@H](C)O1 ZINC000464059666 1041844798 /nfs/dbraw/zinc/84/47/98/1041844798.db2.gz ZCTOVZJSENYSTE-VURPSTOHSA-N 2 0 344.543 4.048 20 0 EIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](CCCOCc3ccccc3)C2)CC1 ZINC000541591195 1042024757 /nfs/dbraw/zinc/02/47/57/1042024757.db2.gz RTBXGWILTLFDDW-QFIPXVFZSA-N 2 0 344.543 4.037 20 0 EIADRP C[C@H](C[NH2+][C@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1)C[NH+](C)C ZINC000425945564 1042045885 /nfs/dbraw/zinc/04/58/85/1042045885.db2.gz RHVBOGOIZNXPCT-UNEWFSDZSA-N 2 0 328.422 4.129 20 0 EIADRP C[C@]1(c2ccccc2)CC[C@H]([N@@H+]2CC[C@H]3[C@H](CCCN3C3CC3)C2)C1 ZINC000438119941 1042062722 /nfs/dbraw/zinc/06/27/22/1042062722.db2.gz LAFTUKSKZIACIF-PVSGBFIBSA-N 2 0 338.539 4.446 20 0 EIADRP CC[NH+](CC)C[C@H]1CC[N@H+](CCCOc2cccc3ccccc32)C1 ZINC000464776224 1042158855 /nfs/dbraw/zinc/15/88/55/1042158855.db2.gz KWPCDNSDTKQVGJ-LJQANCHMSA-N 2 0 340.511 4.272 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc3nc(C)sc3c2)CC1 ZINC000426051349 1042223404 /nfs/dbraw/zinc/22/34/04/1042223404.db2.gz SXISNXFNRJAKMO-UHFFFAOYSA-N 2 0 331.529 4.159 20 0 EIADRP C[NH+](C)CC1CCC([NH2+]Cc2cc3ccnc(Cl)c3s2)CC1 ZINC000894357730 1042235501 /nfs/dbraw/zinc/23/55/01/1042235501.db2.gz YAXNYTGRBVPOTM-UHFFFAOYSA-N 2 0 337.920 4.160 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2cnc(C3CC3)s2)CC1 ZINC000542176808 1042328623 /nfs/dbraw/zinc/32/86/23/1042328623.db2.gz DMQDENCUJKVVCX-UHFFFAOYSA-N 2 0 335.561 4.355 20 0 EIADRP CC(C)CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)C(C)(C)C ZINC000518249772 1042439641 /nfs/dbraw/zinc/43/96/41/1042439641.db2.gz BLYZNYMJCPNXQS-AABGKKOBSA-N 2 0 338.580 4.195 20 0 EIADRP CC(C)[NH+]1CCC([N@H+](C)CCOc2cccc(C(C)(C)C)c2)CC1 ZINC000506464748 1042467471 /nfs/dbraw/zinc/46/74/71/1042467471.db2.gz XXXILHYPLWRNIJ-UHFFFAOYSA-N 2 0 332.532 4.168 20 0 EIADRP c1csc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000518387705 1042501406 /nfs/dbraw/zinc/50/14/06/1042501406.db2.gz YFQRJPISSJCAQR-UHFFFAOYSA-N 2 0 326.509 4.236 20 0 EIADRP Clc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1Cl ZINC001167964386 1042599099 /nfs/dbraw/zinc/59/90/99/1042599099.db2.gz QHHSQXKAAMUXLS-MQVJKMGUSA-N 2 0 339.310 4.488 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)cc1 ZINC000415000260 1042676270 /nfs/dbraw/zinc/67/62/70/1042676270.db2.gz AOKSGEPSJSBNAV-MYGLTJDJSA-N 2 0 342.527 4.088 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(Cl)s1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309912990 1042824230 /nfs/dbraw/zinc/82/42/30/1042824230.db2.gz MWGOGHDMVJUKMZ-HOCLYGCPSA-N 2 0 334.916 4.402 20 0 EIADRP C[C@H]([NH2+]CCSc1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310170865 1042829962 /nfs/dbraw/zinc/82/99/62/1042829962.db2.gz UAUPBAFOHWMDDW-AZUAARDMSA-N 2 0 340.536 4.279 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccccc1Cl ZINC000177226687 1042831517 /nfs/dbraw/zinc/83/15/17/1042831517.db2.gz NKIXPCBPOMHYFL-OAHLLOKOSA-N 2 0 332.875 4.131 20 0 EIADRP COC[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000493882722 1042971023 /nfs/dbraw/zinc/97/10/23/1042971023.db2.gz JOXROKYMEUDERV-VQIMIIECSA-N 2 0 338.923 4.129 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)[C@@H](OC)c2ccccc2)c1 ZINC000493905181 1042974797 /nfs/dbraw/zinc/97/47/97/1042974797.db2.gz HBVMIRPPKPMYKF-DYESRHJHSA-N 2 0 326.484 4.004 20 0 EIADRP C[C@@H]1CC([NH2+]CCc2cccc(F)c2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168007483 1043018237 /nfs/dbraw/zinc/01/82/37/1043018237.db2.gz SHPMFKFOBGFGKX-QZTJIDSGSA-N 2 0 340.486 4.399 20 0 EIADRP Cc1nc2ccc(C[NH2+][C@H](C)[C@@H]3CCC[N@@H+](C4CCC4)C3)cc2s1 ZINC000494196802 1043032563 /nfs/dbraw/zinc/03/25/63/1043032563.db2.gz ZQWZDBXORQQKLX-RHSMWYFYSA-N 2 0 343.540 4.347 20 0 EIADRP C[C@H](C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1c(Cl)cccc1Cl ZINC000166447783 1043086058 /nfs/dbraw/zinc/08/60/58/1043086058.db2.gz WPZSKDNJVNHWPM-HZSPNIEDSA-N 2 0 327.299 4.313 20 0 EIADRP Cc1cncc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)c1 ZINC000184265870 1043087429 /nfs/dbraw/zinc/08/74/29/1043087429.db2.gz VRPUQTYFPZAWMN-IBGZPJMESA-N 2 0 337.511 4.473 20 0 EIADRP Fc1ccc(F)c2c1CC[C@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000507820524 1043105887 /nfs/dbraw/zinc/10/58/87/1043105887.db2.gz DFTLBAKETYDJQH-HXUWFJFHSA-N 2 0 342.433 4.338 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2cnc3ccccc3c2)C1 ZINC000727467009 1043226851 /nfs/dbraw/zinc/22/68/51/1043226851.db2.gz LOFLVANVEKGTRC-HDICACEKSA-N 2 0 325.500 4.083 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)C[C@@H]1C ZINC000674005779 1043269922 /nfs/dbraw/zinc/26/99/22/1043269922.db2.gz OKTPLRBLDJJRIR-MAUKXSAKSA-N 2 0 342.449 4.443 20 0 EIADRP c1ccc2ncc(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)cc2c1 ZINC000499577119 1043331691 /nfs/dbraw/zinc/33/16/91/1043331691.db2.gz UYTPQFWEOCGECP-UHFFFAOYSA-N 2 0 337.511 4.323 20 0 EIADRP CN(C)c1ccc(N2CCC([NH2+][C@@H]3CCCCC3(C)C)CC2)cc1 ZINC000766189628 1043398604 /nfs/dbraw/zinc/39/86/04/1043398604.db2.gz GLLPCIWJFIAJRZ-HXUWFJFHSA-N 2 0 329.532 4.280 20 0 EIADRP Cc1nc2ccc(C[NH2+]CCCC[NH+]3CCC(C)CC3)cc2s1 ZINC000494308469 1043414354 /nfs/dbraw/zinc/41/43/54/1043414354.db2.gz HJJMHXUEKQYKBB-UHFFFAOYSA-N 2 0 331.529 4.206 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2CCSc3c(F)cccc32)cc1 ZINC000171128899 1043451888 /nfs/dbraw/zinc/45/18/88/1043451888.db2.gz AOZASJUTIPUEDN-SFHVURJKSA-N 2 0 330.472 4.214 20 0 EIADRP FC(F)(F)CCC(CCC(F)(F)F)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000665272365 1043502394 /nfs/dbraw/zinc/50/23/94/1043502394.db2.gz DBIPDLSYBMAIKH-NTZNESFSSA-N 2 0 346.359 4.018 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccnn1-c1ccccc1 ZINC000467363857 1043577594 /nfs/dbraw/zinc/57/75/94/1043577594.db2.gz GPKABMQGQNLWIT-IBGZPJMESA-N 2 0 340.515 4.179 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccnn1-c1ccccc1 ZINC000467363819 1043579628 /nfs/dbraw/zinc/57/96/28/1043579628.db2.gz GBQFDCAWLNURDZ-RBUKOAKNSA-N 2 0 340.515 4.035 20 0 EIADRP Cc1nccn1CCCC[N@@H+](C)Cc1cc(Cl)cc(Cl)c1 ZINC000442393790 1043670330 /nfs/dbraw/zinc/67/03/30/1043670330.db2.gz IRSVEDDKRDHAJA-UHFFFAOYSA-N 2 0 326.271 4.411 20 0 EIADRP CC(C)O[C@H](C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000428251060 1043694093 /nfs/dbraw/zinc/69/40/93/1043694093.db2.gz YALIBPCCQYJKHA-NHCUHLMSSA-N 2 0 330.516 4.103 20 0 EIADRP C[C@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccccn1 ZINC000658065420 1043723528 /nfs/dbraw/zinc/72/35/28/1043723528.db2.gz BIWYQXROUGCDMJ-KMFTYDHNSA-N 2 0 337.511 4.218 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCCC[C@H]3[C@H]3CCOC3)CC2)CC1 ZINC000474034483 1043731476 /nfs/dbraw/zinc/73/14/76/1043731476.db2.gz SBUVJMHGKWJCIT-RGCMJDONSA-N 2 0 348.575 4.214 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH+]2CCC(c3ccsc3)CC2)cc1 ZINC000681630413 1043760567 /nfs/dbraw/zinc/76/05/67/1043760567.db2.gz UZVVHMVEPYBJOW-UHFFFAOYSA-N 2 0 344.524 4.068 20 0 EIADRP C[C@H](CC[NH2+][C@@H](C)c1cccc(OC(F)F)c1)[NH+]1CCCCC1 ZINC000542487809 1043767592 /nfs/dbraw/zinc/76/75/92/1043767592.db2.gz APFSYCUZGDLQKI-CABCVRRESA-N 2 0 326.431 4.203 20 0 EIADRP COCCC[C@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000442643868 1043790821 /nfs/dbraw/zinc/79/08/21/1043790821.db2.gz GUQVXWVGZAZQDG-FQEVSTJZSA-N 2 0 336.495 4.005 20 0 EIADRP CC(C)[C@@H]([NH2+]CC[C@@H](C)[NH+]1CCCCC1)c1ccc2[nH]c(=O)oc2c1 ZINC000542487822 1043798428 /nfs/dbraw/zinc/79/84/28/1043798428.db2.gz HPTICCGNSLVHSQ-DNVCBOLYSA-N 2 0 345.487 4.085 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H]1CCSc2ccc(OC)cc21 ZINC000191483867 1043818684 /nfs/dbraw/zinc/81/86/84/1043818684.db2.gz ARLGZFZMFBABBY-CRAIPNDOSA-N 2 0 336.545 4.332 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)CCS2 ZINC000191488709 1043820412 /nfs/dbraw/zinc/82/04/12/1043820412.db2.gz WPDAWSOFVYQZCZ-MRXNPFEDSA-N 2 0 334.529 4.131 20 0 EIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000494592883 1043836082 /nfs/dbraw/zinc/83/60/82/1043836082.db2.gz VGOIGLAGBKSVCT-QBKZBJQZSA-N 2 0 344.543 4.395 20 0 EIADRP FC(F)C1CCC([NH2+]CC2CC[NH+](Cc3cccs3)CC2)CC1 ZINC000442795446 1043844019 /nfs/dbraw/zinc/84/40/19/1043844019.db2.gz RKZIXAXXLKOZNB-UHFFFAOYSA-N 2 0 342.499 4.374 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2ccc(COC)cc2)CC1 ZINC000543105161 1043849405 /nfs/dbraw/zinc/84/94/05/1043849405.db2.gz LFWVTQYBJIZGDF-UHFFFAOYSA-N 2 0 332.532 4.167 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2ccc3[nH]ccc3c2)CC1 ZINC000442811728 1043852827 /nfs/dbraw/zinc/85/28/27/1043852827.db2.gz PHIGMUBRCVUVIN-VGSWGCGISA-N 2 0 339.527 4.343 20 0 EIADRP c1ccc(SC2(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CCCC2)cc1 ZINC000166560167 1044036171 /nfs/dbraw/zinc/03/61/71/1044036171.db2.gz LSAGWGNZEOWXAD-QZTJIDSGSA-N 2 0 330.541 4.308 20 0 EIADRP CS[C@@H](C[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1)C(C)(C)C ZINC000542497584 1044146412 /nfs/dbraw/zinc/14/64/12/1044146412.db2.gz ABGZKNPAUDAPOY-QAPCUYQASA-N 2 0 338.561 4.055 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000186518134 1044163391 /nfs/dbraw/zinc/16/33/91/1044163391.db2.gz IGAVCYDGDUFXDE-QLFBSQMISA-N 2 0 336.907 4.349 20 0 EIADRP C[C@H]([NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1)c1ccc(O)cc1 ZINC001168017933 1044317958 /nfs/dbraw/zinc/31/79/58/1044317958.db2.gz YDQIVCCCRXXXNK-KURKYZTESA-N 2 0 338.495 4.484 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000474065802 1044341576 /nfs/dbraw/zinc/34/15/76/1044341576.db2.gz HBEQVLFMTPOMNV-IBGZPJMESA-N 2 0 330.516 4.270 20 0 EIADRP C[C@H]([NH2+][C@H](c1cccs1)c1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC000675732682 1044449961 /nfs/dbraw/zinc/44/99/61/1044449961.db2.gz DJANSWWUFZUNJK-LIRRHRJNSA-N 2 0 332.488 4.297 20 0 EIADRP C[C@H](C[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)Cc1ccccc1 ZINC000542518626 1044451601 /nfs/dbraw/zinc/45/16/01/1044451601.db2.gz YAQCJYSMFXEDPK-NZQKXSOJSA-N 2 0 336.523 4.019 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+][C@@H](C)C2CC[NH+](C)CC2)cc1OC ZINC000675777142 1044490652 /nfs/dbraw/zinc/49/06/52/1044490652.db2.gz MEDLMWGLMUVRAL-DLBZAZTESA-N 2 0 348.531 4.255 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000675819357 1044517106 /nfs/dbraw/zinc/51/71/06/1044517106.db2.gz ZOPQRUIOGQSYLH-INIZCTEOSA-N 2 0 327.299 4.302 20 0 EIADRP COc1ccc(C2CCC([NH2+]C3CC[NH+](C4CCC4)CC3)CC2)cc1 ZINC000543398715 1044520660 /nfs/dbraw/zinc/52/06/60/1044520660.db2.gz YFWKRXCJDWSUHM-UHFFFAOYSA-N 2 0 342.527 4.328 20 0 EIADRP C[NH+](C)CC1(C[NH2+][C@H](C[C@H]2CCOC2)c2ccc(F)cc2)CCCC1 ZINC000494943710 1044528907 /nfs/dbraw/zinc/52/89/07/1044528907.db2.gz ZDOMUQYNKXAKRG-YLJYHZDGSA-N 2 0 348.506 4.005 20 0 EIADRP CC(C)(C[NH2+][C@H](C[C@@H]1CCOC1)c1ccc(F)cc1)C[NH+]1CCCC1 ZINC000494937809 1044534032 /nfs/dbraw/zinc/53/40/32/1044534032.db2.gz GBNQSQVRKSUPFS-FXAWDEMLSA-N 2 0 348.506 4.005 20 0 EIADRP C[C@@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1ccc(OC(F)F)cc1 ZINC000543417864 1044559787 /nfs/dbraw/zinc/55/97/87/1044559787.db2.gz FZHYGVRDAUYLEX-LSDHHAIUSA-N 2 0 326.431 4.203 20 0 EIADRP C[C@@H]1C[C@@H](N2CC[C@@H]([NH3+])c3ccccc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168023150 1044561691 /nfs/dbraw/zinc/56/16/91/1044561691.db2.gz VMYSCORWSVEKNN-BAYUQKDNSA-N 2 0 349.522 4.338 20 0 EIADRP Cc1ccccc1[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H]1CO)C1CCCC1 ZINC000495081002 1044650312 /nfs/dbraw/zinc/65/03/12/1044650312.db2.gz FLTKWKNGFHJEMQ-IRLDBZIGSA-N 2 0 344.543 4.053 20 0 EIADRP C[N@H+](CCCCc1cccc(C(F)(F)F)c1)C[C@@H]1CCC[NH+](C)C1 ZINC000474152100 1044699590 /nfs/dbraw/zinc/69/95/90/1044699590.db2.gz GSYWQTNZGLYWGS-KRWDZBQOSA-N 2 0 342.449 4.302 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1cccc(N)c1 ZINC001168026960 1044724728 /nfs/dbraw/zinc/72/47/28/1044724728.db2.gz MPVSXSRFJAWQRC-SUWCGCSTSA-N 2 0 337.511 4.361 20 0 EIADRP C[C@@H]([NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1)c1ccc(N)cc1 ZINC001168028534 1044744359 /nfs/dbraw/zinc/74/43/59/1044744359.db2.gz PGIKSLUUXRPRBE-KZNAEPCWSA-N 2 0 337.511 4.361 20 0 EIADRP CC1(C[NH2+][C@H]2CCN(C3CC3)[C@@H](c3ccccc3)C2)CC(F)(F)C1 ZINC000895532367 1044800304 /nfs/dbraw/zinc/80/03/04/1044800304.db2.gz OAUAXHSXRHJXKP-FUHWJXTLSA-N 2 0 334.454 4.380 20 0 EIADRP CC(C)[C@@H](C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)c1ccccc1 ZINC000474260907 1044823568 /nfs/dbraw/zinc/82/35/68/1044823568.db2.gz WSSFXGNHLCCGCD-JOCHJYFZSA-N 2 0 344.543 4.003 20 0 EIADRP FC(F)(F)c1ccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000676712967 1044827149 /nfs/dbraw/zinc/82/71/49/1044827149.db2.gz VLCNDTOISKYXAR-QAPCUYQASA-N 2 0 338.417 4.154 20 0 EIADRP CCn1c2ccccc2c2cc(C[NH2+]C[C@@H]3CC[N@H+](CC)C3)ccc21 ZINC000327321135 1044833433 /nfs/dbraw/zinc/83/34/33/1044833433.db2.gz ZXNQIDJRHWMTOA-SFHVURJKSA-N 2 0 335.495 4.246 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+]C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000673600441 1044854633 /nfs/dbraw/zinc/85/46/33/1044854633.db2.gz XCQRJQGARZZKLI-MBSJSRAVSA-N 2 0 326.406 4.040 20 0 EIADRP CCCn1ccnc1CCC[N@H+](C)[C@@H]1CCc2c1cccc2Cl ZINC000429259872 1044856939 /nfs/dbraw/zinc/85/69/39/1044856939.db2.gz LHFTYKPDKOOFAF-GOSISDBHSA-N 2 0 331.891 4.498 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](CCCOC)c2ccc(F)cc2)CC1 ZINC000282365459 1044859969 /nfs/dbraw/zinc/85/99/69/1044859969.db2.gz PYUWIACXUOBKFK-FQEVSTJZSA-N 2 0 336.495 4.005 20 0 EIADRP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000673600221 1044861279 /nfs/dbraw/zinc/86/12/79/1044861279.db2.gz WPAXHEQWJOTUKX-NIAZTZROSA-N 2 0 338.417 4.325 20 0 EIADRP Fc1ccccc1C[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccccc1 ZINC000191693416 1044908338 /nfs/dbraw/zinc/90/83/38/1044908338.db2.gz QZVQIMHCSYXDAF-VGSWGCGISA-N 2 0 338.470 4.183 20 0 EIADRP Clc1cccc2c1C[C@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001168735396 1044974116 /nfs/dbraw/zinc/97/41/16/1044974116.db2.gz SDIDRTWYDFKIIE-ZWKOTPCHSA-N 2 0 332.919 4.148 20 0 EIADRP C[C@@H]1C[C@@H](Nc2cccc(CC[NH3+])c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168035140 1044996173 /nfs/dbraw/zinc/99/61/73/1044996173.db2.gz ROVCTACJCIWTPX-OPMZPASUSA-N 2 0 337.511 4.041 20 0 EIADRP CC(C)=CCC[C@H](C)[NH2+]C[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC000429431042 1045131831 /nfs/dbraw/zinc/13/18/31/1045131831.db2.gz MLPQBICDFGCODU-PZJWPPBQSA-N 2 0 330.516 4.002 20 0 EIADRP Cc1nc([C@H](C)[N@@H+]2CC[C@@H](C[NH3+])[C@H](C)C2)oc1-c1ccc(Cl)cc1 ZINC000923494882 1045135432 /nfs/dbraw/zinc/13/54/32/1045135432.db2.gz PYRMSXMOXSPFOQ-INWMFGNUSA-N 2 0 347.890 4.281 20 0 EIADRP C[C@@H]([NH2+]CCCN1CCc2ccccc2C1)c1ccc(F)c(F)c1 ZINC000495503688 1045163572 /nfs/dbraw/zinc/16/35/72/1045163572.db2.gz PCVLVUGBUOYOPL-OAHLLOKOSA-N 2 0 330.422 4.064 20 0 EIADRP Clc1ccc2c(c1Cl)CC[C@@H]2[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000161655534 1045308250 /nfs/dbraw/zinc/30/82/50/1045308250.db2.gz XJMPTKVKZHEKCW-HSMVNMDESA-N 2 0 325.283 4.197 20 0 EIADRP COC[C@@H](C)[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000237166572 1045376699 /nfs/dbraw/zinc/37/66/99/1045376699.db2.gz OKFKYIASJAAMFX-GOSISDBHSA-N 2 0 338.495 4.074 20 0 EIADRP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000768100576 1045713157 /nfs/dbraw/zinc/71/31/57/1045713157.db2.gz CQQNULXZPIXBIP-KBPBESRZSA-N 2 0 328.422 4.129 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1ccc2c(c1)CCCO2 ZINC000768101100 1045713391 /nfs/dbraw/zinc/71/33/91/1045713391.db2.gz HISCZRPDWNOOSY-XLIONFOSSA-N 2 0 330.516 4.173 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC000397993100 1045820771 /nfs/dbraw/zinc/82/07/71/1045820771.db2.gz RANXRNJAFJXBEF-NZSAHSFTSA-N 2 0 336.470 4.312 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000248404234 1045873012 /nfs/dbraw/zinc/87/30/12/1045873012.db2.gz PTMGXDSAXWRJOK-BQFCYCMXSA-N 2 0 346.515 4.007 20 0 EIADRP CC(C)c1ccc(C2(O)CCC([NH2+]CCC[N@@H+](C)C(C)C)CC2)cc1 ZINC000769006307 1045876433 /nfs/dbraw/zinc/87/64/33/1045876433.db2.gz YZUPHPOSJUCUAB-UHFFFAOYSA-N 2 0 346.559 4.260 20 0 EIADRP CSCCCCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000248882156 1045887828 /nfs/dbraw/zinc/88/78/28/1045887828.db2.gz LBHNXXXENYLRCJ-OWZKRDHZSA-N 2 0 332.557 4.305 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(Br)cc2)CC1 ZINC000037150099 1046013505 /nfs/dbraw/zinc/01/35/05/1046013505.db2.gz OTAGMMKMWMZPQG-AWEZNQCLSA-N 2 0 339.321 4.364 20 0 EIADRP CCc1noc(C)c1[C@H](C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000769872211 1046099123 /nfs/dbraw/zinc/09/91/23/1046099123.db2.gz HUEUCNXDTDSIKV-AWEZNQCLSA-N 2 0 347.528 4.170 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2ncc(-c3ccccc3)s2)CC1 ZINC000123448681 1046122738 /nfs/dbraw/zinc/12/27/38/1046122738.db2.gz PVJIWBJQYYVMHW-UHFFFAOYSA-N 2 0 343.540 4.364 20 0 EIADRP Clc1ccc2sc(C3CC[NH+](C[C@@H]4CCC[NH2+]C4)CC3)nc2c1 ZINC000262044220 1046175216 /nfs/dbraw/zinc/17/52/16/1046175216.db2.gz YSQREHBUZRROPS-CYBMUJFWSA-N 2 0 349.931 4.129 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(OC)cc2F)c1 ZINC000123901759 1046204202 /nfs/dbraw/zinc/20/42/02/1046204202.db2.gz HZKKXXDFZBQNAB-HNNXBMFYSA-N 2 0 330.447 4.137 20 0 EIADRP C[N@@H+](Cc1ccc2ncccc2c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000124678102 1046255430 /nfs/dbraw/zinc/25/54/30/1046255430.db2.gz CSUZSAMLOCKYFV-OAQYLSRUSA-N 2 0 345.490 4.189 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)Cc1cccs1 ZINC000508692940 1046323197 /nfs/dbraw/zinc/32/31/97/1046323197.db2.gz XMTQOQCIZQMNIP-BJLQDIEVSA-N 2 0 342.552 4.427 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c(C)s1 ZINC000162539883 1046330000 /nfs/dbraw/zinc/33/00/00/1046330000.db2.gz AGGDAGUGXZAFAX-OAHLLOKOSA-N 2 0 332.513 4.156 20 0 EIADRP c1cc(-c2ccccc2)sc1C[N@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000536658922 1046624470 /nfs/dbraw/zinc/62/44/70/1046624470.db2.gz UUPHRPZXIRCPNO-QGZVFWFLSA-N 2 0 326.509 4.333 20 0 EIADRP COc1ccc(C[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c2ccccc12 ZINC000536662396 1046630444 /nfs/dbraw/zinc/63/04/44/1046630444.db2.gz TUYOTWUFMNFILT-IBGZPJMESA-N 2 0 338.495 4.299 20 0 EIADRP C[C@@H]1C[C@H](NCc2ccc(F)cc2F)CC[N@@H+]1Cc1ccccc1 ZINC000379622200 1046713989 /nfs/dbraw/zinc/71/39/89/1046713989.db2.gz GEOHMLPKQHEPCZ-DNVCBOLYSA-N 2 0 330.422 4.108 20 0 EIADRP CCN(Cc1ccccc1OC)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000536708738 1046718886 /nfs/dbraw/zinc/71/88/86/1046718886.db2.gz QCKXTNJWAOWEHU-FQEVSTJZSA-N 2 0 338.495 4.039 20 0 EIADRP Cn1cncc1CC[NH+]1CCC(c2cccc(Cl)c2Cl)CC1 ZINC000459496863 1046723477 /nfs/dbraw/zinc/72/34/77/1046723477.db2.gz HRYXJBHELWFCIZ-UHFFFAOYSA-N 2 0 338.282 4.149 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cc1 ZINC000536833053 1046809345 /nfs/dbraw/zinc/80/93/45/1046809345.db2.gz MFSKYBUCJVGBQM-QHGAOEGBSA-N 2 0 330.516 4.389 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCc4cc(F)ccc43)CC2)CC1 ZINC000536833665 1046810203 /nfs/dbraw/zinc/81/02/03/1046810203.db2.gz ODPZQWFTQQGBQK-GRERDSQWSA-N 2 0 330.491 4.446 20 0 EIADRP C[C@H]([NH2+]Cc1cnc2ccccc2c1)c1cccc(OCC[NH+](C)C)c1 ZINC000536859135 1046826860 /nfs/dbraw/zinc/82/68/60/1046826860.db2.gz RTUGVHXGOQDZBI-KRWDZBQOSA-N 2 0 349.478 4.026 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(F)c(Cl)c1 ZINC000536860577 1046828413 /nfs/dbraw/zinc/82/84/13/1046828413.db2.gz YXDMWRCWYDDBLW-QLFBSQMISA-N 2 0 342.886 4.019 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000459663727 1046846474 /nfs/dbraw/zinc/84/64/74/1046846474.db2.gz YDBJRSGPOONVIF-KGLIPLIRSA-N 2 0 336.464 4.226 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC000459728936 1046865123 /nfs/dbraw/zinc/86/51/23/1046865123.db2.gz CWEUNKCBHXIVIJ-OWCLPIDISA-N 2 0 331.529 4.110 20 0 EIADRP C[C@@H](C[NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000459725137 1046865462 /nfs/dbraw/zinc/86/54/62/1046865462.db2.gz BATFYJPYBJRHIE-LSDHHAIUSA-N 2 0 328.422 4.130 20 0 EIADRP CC(C)[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccc2[nH]c(=O)oc2c1 ZINC000536961942 1046870130 /nfs/dbraw/zinc/87/01/30/1046870130.db2.gz VMVPKWCRSKGGDB-HNAYVOBHSA-N 2 0 345.487 4.085 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000536999915 1046891225 /nfs/dbraw/zinc/89/12/25/1046891225.db2.gz FZTJSTWUJDVXQW-DYVFJYSZSA-N 2 0 326.406 4.088 20 0 EIADRP Cc1cccc(O[C@@H]2CCCC[C@@H]2[NH2+]C2CC[NH+](CC3CC3)CC2)c1 ZINC000537095017 1046941974 /nfs/dbraw/zinc/94/19/74/1046941974.db2.gz GRGOZWXPHOGJSD-FCHUYYIVSA-N 2 0 342.527 4.149 20 0 EIADRP Clc1ccc2c(n1)CC[C@@H]2[NH2+]CCCCCCC[NH+]1CCCC1 ZINC000806138067 1047136377 /nfs/dbraw/zinc/13/63/77/1047136377.db2.gz QTVUOGFSYJAMOH-KRWDZBQOSA-N 2 0 335.923 4.358 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCc3ccc(Cl)nc32)c1 ZINC000788542059 1047219542 /nfs/dbraw/zinc/21/95/42/1047219542.db2.gz JJTBIKFPABUKPI-SFHVURJKSA-N 2 0 343.902 4.354 20 0 EIADRP Cc1ccc(C[N@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC001204033450 1047226082 /nfs/dbraw/zinc/22/60/82/1047226082.db2.gz AHVUPUKTBOPOID-UHFFFAOYSA-N 2 0 328.525 4.401 20 0 EIADRP COc1ccc(C[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)c2ccccc12 ZINC000325425005 1047238860 /nfs/dbraw/zinc/23/88/60/1047238860.db2.gz XKJZUNXCWRALHW-KRWDZBQOSA-N 2 0 326.484 4.203 20 0 EIADRP C[C@H]1CC[C@H]([NH+]2CCC([NH3+])(Cc3cccc(C(F)(F)F)c3)CC2)C1 ZINC001170121914 1047486132 /nfs/dbraw/zinc/48/61/32/1047486132.db2.gz ORXZUXAISJCOQH-YOEHRIQHSA-N 2 0 340.433 4.230 20 0 EIADRP C[C@@H]1CC[C@@H]([NH+]2CCC([NH3+])(Cc3cccc(C(F)(F)F)c3)CC2)C1 ZINC001170121906 1047486786 /nfs/dbraw/zinc/48/67/86/1047486786.db2.gz ORXZUXAISJCOQH-RHSMWYFYSA-N 2 0 340.433 4.230 20 0 EIADRP C[C@@H]([NH2+]Cc1coc2ccccc12)c1cccc(OCC[NH+](C)C)c1 ZINC000556216783 1047566951 /nfs/dbraw/zinc/56/69/51/1047566951.db2.gz JOFRDUAQGIUGSD-MRXNPFEDSA-N 2 0 338.451 4.224 20 0 EIADRP CCC[C@H](CC)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556231275 1047596215 /nfs/dbraw/zinc/59/62/15/1047596215.db2.gz UNPJRFAEUQDCEA-SFTDATJTSA-N 2 0 344.543 4.084 20 0 EIADRP CCC[C@@H](CC)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556231268 1047597109 /nfs/dbraw/zinc/59/71/09/1047597109.db2.gz UNPJRFAEUQDCEA-NHCUHLMSSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1ccncc1F ZINC000556235737 1047600649 /nfs/dbraw/zinc/60/06/49/1047600649.db2.gz GTDFTCVXINKQGG-IAGOWNOFSA-N 2 0 341.474 4.446 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2cn3ccccc3n2)c1 ZINC000556236933 1047602307 /nfs/dbraw/zinc/60/23/07/1047602307.db2.gz XIVCXAIMIDBHSC-QGZVFWFLSA-N 2 0 336.483 4.027 20 0 EIADRP C[NH+](C)C1CCC([NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)CC1 ZINC001168299640 1047708575 /nfs/dbraw/zinc/70/85/75/1047708575.db2.gz MFDIESZQYHPAFX-UHFFFAOYSA-N 2 0 326.406 4.157 20 0 EIADRP C[NH+](C)C1CCC(NC(=[NH2+])c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC001168305314 1047764711 /nfs/dbraw/zinc/76/47/11/1047764711.db2.gz IAUMKSUCKRQHNA-UHFFFAOYSA-N 2 0 347.812 4.147 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc(C2CC2)c1 ZINC000550629444 1047782757 /nfs/dbraw/zinc/78/27/57/1047782757.db2.gz QVJGVMBURCECDX-FGTMMUONSA-N 2 0 330.516 4.104 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC000556590141 1047830714 /nfs/dbraw/zinc/83/07/14/1047830714.db2.gz ZKKRJTXVAMAWNZ-QGZVFWFLSA-N 2 0 330.516 4.391 20 0 EIADRP C[NH+](C)CCCCC[NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171063090 1047908715 /nfs/dbraw/zinc/90/87/15/1047908715.db2.gz LLDIURHFIXHVPV-OAHLLOKOSA-N 2 0 329.315 4.172 20 0 EIADRP CC(C)(CC[NH3+])[NH2+]C1CCC(c2ccc(Br)cc2)CC1 ZINC001246362439 1047976867 /nfs/dbraw/zinc/97/68/67/1047976867.db2.gz LJRCHDROIHUDTQ-UHFFFAOYSA-N 2 0 339.321 4.192 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000556857799 1048069143 /nfs/dbraw/zinc/06/91/43/1048069143.db2.gz HMYRKBIAFRQBKG-CXAGYDPISA-N 2 0 342.405 4.110 20 0 EIADRP Cc1cncc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c1 ZINC000556884241 1048100715 /nfs/dbraw/zinc/10/07/15/1048100715.db2.gz HNESLWXSUKDJBL-RJGXRXQPSA-N 2 0 349.522 4.170 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CCc2nc(C3CCCCC3)cs2)[C@@H]2CCC[C@H]21 ZINC000556886246 1048107611 /nfs/dbraw/zinc/10/76/11/1048107611.db2.gz KDZMNKMJCSMBSV-JENIJYKNSA-N 2 0 347.572 4.196 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@@H]21)c1ccc(C(F)(F)F)cc1 ZINC000556890738 1048131056 /nfs/dbraw/zinc/13/10/56/1048131056.db2.gz RQUCCLGEJLYEIC-BNEJOLLZSA-N 2 0 340.433 4.271 20 0 EIADRP C[NH+](C)Cc1ccc(CC[NH2+][C@@H]2CCc3cc(Cl)ccc3C2)cc1 ZINC001171103228 1048183651 /nfs/dbraw/zinc/18/36/51/1048183651.db2.gz ZLVCOZKYYGUGDH-OAQYLSRUSA-N 2 0 342.914 4.091 20 0 EIADRP Cc1nc(C[N@@H+](C)C2CCC([NH3+])CC2)oc1-c1ccc(Cl)cc1 ZINC000844221408 1048225070 /nfs/dbraw/zinc/22/50/70/1048225070.db2.gz YZNLMAMOIKBUGL-UHFFFAOYSA-N 2 0 333.863 4.005 20 0 EIADRP Cc1ccc(C[NH+]2CC[C@@H](C[N@H+](C)CCc3cccs3)C2)s1 ZINC000844325993 1048295256 /nfs/dbraw/zinc/29/52/56/1048295256.db2.gz FQWNLGRSSQBMTP-INIZCTEOSA-N 2 0 334.554 4.114 20 0 EIADRP C[NH+]1CCC2(CC[N@H+](Cc3cc(Cl)cc(C(F)(F)F)c3)C2)CC1 ZINC001143990734 1048349985 /nfs/dbraw/zinc/34/99/85/1048349985.db2.gz IFQCNBUAXWJMIR-UHFFFAOYSA-N 2 0 346.824 4.277 20 0 EIADRP Cc1cc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)ccc1F ZINC000499153142 1048360612 /nfs/dbraw/zinc/36/06/12/1048360612.db2.gz RATKQDBEPBMDCM-WKCHPHFGSA-N 2 0 338.470 4.419 20 0 EIADRP CCCC[NH+]1CCC([N@H+](C)[C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171133531 1048395373 /nfs/dbraw/zinc/39/53/73/1048395373.db2.gz MMMLHPBAUVPUOV-FQEVSTJZSA-N 2 0 334.935 4.394 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171139305 1048419523 /nfs/dbraw/zinc/41/95/23/1048419523.db2.gz LBIXFWQMGNWATP-INIZCTEOSA-N 2 0 341.326 4.313 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccc(C(F)(F)F)s2)cc1 ZINC000809738738 1048509526 /nfs/dbraw/zinc/50/95/26/1048509526.db2.gz HCININMZJQHZLJ-UHFFFAOYSA-N 2 0 342.430 4.461 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccc(F)c3cccnc23)cc1 ZINC000809737780 1048510843 /nfs/dbraw/zinc/51/08/43/1048510843.db2.gz KVIZHABDSCSTIO-UHFFFAOYSA-N 2 0 337.442 4.068 20 0 EIADRP Cc1cc(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)c2ccccc2n1 ZINC000809737957 1048511198 /nfs/dbraw/zinc/51/11/98/1048511198.db2.gz NHTCSVQWLXUFPW-UHFFFAOYSA-N 2 0 333.479 4.237 20 0 EIADRP Cc1cc(F)ccc1[C@@H](C)[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000815575487 1048536626 /nfs/dbraw/zinc/53/66/26/1048536626.db2.gz SRZIXWDAOWFUDA-UYAOXDASSA-N 2 0 340.486 4.349 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1cc(C)c(OC)c(Cl)c1 ZINC000844924852 1048550218 /nfs/dbraw/zinc/55/02/18/1048550218.db2.gz RJZKQDZQHXUYPG-AWEZNQCLSA-N 2 0 332.875 4.227 20 0 EIADRP CCCCCC[C@@H](CC)n1nc(C[N@H+](C)C(C)C)c2c1C[NH2+]CC2 ZINC001170592881 1048590108 /nfs/dbraw/zinc/59/01/08/1048590108.db2.gz NGOWBDHKRKLPOR-QGZVFWFLSA-N 2 0 334.552 4.291 20 0 EIADRP C[NH+](C)CC1CC[NH+]([C@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171162196 1048597001 /nfs/dbraw/zinc/59/70/01/1048597001.db2.gz IDZGOZOKZQHYFJ-INIZCTEOSA-N 2 0 341.326 4.124 20 0 EIADRP Cc1nc(C[N@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)sc1C ZINC001144378614 1048616748 /nfs/dbraw/zinc/61/67/48/1048616748.db2.gz UFNMDGSEGWWHAJ-UHFFFAOYSA-N 2 0 343.540 4.104 20 0 EIADRP CC(C)(C)c1csc(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)n1 ZINC000133310528 1048703901 /nfs/dbraw/zinc/70/39/01/1048703901.db2.gz RNTCQPOBCQGOIO-UHFFFAOYSA-N 2 0 349.588 4.370 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CC[C@]3(C)C[C@]3(F)Cl)CC2)C1 ZINC000846032144 1048800519 /nfs/dbraw/zinc/80/05/19/1048800519.db2.gz KEGOXONDNBXCAY-BZZMCLGOSA-N 2 0 330.919 4.324 20 0 EIADRP c1cc2cccc(C[NH+]3CCC4(CC[N@@H+](Cc5ccoc5)C4)CC3)c2[nH]1 ZINC001144713096 1048815170 /nfs/dbraw/zinc/81/51/70/1048815170.db2.gz KVOIBCYMGMLZOK-UHFFFAOYSA-N 2 0 349.478 4.249 20 0 EIADRP c1cncc(-c2cccc(C[NH+]3CCC(C[NH+]4CCCC4)CC3)c2)c1 ZINC000134207629 1048895597 /nfs/dbraw/zinc/89/55/97/1048895597.db2.gz USIRAKKRENGAQQ-UHFFFAOYSA-N 2 0 335.495 4.056 20 0 EIADRP C[C@H]1C[C@H]1c1ccc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)o1 ZINC000237665578 1048974065 /nfs/dbraw/zinc/97/40/65/1048974065.db2.gz WSDCITNNYSFAOU-HNAYVOBHSA-N 2 0 344.524 4.466 20 0 EIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H](c1ccccc1)C1CCOCC1 ZINC000817893266 1049054415 /nfs/dbraw/zinc/05/44/15/1049054415.db2.gz DENAWHDATNESNL-QMMLZNLJSA-N 2 0 330.516 4.055 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc2c(c1)CCC2 ZINC000817907248 1049056710 /nfs/dbraw/zinc/05/67/10/1049056710.db2.gz SVICRDOEFWQJBA-YROCYRMSSA-N 2 0 348.490 4.082 20 0 EIADRP CC(C)COc1ccc([C@H](C)[NH2+]Cc2ccc(CC[NH3+])cc2)cc1 ZINC000817946646 1049063701 /nfs/dbraw/zinc/06/37/01/1049063701.db2.gz CERNKIAHJRHIBE-KRWDZBQOSA-N 2 0 326.484 4.073 20 0 EIADRP [NH3+]CCc1ccc(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1 ZINC000817947986 1049063775 /nfs/dbraw/zinc/06/37/75/1049063775.db2.gz HWSXKIVPYVSDAT-IBGZPJMESA-N 2 0 348.412 4.448 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]Cc2ccc(CC[NH3+])cc2)cc1 ZINC000817947578 1049064345 /nfs/dbraw/zinc/06/43/45/1049064345.db2.gz BIVBKOLJMBUCSA-KRWDZBQOSA-N 2 0 326.484 4.218 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CCc3cccc(Cl)c3C2)cc1 ZINC001170897544 1049125129 /nfs/dbraw/zinc/12/51/29/1049125129.db2.gz PVRLLAJIZSPLPD-GOSISDBHSA-N 2 0 328.887 4.049 20 0 EIADRP [NH3+]CCc1cc2ccccc2n1-c1ccnc(C2(C(F)(F)F)CC2)c1 ZINC001171304783 1049149953 /nfs/dbraw/zinc/14/99/53/1049149953.db2.gz YAQOKTGVBYZQDF-UHFFFAOYSA-N 2 0 345.368 4.121 20 0 EIADRP Clc1cccc2c1C[C@@H]([NH2+]C1CC[NH+](CC3CCC3)CC1)CC2 ZINC001170910679 1049182939 /nfs/dbraw/zinc/18/29/39/1049182939.db2.gz MSRLEZWVFUDHAF-SFHVURJKSA-N 2 0 332.919 4.051 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H]2CCc3c(F)cc(F)cc3C2)CC1 ZINC001171353213 1049505416 /nfs/dbraw/zinc/50/54/16/1049505416.db2.gz FCVAHWPHBHCKKD-LXPRWKDFSA-N 2 0 336.470 4.065 20 0 EIADRP Oc1cccc2c1CCC[C@H]2[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000812720398 1049547754 /nfs/dbraw/zinc/54/77/54/1049547754.db2.gz FIRQLQRLIUAPRO-LBXVMSDZSA-N 2 0 328.500 4.156 20 0 EIADRP C[C@H](C[C@H](O)c1ccc(F)cc1)[NH2+][C@@H](C)c1cccc(C[NH+](C)C)c1 ZINC000820814880 1049557297 /nfs/dbraw/zinc/55/72/97/1049557297.db2.gz NVZYKBIDAKEEHV-XFQAVAEZSA-N 2 0 344.474 4.050 20 0 EIADRP Cc1cc(C[NH+](C)C)cc(N[C@@H](C)c2cccc(C[NH+](C)C)c2)c1 ZINC000820836125 1049566473 /nfs/dbraw/zinc/56/64/73/1049566473.db2.gz LESNXDKRCGSSOF-KRWDZBQOSA-N 2 0 325.500 4.291 20 0 EIADRP Fc1cccc2c1CC[C@@H]([NH2+]CC1CC[NH+](C3CCCCC3)CC1)C2 ZINC001171405149 1049629552 /nfs/dbraw/zinc/62/95/52/1049629552.db2.gz QZTCKDXVCMLUHK-LJQANCHMSA-N 2 0 344.518 4.317 20 0 EIADRP C[N@H+](C1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCc2c(F)cccc2C1 ZINC001171445373 1049695686 /nfs/dbraw/zinc/69/56/86/1049695686.db2.gz JRUOPZCEFFNEAJ-HXUWFJFHSA-N 2 0 344.518 4.412 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171474686 1049729344 /nfs/dbraw/zinc/72/93/44/1049729344.db2.gz WMENWROHLKUGRM-KZNAEPCWSA-N 2 0 336.470 4.065 20 0 EIADRP Cc1cccc2c1CC[C@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001171570849 1049758948 /nfs/dbraw/zinc/75/89/48/1049758948.db2.gz PAUANLCZQMZWKG-SFTDATJTSA-N 2 0 326.528 4.193 20 0 EIADRP COc1ccccc1CC(C)(C)[NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171631004 1049761473 /nfs/dbraw/zinc/76/14/73/1049761473.db2.gz SZRVZKZWDVJCHX-UHFFFAOYSA-N 2 0 332.532 4.257 20 0 EIADRP C[NH+]1C(C)(C)CC(Nc2ccc(C[NH3+])cc2C(F)(F)F)CC1(C)C ZINC001171626100 1049767972 /nfs/dbraw/zinc/76/79/72/1049767972.db2.gz VRAKRGXBXQTSQS-UHFFFAOYSA-N 2 0 343.437 4.227 20 0 EIADRP CN(Cc1ccc(Cl)cc1F)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001137661575 1049769666 /nfs/dbraw/zinc/76/96/66/1049769666.db2.gz YZTAOFJKGPMHMO-KRWDZBQOSA-N 2 0 346.877 4.433 20 0 EIADRP CN(C1CC[NH+](C2CCCCC2)CC1)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171640983 1049779847 /nfs/dbraw/zinc/77/98/47/1049779847.db2.gz LDWLHNKWBIMZEP-UHFFFAOYSA-N 2 0 349.607 4.367 20 0 EIADRP C[N@H+](CC[C@H]1CC1(Cl)Cl)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000822654603 1049782285 /nfs/dbraw/zinc/78/22/85/1049782285.db2.gz NTGAGONNOWMHJP-IRXDYDNUSA-N 2 0 341.326 4.024 20 0 EIADRP Cc1cccc2c(CC[NH3+])cn([C@@H]3C[C@@H](C)[N@@H+](Cc4ccccc4)C3)c21 ZINC001171726357 1049785762 /nfs/dbraw/zinc/78/57/62/1049785762.db2.gz VERMBNJPXMICEV-WIYYLYMNSA-N 2 0 347.506 4.286 20 0 EIADRP C[C@H]1C[C@@H](n2c(C[NH3+])cc3cccc(F)c32)C[N@@H+]1Cc1ccccc1 ZINC001171741665 1049801800 /nfs/dbraw/zinc/80/18/00/1049801800.db2.gz QSJMHHDTQCOPDE-HNAYVOBHSA-N 2 0 337.442 4.075 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCCC2)[C@H]2Cc3cccc(F)c3C2)CC1 ZINC001171785433 1049803978 /nfs/dbraw/zinc/80/39/78/1049803978.db2.gz NIHHWFMPKBQFKI-UFYCRDLUSA-N 2 0 344.518 4.445 20 0 EIADRP COC1(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCC1 ZINC000813790734 1049816176 /nfs/dbraw/zinc/81/61/76/1049816176.db2.gz VVDUZEOJBFVQPL-SEJPIABJSA-N 2 0 342.527 4.121 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001171966606 1049826170 /nfs/dbraw/zinc/82/61/70/1049826170.db2.gz WNWPVDUTYYFGRT-KBRIMQKVSA-N 2 0 328.422 4.099 20 0 EIADRP CC1(C)C[C@H](n2cc3cc(C[NH3+])ccc3n2)CC[N@@H+]1Cc1ccccc1 ZINC001171971783 1049834584 /nfs/dbraw/zinc/83/45/84/1049834584.db2.gz JYVYLLZIVCVZDH-HXUWFJFHSA-N 2 0 348.494 4.111 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001171974439 1049836246 /nfs/dbraw/zinc/83/62/46/1049836246.db2.gz UHCUKPZPAMQEDT-OAHLLOKOSA-N 2 0 340.433 4.054 20 0 EIADRP C[C@@H](N[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1cncc(F)c1 ZINC001171978454 1049836995 /nfs/dbraw/zinc/83/69/95/1049836995.db2.gz KVYACXZVJSYOOD-OXQOHEQNSA-N 2 0 341.474 4.315 20 0 EIADRP Cc1cccc(C(=[NH2+])N[C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)c1 ZINC001171976178 1049837247 /nfs/dbraw/zinc/83/72/47/1049837247.db2.gz QASTWNSOXHVPTO-HXUWFJFHSA-N 2 0 335.495 4.353 20 0 EIADRP CCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CCOCC1 ZINC001171977806 1049837309 /nfs/dbraw/zinc/83/73/09/1049837309.db2.gz HBOXDXFTJDWBIC-FQEVSTJZSA-N 2 0 344.543 4.226 20 0 EIADRP CC1(C)C[C@@H]([NH2+]C2(Cc3cccnc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171974952 1049837424 /nfs/dbraw/zinc/83/74/24/1049837424.db2.gz BJNAPFFCRQTLCN-NRFANRHFSA-N 2 0 349.522 4.190 20 0 EIADRP CC1(C)C[C@@H](N2CC[C@](C)(F)[C@H](F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171976026 1049837605 /nfs/dbraw/zinc/83/76/05/1049837605.db2.gz HQLDSDPMRPKLFW-NSHGMRRFSA-N 2 0 336.470 4.202 20 0 EIADRP CC1(C)C[C@H](N2CC[C@](C)(F)[C@@H](F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171976025 1049837865 /nfs/dbraw/zinc/83/78/65/1049837865.db2.gz HQLDSDPMRPKLFW-HBFSDRIKSA-N 2 0 336.470 4.202 20 0 EIADRP Cc1cc2c(cn1)[C@H]([NH2+][C@@H]1CC[N@H+](Cc3ccccc3)C(C)(C)C1)CC2 ZINC001171980586 1049838597 /nfs/dbraw/zinc/83/85/97/1049838597.db2.gz RTFVZJFWPPLRQZ-IFMALSPDSA-N 2 0 349.522 4.410 20 0 EIADRP CC1(C)C[C@H]([NH+]2C[C@H]3[C@H](CC3(F)F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171981016 1049839102 /nfs/dbraw/zinc/83/91/02/1049839102.db2.gz JXSOCQXMPSMXJS-KURKYZTESA-N 2 0 334.454 4.017 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@@H]2CCCc3cnccc32)CC[N@@H+]1Cc1ccccc1 ZINC001171980483 1049839269 /nfs/dbraw/zinc/83/92/69/1049839269.db2.gz VNXRCFCSOBXWHF-IFMALSPDSA-N 2 0 349.522 4.492 20 0 EIADRP COCCC1CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171985187 1049840565 /nfs/dbraw/zinc/84/05/65/1049840565.db2.gz SSHXXVHXUKVEKV-OAQYLSRUSA-N 2 0 344.543 4.178 20 0 EIADRP CC1(C)C[C@H]([NH+]2CC[C@@H](c3ccccn3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171983814 1049840636 /nfs/dbraw/zinc/84/06/36/1049840636.db2.gz GWHZCPGRAPDMNJ-NHCUHLMSSA-N 2 0 349.522 4.314 20 0 EIADRP C[NH2+]Cc1ccc(N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC001172072166 1049844541 /nfs/dbraw/zinc/84/45/41/1049844541.db2.gz HTMBRPPMARGUSW-WBDAEOGXSA-N 2 0 349.522 4.404 20 0 EIADRP CO[C@H]1CCC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001172076429 1049845522 /nfs/dbraw/zinc/84/55/22/1049845522.db2.gz YMXXYPSAOGUMMB-LRSLUSHPSA-N 2 0 342.527 4.073 20 0 EIADRP CO[C@H]1CCC[C@@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172079702 1049846164 /nfs/dbraw/zinc/84/61/64/1049846164.db2.gz PNLAWCDBHLJPNS-BDHVOXNPSA-N 2 0 342.527 4.119 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](NCc1cc(F)c(Cl)cc1Cl)C2 ZINC001172100427 1049849664 /nfs/dbraw/zinc/84/96/64/1049849664.db2.gz QKPBIVHEUBHRJD-XYYAHUGASA-N 2 0 331.262 4.237 20 0 EIADRP Cc1ccccc1[C@@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccncc1 ZINC001172099939 1049849887 /nfs/dbraw/zinc/84/98/87/1049849887.db2.gz NVKSIITYDMAWCP-IIZPIQPGSA-N 2 0 335.495 4.084 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]C2CCSCC2)C3)cc1 ZINC001172066173 1049852024 /nfs/dbraw/zinc/85/20/24/1049852024.db2.gz UMJWVUCPADZOCV-OWZKRDHZSA-N 2 0 330.541 4.057 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]CC2CCSCC2)C3)cc1 ZINC001172066919 1049852042 /nfs/dbraw/zinc/85/20/42/1049852042.db2.gz DFUWDAPQFONQJH-WKCHPHFGSA-N 2 0 344.568 4.305 20 0 EIADRP C[C@@H]1CCN([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C[C@H]1F ZINC001172067550 1049852065 /nfs/dbraw/zinc/85/20/65/1049852065.db2.gz CVYQMUQQDIDUCZ-QNDFHXLGSA-N 2 0 330.491 4.252 20 0 EIADRP Cc1cnccc1C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172070015 1049852380 /nfs/dbraw/zinc/85/23/80/1049852380.db2.gz ZUMUFTZUQGHSCJ-KOUNCHBCSA-N 2 0 335.495 4.065 20 0 EIADRP C[C@H](Cc1cccs1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245770345 1049852883 /nfs/dbraw/zinc/85/28/83/1049852883.db2.gz XEBGOLFGCFCYGV-AFYVEPGGSA-N 2 0 340.536 4.464 20 0 EIADRP CCCCOCCC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172069173 1049853241 /nfs/dbraw/zinc/85/32/41/1049853241.db2.gz HEJHANVYWJWKLN-KOUNCHBCSA-N 2 0 344.543 4.369 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc(C(=O)c3ccccc3)cc1)C2 ZINC001172101920 1049855537 /nfs/dbraw/zinc/85/55/37/1049855537.db2.gz IFZYVMNGYGQUCZ-DKUWSORSSA-N 2 0 348.490 4.023 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)N2C)c1cccc(C(F)(F)F)c1 ZINC001172108181 1049857459 /nfs/dbraw/zinc/85/74/59/1049857459.db2.gz REOSQAJJWQODAB-OSMBCOQSSA-N 2 0 326.406 4.371 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1cccc(OC3CCCC3)c1)C2 ZINC001172117857 1049857996 /nfs/dbraw/zinc/85/79/96/1049857996.db2.gz NOQCVCUBCZNJOV-REPLKXPHSA-N 2 0 328.500 4.113 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC1(Cc3ccccc3Cl)CC1)C2 ZINC001172110944 1049858648 /nfs/dbraw/zinc/85/86/48/1049858648.db2.gz MDZOVINFCMWIJX-BCDXTJNWSA-N 2 0 332.919 4.268 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H](c1ccccc1)c1ccc(O)cc1)C2 ZINC001172118789 1049858762 /nfs/dbraw/zinc/85/87/62/1049858762.db2.gz SVLXVBSWYRCODC-XWSHUIEDSA-N 2 0 336.479 4.087 20 0 EIADRP C[C@@]12CC3([NH3+])CC([NH2+][C@H]4CSc5ccccc5C4)(C1)C[C@](C)(C3)C2 ZINC001172205867 1049864261 /nfs/dbraw/zinc/86/42/61/1049864261.db2.gz ZDVAMVSMMWESCX-MYAZKZQCSA-N 2 0 342.552 4.123 20 0 EIADRP Clc1cccc2c1CC[C@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)C2 ZINC001171022667 1049866438 /nfs/dbraw/zinc/86/64/38/1049866438.db2.gz PGICYBJDCMMOGW-IBGZPJMESA-N 2 0 346.946 4.442 20 0 EIADRP c1ccc2c(c1)C[C@@H]([NH2+]CC1CC[NH+](CC3CCCC3)CC1)CS2 ZINC001172199296 1049869643 /nfs/dbraw/zinc/86/96/43/1049869643.db2.gz VFYNGVIEZQUZAU-HXUWFJFHSA-N 2 0 344.568 4.195 20 0 EIADRP COCCC[NH+]1CCC([NH2+]Cc2cccc(-c3cccs3)c2)CC1 ZINC001172246538 1049872088 /nfs/dbraw/zinc/87/20/88/1049872088.db2.gz MIKNMPMLSCEOLF-UHFFFAOYSA-N 2 0 344.524 4.006 20 0 EIADRP Clc1cccc2c1CC[C@H]([NH2+]C1CC[NH+](CC3CCC3)CC1)C2 ZINC001171029372 1049874419 /nfs/dbraw/zinc/87/44/19/1049874419.db2.gz HUQFIEPFJUQYEK-SFHVURJKSA-N 2 0 332.919 4.051 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171033897 1049882408 /nfs/dbraw/zinc/88/24/08/1049882408.db2.gz QHVQDLHSGPDJCW-KZNAEPCWSA-N 2 0 334.935 4.440 20 0 EIADRP COc1ccc(CN2CCC([NH2+][C@@H]3CC[C@H](C)[C@H](C)C3)CC2)cc1 ZINC001172359544 1049895080 /nfs/dbraw/zinc/89/50/80/1049895080.db2.gz KCLAXRZSLYCSBC-SQGPQFPESA-N 2 0 330.516 4.074 20 0 EIADRP C[NH+](C)C1CCN(c2ccc(N[C@@H]3CCCC34CCC4)cc2)CC1 ZINC000824066217 1049897221 /nfs/dbraw/zinc/89/72/21/1049897221.db2.gz PWZKXVNPUQUFKN-HXUWFJFHSA-N 2 0 327.516 4.352 20 0 EIADRP CC(C)OCC[C@H](C)[N@H+](Cc1cccc(F)c1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172437377 1049912315 /nfs/dbraw/zinc/91/23/15/1049912315.db2.gz OSIRDDOPENJREX-VDGAXYAQSA-N 2 0 336.495 4.101 20 0 EIADRP CC(C)OCC[C@@H](C)[N@H+]1C[C@H]2c3ccccc3[C@H]([NH+](C)C(C)C)[C@H]2C1 ZINC001172451447 1049914759 /nfs/dbraw/zinc/91/47/59/1049914759.db2.gz QASNAHSAYIBWTJ-MNAPGUCWSA-N 2 0 344.543 4.301 20 0 EIADRP CCCCCC[C@@H](CCCC)[NH+]1CCC(N2CC[NH+](C)CC2)CC1 ZINC001172511988 1049926938 /nfs/dbraw/zinc/92/69/38/1049926938.db2.gz BEJMXGKRSXVTFA-HXUWFJFHSA-N 2 0 337.596 4.227 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccn2)[C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172555942 1049930982 /nfs/dbraw/zinc/93/09/82/1049930982.db2.gz KNQQUBWPGKXMBJ-PRTQVNTJSA-N 2 0 349.522 4.490 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[N@H+](C)C1CCC([NH3+])CC1 ZINC001172565997 1049935737 /nfs/dbraw/zinc/93/57/37/1049935737.db2.gz ANMAXRWGPYJYLY-XGNXJENSSA-N 2 0 330.850 4.141 20 0 EIADRP CC1(C)CC([N@H+](CC2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC(C)(C)O1 ZINC001172653733 1049957271 /nfs/dbraw/zinc/95/72/71/1049957271.db2.gz PYLIYNULFSQZHQ-IYARVYRRSA-N 2 0 336.564 4.485 20 0 EIADRP CC1(C)CC([NH2+]C23CC4([NH3+])C[C@](C)(C2)C[C@@](C)(C4)C3)CC(C)(C)O1 ZINC001172652997 1049957366 /nfs/dbraw/zinc/95/73/66/1049957366.db2.gz XKGXJHAFQQKHPY-WHSGIHJSSA-N 2 0 334.548 4.143 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+][C@@H]1Cc2ccc(Cl)cc2C1)c1ccccc1 ZINC001172708949 1049970812 /nfs/dbraw/zinc/97/08/12/1049970812.db2.gz QFIOGWLBLUPARM-UXHICEINSA-N 2 0 328.887 4.090 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1CC2(CCCC2)Oc2ccccc21 ZINC000246431105 1049971977 /nfs/dbraw/zinc/97/19/77/1049971977.db2.gz NYCFYHUGMNNSSP-FPAYPSAMSA-N 2 0 328.500 4.141 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(SCC(F)F)cc2)C1 ZINC000246816872 1050001725 /nfs/dbraw/zinc/00/17/25/1050001725.db2.gz AXVUSPKFOGBSMF-ZIAGYGMSSA-N 2 0 328.472 4.036 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](CC)c2ccc(OC(F)F)cc2)C1 ZINC000246969546 1050007723 /nfs/dbraw/zinc/00/77/23/1050007723.db2.gz IZPAJPSNOYOGFZ-WMLDXEAASA-N 2 0 326.431 4.061 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cnc2ccsc2c1 ZINC000247177756 1050015928 /nfs/dbraw/zinc/01/59/28/1050015928.db2.gz VBHCNGHWZKVUEC-JKSUJKDBSA-N 2 0 331.529 4.459 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CCc2ccc(-c3csc(C)n3)s2)[C@@H](C)C1 ZINC000248044616 1050040265 /nfs/dbraw/zinc/04/02/65/1050040265.db2.gz UPSCYLKKUSDFQV-BBRMVZONSA-N 2 0 349.569 4.042 20 0 EIADRP CC(C)OCCCC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000248374866 1050051934 /nfs/dbraw/zinc/05/19/34/1050051934.db2.gz UREQFCINUUQEPT-BHDDXSALSA-N 2 0 344.543 4.082 20 0 EIADRP Cc1c([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cnn1C(C)(C)C ZINC000248713477 1050074108 /nfs/dbraw/zinc/07/41/08/1050074108.db2.gz QVAHCMPZCNMFOT-SJORKVTESA-N 2 0 334.552 4.252 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](CC)c2cccc(F)c2)[C@H](C)C1 ZINC000249214415 1050095339 /nfs/dbraw/zinc/09/53/39/1050095339.db2.gz ZJIIEAWNBLZGIC-UXPWSPDFSA-N 2 0 336.495 4.003 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CCc2nc(C3CCCCC3)cs2)[C@H](C)C1 ZINC000090046500 1050152425 /nfs/dbraw/zinc/15/24/25/1050152425.db2.gz AADPSAOILARXLX-WBVHZDCISA-N 2 0 335.561 4.053 20 0 EIADRP CCC(CC)[C@H](C[NH2+]C[C@@H]1CCOc2ccccc21)[NH+]1CCCC1 ZINC001177198914 1050159710 /nfs/dbraw/zinc/15/97/10/1050159710.db2.gz ANHYAAVMBPREMG-ICSRJNTNSA-N 2 0 330.516 4.043 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([N@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828185 1050166976 /nfs/dbraw/zinc/16/69/76/1050166976.db2.gz JGOCMNSVYYYDSQ-YMPZKCBVSA-N 2 0 349.522 4.019 20 0 EIADRP CCOc1ccc(Cl)cc1C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC001177231397 1050168705 /nfs/dbraw/zinc/16/87/05/1050168705.db2.gz ONWGTLZIWBAUAM-UHFFFAOYSA-N 2 0 332.875 4.090 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([N@H+](C)C[C@@H]1CC[NH+](Cc3ccccc3)C1)CC2 ZINC001172844395 1050182247 /nfs/dbraw/zinc/18/22/47/1050182247.db2.gz SQCFVCBOKKWGHM-XUZZJYLKSA-N 2 0 348.534 4.306 20 0 EIADRP COC1(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)CCCCC1 ZINC001177261958 1050183600 /nfs/dbraw/zinc/18/36/00/1050183600.db2.gz MBBRMQYBZHQQFW-IBGZPJMESA-N 2 0 344.543 4.357 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([N@H+](C)C[C@H]1CC[NH+](Cc3ccccc3)C1)CC2 ZINC001172844396 1050184142 /nfs/dbraw/zinc/18/41/42/1050184142.db2.gz SQCFVCBOKKWGHM-ZJSXRUAMSA-N 2 0 348.534 4.306 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)[N@@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001172849778 1050188185 /nfs/dbraw/zinc/18/81/85/1050188185.db2.gz PNGUXNBKNGAPCJ-LSDHHAIUSA-N 2 0 326.887 4.251 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[NH2+]CCCC1CC[NH+](C)CC1 ZINC001172851371 1050189834 /nfs/dbraw/zinc/18/98/34/1050189834.db2.gz IIKYIESSZGRPJC-CQSZACIVSA-N 2 0 326.887 4.122 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC001172851129 1050190015 /nfs/dbraw/zinc/19/00/15/1050190015.db2.gz FRFGEJQCBOIHDS-AWEZNQCLSA-N 2 0 347.865 4.064 20 0 EIADRP CC(C)[N@H+]([C@@H](C)Cc1ccc(F)cc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172855881 1050192393 /nfs/dbraw/zinc/19/23/93/1050192393.db2.gz APZXMFPLDSWOSX-JQFCIGGWSA-N 2 0 326.887 4.390 20 0 EIADRP C[C@@H](C[NH2+]Cc1ccc(Oc2cccc(F)c2)cc1)C[NH+]1CCCC1 ZINC001177328746 1050193260 /nfs/dbraw/zinc/19/32/60/1050193260.db2.gz SLFCIRCCXIWBRY-KRWDZBQOSA-N 2 0 342.458 4.440 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC001172858160 1050194154 /nfs/dbraw/zinc/19/41/54/1050194154.db2.gz CVKXIXODMJWRMM-AWEZNQCLSA-N 2 0 338.898 4.407 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH+]1CCC([NH3+])(CC2CC2)CC1 ZINC001172878840 1050220502 /nfs/dbraw/zinc/22/05/02/1050220502.db2.gz KSXFQZYCVFPUSR-CQSZACIVSA-N 2 0 338.948 4.414 20 0 EIADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2cc(Br)ccc2Cl)CC1 ZINC001206305092 1050236370 /nfs/dbraw/zinc/23/63/70/1050236370.db2.gz SSTSTDAMJHHQMX-OAHLLOKOSA-N 2 0 345.712 4.053 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](c2ccc(OC)cc2)C2CC2)c1 ZINC000091333117 1050253745 /nfs/dbraw/zinc/25/37/45/1050253745.db2.gz TYCDJABIEABCAS-QFIPXVFZSA-N 2 0 338.495 4.388 20 0 EIADRP CC(C)[C@H]1C[C@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)CCO1 ZINC001177566646 1050254878 /nfs/dbraw/zinc/25/48/78/1050254878.db2.gz YFUUGMVKDJSXQV-FGZHOGPDSA-N 2 0 344.543 4.356 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1C1CCC2(CCOCC2)CC1 ZINC001173048798 1050273366 /nfs/dbraw/zinc/27/33/66/1050273366.db2.gz VEALEIWAGUGBCQ-VQTJNVASSA-N 2 0 334.548 4.065 20 0 EIADRP CC(C)[C@H]1C[C@@H]([NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)CCO1 ZINC001177742978 1050291209 /nfs/dbraw/zinc/29/12/09/1050291209.db2.gz KBIJZEMOHDVQPY-FCHUYYIVSA-N 2 0 344.543 4.212 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2cccc(C(F)(F)F)c2)CC1 ZINC001173104041 1050305441 /nfs/dbraw/zinc/30/54/41/1050305441.db2.gz DSHFUMKOJWNERU-UHFFFAOYSA-N 2 0 328.422 4.448 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCN(c3ccc(Cl)cc3)CC2)CC1 ZINC001173108600 1050306853 /nfs/dbraw/zinc/30/68/53/1050306853.db2.gz OURCUHNASCREQH-UHFFFAOYSA-N 2 0 349.950 4.115 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCN(c3cc(C)ccc3C)CC2)CC1 ZINC001173108816 1050307265 /nfs/dbraw/zinc/30/72/65/1050307265.db2.gz RHEGTIMCGARHCN-UHFFFAOYSA-N 2 0 343.559 4.078 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](c2ccc(Cl)cn2)C2CC2)CC1 ZINC001173109405 1050307930 /nfs/dbraw/zinc/30/79/30/1050307930.db2.gz DVIQZVDOVVHGEO-TVPLGVNVSA-N 2 0 335.923 4.429 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC(c3ccc(O)cc3)CC2)CC1 ZINC001173113347 1050309771 /nfs/dbraw/zinc/30/97/71/1050309771.db2.gz NKTYDPWGMQSFAG-UHFFFAOYSA-N 2 0 330.516 4.225 20 0 EIADRP CC[NH+](CC)C1CCC(n2c3ccccc3c3c2CC[NH2+]C3)CC1 ZINC001173111403 1050309944 /nfs/dbraw/zinc/30/99/44/1050309944.db2.gz DXLANETYGHVWBA-UHFFFAOYSA-N 2 0 325.500 4.113 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)CC1 ZINC001173114005 1050309954 /nfs/dbraw/zinc/30/99/54/1050309954.db2.gz ROLNCQAFYUCHJQ-VWEINGBSSA-N 2 0 330.516 4.101 20 0 EIADRP CC[NH+](CC)C1CCC([N@H+](C)CCCc2cccc(OC)c2)CC1 ZINC001173112418 1050310524 /nfs/dbraw/zinc/31/05/24/1050310524.db2.gz AOVFHVYYALDZMO-UHFFFAOYSA-N 2 0 332.532 4.213 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CC2(Cc3ccccc3F)CC2)CC1 ZINC001173111163 1050310788 /nfs/dbraw/zinc/31/07/88/1050310788.db2.gz YDWCXKVQEYUSOS-UHFFFAOYSA-N 2 0 332.507 4.391 20 0 EIADRP C[N@H+](C1CCOCC1)C1CC[NH+](C2CCC3(CCCCC3)CC2)CC1 ZINC001173121653 1050316248 /nfs/dbraw/zinc/31/62/48/1050316248.db2.gz TWXUJMNPQRZMHX-UHFFFAOYSA-N 2 0 348.575 4.455 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+]C2CCC(Oc3ccccc3)CC2)c1 ZINC001173198595 1050342168 /nfs/dbraw/zinc/34/21/68/1050342168.db2.gz WHNAODFWHYRHNN-UHFFFAOYSA-N 2 0 338.495 4.228 20 0 EIADRP CCCC[C@@H](CC(C)C)[NH2+]CC1CC[NH+](CC2CCOCC2)CC1 ZINC001173253919 1050379565 /nfs/dbraw/zinc/37/95/65/1050379565.db2.gz SHMRRVRUCVZFBN-NRFANRHFSA-N 2 0 338.580 4.320 20 0 EIADRP CC[C@@H]1CC[C@@H]([N@H+](Cc2cccc(OC)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173271851 1050391016 /nfs/dbraw/zinc/39/10/16/1050391016.db2.gz RMIPXAIPMTYXTP-VBSBHUPXSA-N 2 0 330.516 4.346 20 0 EIADRP CCSC[C@@H](C)[NH+]1CCC2(CC[C@@H]2[N@H+](C)Cc2ccco2)CC1 ZINC001173299048 1050400791 /nfs/dbraw/zinc/40/07/91/1050400791.db2.gz AIIGQEFRPFWKIF-AEFFLSMTSA-N 2 0 336.545 4.098 20 0 EIADRP CC[NH+](CC)CCCN1CC[NH+]([C@@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173344065 1050431534 /nfs/dbraw/zinc/43/15/34/1050431534.db2.gz QFFSWLVDXYTLRD-OAQYLSRUSA-N 2 0 349.607 4.229 20 0 EIADRP C([NH2+][C@H]1CCCC2(CCCCC2)C1)C1CC[NH+](C2CCOCC2)CC1 ZINC001173344913 1050434554 /nfs/dbraw/zinc/43/45/54/1050434554.db2.gz PIXUORCFDUDJOW-FQEVSTJZSA-N 2 0 348.575 4.360 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]CC12CC[NH+](CC1)CC2 ZINC001173538915 1050475610 /nfs/dbraw/zinc/47/56/10/1050475610.db2.gz JLWKXHYZSFYPEB-CQSZACIVSA-N 2 0 341.326 4.390 20 0 EIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)cc1 ZINC000092856911 1050480586 /nfs/dbraw/zinc/48/05/86/1050480586.db2.gz HMQBJUGQARBWOP-OAHLLOKOSA-N 2 0 329.875 4.302 20 0 EIADRP Cc1ccc(-c2ccc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)o2)cc1 ZINC001179253039 1050658993 /nfs/dbraw/zinc/65/89/93/1050658993.db2.gz OJOPIISIENIILR-UHFFFAOYSA-N 2 0 338.495 4.467 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC001179259164 1050662693 /nfs/dbraw/zinc/66/26/93/1050662693.db2.gz SHPMGYWNNOZPQS-INIZCTEOSA-N 2 0 340.433 4.225 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+]Cc2cccc(-c3ccccn3)c2)CC1 ZINC001179277735 1050668517 /nfs/dbraw/zinc/66/85/17/1050668517.db2.gz MUKSAEWVJXGIIV-UHFFFAOYSA-N 2 0 337.511 4.349 20 0 EIADRP CO[C@@H]1CCC[C@H]([NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001179278722 1050669754 /nfs/dbraw/zinc/66/97/54/1050669754.db2.gz YHBCDTKZVXKOED-FCHUYYIVSA-N 2 0 344.543 4.226 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1ccccc1N(C)C ZINC000093941673 1050724557 /nfs/dbraw/zinc/72/45/57/1050724557.db2.gz XKMPQMRZSVAAOP-SFHVURJKSA-N 2 0 339.527 4.445 20 0 EIADRP CC(C)[C@@H](C[NH2+][C@@H](CC[NH+](C)C)c1cccnc1)c1ccccc1 ZINC001179636703 1050745228 /nfs/dbraw/zinc/74/52/28/1050745228.db2.gz KLKVFUZTLXWNQM-RTWAWAEBSA-N 2 0 325.500 4.104 20 0 EIADRP c1ccc(C[NH+]2CCC[C@H]3C[N@H+](CC4CCSCC4)CC[C@@H]32)cc1 ZINC001179918367 1050834282 /nfs/dbraw/zinc/83/42/82/1050834282.db2.gz BOCCNQXXYRCCIC-SFTDATJTSA-N 2 0 344.568 4.116 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](C[C@@H]2CCc3ccccc32)C1 ZINC001180030503 1050860179 /nfs/dbraw/zinc/86/01/79/1050860179.db2.gz NRWHHXKGZPBBNS-DYXWJJEUSA-N 2 0 326.528 4.303 20 0 EIADRP COc1cc2ccccc2cc1CN(C)CC[C@H]1CCCC[N@@H+]1C ZINC001180099202 1050886395 /nfs/dbraw/zinc/88/63/95/1050886395.db2.gz WRFHEBVRDRMRPB-HXUWFJFHSA-N 2 0 326.484 4.155 20 0 EIADRP c1ccc2c(c1)CC[C@H]2C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC001180125406 1050892508 /nfs/dbraw/zinc/89/25/08/1050892508.db2.gz YGVHUMMIZNNRJD-NRFANRHFSA-N 2 0 326.528 4.304 20 0 EIADRP CCOc1ccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cc1F ZINC001180125086 1050892709 /nfs/dbraw/zinc/89/27/09/1050892709.db2.gz QUODDCKTWOUHFV-UHFFFAOYSA-N 2 0 348.506 4.312 20 0 EIADRP Cc1cc(C)cc(CC[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC001180350249 1050966112 /nfs/dbraw/zinc/96/61/12/1050966112.db2.gz WYNODVIKEGDCLT-NFBKMPQASA-N 2 0 336.523 4.346 20 0 EIADRP C[NH+](C)[C@H]1CCCN(Cc2ccc(SC(F)(F)F)cc2)CC1 ZINC000763604577 1050977563 /nfs/dbraw/zinc/97/75/63/1050977563.db2.gz HOBWEORFGXOLRF-AWEZNQCLSA-N 2 0 332.435 4.215 20 0 EIADRP C[C@@H](C[NH2+]C[C@@H]1CCC[N@@H+]1C1CCCCC1)c1cc(F)cc(F)c1 ZINC001181276062 1051196114 /nfs/dbraw/zinc/19/61/14/1051196114.db2.gz IKTYXRWDARYOQY-YWZLYKJASA-N 2 0 336.470 4.455 20 0 EIADRP CC[NH+]1CCC([NH2+]CC2(c3c(Cl)cccc3Cl)CCC2)CC1 ZINC001181276249 1051196779 /nfs/dbraw/zinc/19/67/79/1051196779.db2.gz KPBAMIVBBIGUJA-UHFFFAOYSA-N 2 0 341.326 4.489 20 0 EIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](CCSCc3ccccc3)C2)CC1 ZINC001190651730 1051244446 /nfs/dbraw/zinc/24/44/46/1051244446.db2.gz QAIQXZSSBHNJNF-NRFANRHFSA-N 2 0 346.584 4.364 20 0 EIADRP CC(C)CC[NH+]1CCC([NH2+]CCCc2c[nH]c3ccc(F)cc23)CC1 ZINC001181738589 1051292024 /nfs/dbraw/zinc/29/20/24/1051292024.db2.gz BSCTWPIYMVXKRQ-UHFFFAOYSA-N 2 0 345.506 4.340 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CC2(C3CC3)CC2)ccc1OC ZINC000775416797 1051292900 /nfs/dbraw/zinc/29/29/00/1051292900.db2.gz RLMPKXVCDOLEEZ-MRXNPFEDSA-N 2 0 330.516 4.378 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc[nH]2)cc1C[NH+]1CCCCC1 ZINC000775425296 1051316860 /nfs/dbraw/zinc/31/68/60/1051316860.db2.gz XOENLWBRRLWMMG-IRXDYDNUSA-N 2 0 341.499 4.421 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](CCc2ccccc2F)CC1 ZINC001191550863 1051486163 /nfs/dbraw/zinc/48/61/63/1051486163.db2.gz NOWXUIUICXLKJG-GOSISDBHSA-N 2 0 332.507 4.345 20 0 EIADRP CC(C)COc1cccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC001192323737 1051692259 /nfs/dbraw/zinc/69/22/59/1051692259.db2.gz FCNKMXJVYXYQAC-DENIHFKCSA-N 2 0 342.527 4.170 20 0 EIADRP c1ccc(SCC[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cc1 ZINC001192402115 1051723313 /nfs/dbraw/zinc/72/33/13/1051723313.db2.gz SRNWYAVWFIMYTP-UHFFFAOYSA-N 2 0 332.557 4.367 20 0 EIADRP Cc1nc2c(s1)[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)CCC2 ZINC000158591528 1051762107 /nfs/dbraw/zinc/76/21/07/1051762107.db2.gz XVXAWIHLAXMMKM-UXLLHSPISA-N 2 0 335.561 4.177 20 0 EIADRP Cc1cc([C@@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)C2CC2)ccc1F ZINC000158702616 1051779422 /nfs/dbraw/zinc/77/94/22/1051779422.db2.gz ILPUERVRJZGDTC-NRFANRHFSA-N 2 0 326.459 4.437 20 0 EIADRP C[C@H]([NH2+]CC1CCC2(CC2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001183122652 1051784347 /nfs/dbraw/zinc/78/43/47/1051784347.db2.gz MAUSWJWGQOHIHZ-GHTZIAJQSA-N 2 0 326.528 4.457 20 0 EIADRP CCc1noc(C)c1C[NH+]1CCC(CC[N@@H+]2CCCC[C@@H]2C)CC1 ZINC000158978973 1051803527 /nfs/dbraw/zinc/80/35/27/1051803527.db2.gz JONILGCIXCHSLZ-INIZCTEOSA-N 2 0 333.520 4.022 20 0 EIADRP C[C@H](CCc1ccc(Cl)s1)[NH2+]C[C@H]1CCN1C1CCCC1 ZINC001183227246 1051808289 /nfs/dbraw/zinc/80/82/89/1051808289.db2.gz PTNLIUJZAMRSIA-UKRRQHHQSA-N 2 0 326.937 4.329 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC001183408594 1051836516 /nfs/dbraw/zinc/83/65/16/1051836516.db2.gz JRNYDADQPIPYTK-IMUUDWKMSA-N 2 0 326.887 4.263 20 0 EIADRP COCC[C@@H](c1ccccc1)[NH+]1CCC(C)([NH+]2CCCCC2)CC1 ZINC001175965822 1051853098 /nfs/dbraw/zinc/85/30/98/1051853098.db2.gz RVZZNIJXTUHBRW-FQEVSTJZSA-N 2 0 330.516 4.105 20 0 EIADRP [NH3+]Cc1ccc(Nc2ccc3c(c2)CC[C@H]([NH+]2CCCC2)CC3)cc1 ZINC001175972638 1051854470 /nfs/dbraw/zinc/85/44/70/1051854470.db2.gz FGLLUOJBSATPHW-JOCHJYFZSA-N 2 0 335.495 4.232 20 0 EIADRP CC(C)C[C@H](Cc1cccc(Cl)c1)[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001184135910 1051952215 /nfs/dbraw/zinc/95/22/15/1051952215.db2.gz XGSRNGFBYKSCGB-AZUAARDMSA-N 2 0 334.935 4.229 20 0 EIADRP CC(C)C[C@@H](Cc1cccc(Cl)c1)[NH2+]C[C@H]1C[NH+]2CCC1CC2 ZINC001184135911 1051952745 /nfs/dbraw/zinc/95/27/45/1051952745.db2.gz XGSRNGFBYKSCGB-ICSRJNTNSA-N 2 0 334.935 4.229 20 0 EIADRP CCN1CCC([NH2+][C@H](C)c2ccc(SCC(F)F)cc2)CC1 ZINC000159262666 1051963985 /nfs/dbraw/zinc/96/39/85/1051963985.db2.gz OARDIGLFTLMDOA-CYBMUJFWSA-N 2 0 328.472 4.179 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccc3c(c2)OCO3)c1 ZINC000163543167 1051996124 /nfs/dbraw/zinc/99/61/24/1051996124.db2.gz VXHNWWHIZSFGRX-INIZCTEOSA-N 2 0 340.467 4.108 20 0 EIADRP CC(C)C[C@H](C)C[C@@H](C)[NH2+]CCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001184417526 1052009578 /nfs/dbraw/zinc/00/95/78/1052009578.db2.gz FJAXIIRAMSJWNT-VQTJNVASSA-N 2 0 345.575 4.031 20 0 EIADRP C[NH+](C)CCCOc1ccc(C[NH2+][C@@H]2CCCc3sccc32)cc1 ZINC000165190105 1052053638 /nfs/dbraw/zinc/05/36/38/1052053638.db2.gz RKHRSIUAYGPWLC-LJQANCHMSA-N 2 0 344.524 4.246 20 0 EIADRP C[C@H](C[NH2+][C@H](C)[C@@H](C)c1nc2ccccc2s1)C[NH+]1CCCC1 ZINC000165305117 1052057408 /nfs/dbraw/zinc/05/74/08/1052057408.db2.gz NABFLIATXLWRBM-BZUAXINKSA-N 2 0 331.529 4.110 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)cc1 ZINC000165897772 1052078433 /nfs/dbraw/zinc/07/84/33/1052078433.db2.gz YNTVLNYTPFCHOU-MSOLQXFVSA-N 2 0 326.484 4.347 20 0 EIADRP CC1CC[NH+](CCCC[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000166173920 1052085849 /nfs/dbraw/zinc/08/58/49/1052085849.db2.gz SLEGEPRBBNLSNZ-RBBKRZOGSA-N 2 0 344.543 4.256 20 0 EIADRP CC(C)(C)n1cncc1[C@@H]1CCC[N@H+](Cc2ccc(Cl)nc2)C1 ZINC001176990253 1052212881 /nfs/dbraw/zinc/21/28/81/1052212881.db2.gz FXESEWGZRAKMOK-OAHLLOKOSA-N 2 0 332.879 4.066 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cc(C)cc(Br)c2)C[C@H]1C ZINC000774903343 1052269989 /nfs/dbraw/zinc/26/99/89/1052269989.db2.gz MKSNUMMUCOJKBU-RHSMWYFYSA-N 2 0 339.321 4.062 20 0 EIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000171129374 1052395875 /nfs/dbraw/zinc/39/58/75/1052395875.db2.gz ZSOIHAHBPAQEGW-QGZVFWFLSA-N 2 0 326.484 4.386 20 0 EIADRP COc1cc(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)ccc1Cl ZINC000623348263 1052629340 /nfs/dbraw/zinc/62/93/40/1052629340.db2.gz XGXXZCNOGONEHP-UHFFFAOYSA-N 2 0 344.886 4.234 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CN[C@@H]1CC[NH+](C)C(C)(C)C1 ZINC000623357839 1052632561 /nfs/dbraw/zinc/63/25/61/1052632561.db2.gz CAZRBZRLHWWQQM-WIYYLYMNSA-N 2 0 343.559 4.023 20 0 EIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623487710 1052664363 /nfs/dbraw/zinc/66/43/63/1052664363.db2.gz NVIMUUGRBODESG-UKRRQHHQSA-N 2 0 328.422 4.099 20 0 EIADRP CC(C)Oc1cc(Cl)c(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)cc1Cl ZINC000623561037 1052680190 /nfs/dbraw/zinc/68/01/90/1052680190.db2.gz ZSFZCYNHMJHGBD-XBXGTLAGSA-N 2 0 345.314 4.210 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCCc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000178094527 1052699462 /nfs/dbraw/zinc/69/94/62/1052699462.db2.gz MDLFTGQJQCFNAL-VGOFRKELSA-N 2 0 338.495 4.355 20 0 EIADRP C[C@H]([NH2+][C@H](c1ccccc1)C1CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000178494153 1052707285 /nfs/dbraw/zinc/70/72/85/1052707285.db2.gz OKIJETOCNYEWEQ-HTAPYJJXSA-N 2 0 338.495 4.429 20 0 EIADRP CC(C)OCCCC[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000180463487 1052800977 /nfs/dbraw/zinc/80/09/77/1052800977.db2.gz UREQFCINUUQEPT-BHIFYINESA-N 2 0 344.543 4.082 20 0 EIADRP CC[C@H](C)Oc1cc(C[NH2+]C[C@@H](C)C[NH+]2CCCCC2)ccc1OC ZINC000624019772 1052853821 /nfs/dbraw/zinc/85/38/21/1052853821.db2.gz ZAKIFPTXTZLEKB-MSOLQXFVSA-N 2 0 348.531 4.084 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]C[C@H]2CCOC2(C)C)ccc1OC ZINC000850570788 1053324591 /nfs/dbraw/zinc/32/45/91/1053324591.db2.gz IWTBLYHAACMWCY-VQIMIIECSA-N 2 0 348.531 4.003 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cnn(-c2ccccc2)c1 ZINC000764960056 1053398889 /nfs/dbraw/zinc/39/88/89/1053398889.db2.gz CBYBRKQUXZKJQA-RBUKOAKNSA-N 2 0 340.515 4.035 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+](Cc1cc(Cl)cc(Cl)c1)CC2 ZINC001203810890 1053426819 /nfs/dbraw/zinc/42/68/19/1053426819.db2.gz CIDVTNINNOAYLH-UHFFFAOYSA-N 2 0 327.299 4.301 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)s1 ZINC000765305778 1053501779 /nfs/dbraw/zinc/50/17/79/1053501779.db2.gz QDVQWOMUCUCZMD-HZPDHXFCSA-N 2 0 332.513 4.409 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cnc3c(F)cccc3c2)c1 ZINC000865451539 1053511598 /nfs/dbraw/zinc/51/15/98/1053511598.db2.gz RIQFXWDAZVHAHZ-UHFFFAOYSA-N 2 0 337.442 4.115 20 0 EIADRP C[C@@H](C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1)c1cccc(F)c1 ZINC000765358984 1053514136 /nfs/dbraw/zinc/51/41/36/1053514136.db2.gz JLFRFOQWVDDVNN-DLBZAZTESA-N 2 0 344.474 4.220 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H](CCc2ccccc2)c2ccccn2)CC1 ZINC000866259464 1053666947 /nfs/dbraw/zinc/66/69/47/1053666947.db2.gz MPUOITCVXOJGTP-QFIPXVFZSA-N 2 0 337.511 4.077 20 0 EIADRP CN1CCC[C@H](C[NH2+][C@H](C2CCC2)[C@H]2CCCO2)[C@H]1c1cccs1 ZINC000866271590 1053671074 /nfs/dbraw/zinc/67/10/74/1053671074.db2.gz ANQJYFWZSCWSIL-LFGUQSLTSA-N 2 0 348.556 4.068 20 0 EIADRP COc1cccc(C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)c1 ZINC000386321891 1053679055 /nfs/dbraw/zinc/67/90/55/1053679055.db2.gz IPTNWEZEEYDFEY-OAQYLSRUSA-N 2 0 338.495 4.087 20 0 EIADRP C[C@H](CCc1cncc2ccccc21)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000866290745 1053681247 /nfs/dbraw/zinc/68/12/47/1053681247.db2.gz YFJKKRKDYPFSDR-QGZVFWFLSA-N 2 0 339.527 4.408 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CCc2ccco2)ccc1OC ZINC000121026454 1053697178 /nfs/dbraw/zinc/69/71/78/1053697178.db2.gz RQCLZPRCUPTINE-MRXNPFEDSA-N 2 0 330.472 4.023 20 0 EIADRP C[C@@H](CCc1cncc2ccccc21)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000866378510 1053711743 /nfs/dbraw/zinc/71/17/43/1053711743.db2.gz SRJBRZZFFNSOKD-DZIBYMRMSA-N 2 0 325.500 4.018 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)cc1OC ZINC000866517289 1053763530 /nfs/dbraw/zinc/76/35/30/1053763530.db2.gz GEPYKRIHJRJWJK-RTUIKWQQSA-N 2 0 348.531 4.048 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@H]2CC3(CCC3)Oc3ccccc32)CC1 ZINC000866515870 1053764204 /nfs/dbraw/zinc/76/42/04/1053764204.db2.gz KPAMFHFHESDWCU-IPCDKGFNSA-N 2 0 328.500 4.285 20 0 EIADRP C[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1nc2ccc(Cl)cc2n1C ZINC000866517449 1053764360 /nfs/dbraw/zinc/76/43/60/1053764360.db2.gz ZIJVKOVPMVFMNV-XIWWETDGSA-N 2 0 348.922 4.140 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]C2CCC(C)([NH+](C)C)CC2)C1 ZINC000866518132 1053765251 /nfs/dbraw/zinc/76/52/51/1053765251.db2.gz TVVYHTJJIAVIHX-HOIRFXKYSA-N 2 0 329.532 4.269 20 0 EIADRP CC(C)[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ccc2[nH]c(=O)oc2c1 ZINC000866515862 1053765646 /nfs/dbraw/zinc/76/56/46/1053765646.db2.gz KJHDFRWWKUVVMG-RVSXGSNBSA-N 2 0 345.487 4.083 20 0 EIADRP C[C@H]([NH2+][C@H]1CCc2ccccc2C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386546133 1053773380 /nfs/dbraw/zinc/77/33/80/1053773380.db2.gz SFZXELNJKSBGRT-NMNUPHIUSA-N 2 0 334.507 4.044 20 0 EIADRP Cc1ccc2c(c1)CC[C@H]2[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000765704672 1053850950 /nfs/dbraw/zinc/85/09/50/1053850950.db2.gz ZEQKDTGUVDKPLU-NZQKXSOJSA-N 2 0 334.507 4.137 20 0 EIADRP C[N@@H+](Cc1sccc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000338563850 1054031997 /nfs/dbraw/zinc/03/19/97/1054031997.db2.gz NXVRWEFAIHXHBJ-UHFFFAOYSA-N 2 0 335.904 4.145 20 0 EIADRP c1cc(C[NH+]2CCCCC2)cc(C[N@@H+]2CCCC[C@@]23CCCOC3)c1 ZINC001198830687 1054269275 /nfs/dbraw/zinc/26/92/75/1054269275.db2.gz WMUPCVPQPHHTBK-QFIPXVFZSA-N 2 0 342.527 4.208 20 0 EIADRP Cc1cc(C)c([C@@H](C)[N@@H+]2C[C@@]34C[NH+](C)C[C@]3(C2)CCCC4)c(C)c1 ZINC001198821550 1054273726 /nfs/dbraw/zinc/27/37/26/1054273726.db2.gz SSALMYGBKKHHAS-FCEUIQTBSA-N 2 0 326.528 4.481 20 0 EIADRP CC(C)COc1cccc(CN2C[C@]34C[N@H+](C)C[C@@]3(C2)CCCC4)c1 ZINC001198819671 1054275378 /nfs/dbraw/zinc/27/53/78/1054275378.db2.gz GJRDFEVYFPHNSH-SZPZYZBQSA-N 2 0 342.527 4.029 20 0 EIADRP C([NH2+][C@H]1CCOC2(CCCC2)C1)C1([NH+]2CCCCC2)CCCCC1 ZINC001198980594 1054318585 /nfs/dbraw/zinc/31/85/85/1054318585.db2.gz JJESQDNYQCFPMT-IBGZPJMESA-N 2 0 334.548 4.257 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+]Cc2cc3nc(Cl)ccc3s2)CC1 ZINC001199143158 1054350081 /nfs/dbraw/zinc/35/00/81/1054350081.db2.gz DFDPKBYSMLXTLQ-UHFFFAOYSA-N 2 0 337.920 4.160 20 0 EIADRP Clc1ccc2c(n1)[C@@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CC2 ZINC000857900987 1054380450 /nfs/dbraw/zinc/38/04/50/1054380450.db2.gz GRAPDYRFSHKVTC-SFHVURJKSA-N 2 0 341.886 4.108 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@H]2CCCc3ccccc3C2)C1 ZINC001199319972 1054390688 /nfs/dbraw/zinc/39/06/88/1054390688.db2.gz GJAGRXXJGCVLFZ-KNKQGSTJSA-N 2 0 328.544 4.282 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2cc(F)cc3cccnc32)C1 ZINC001199320663 1054390840 /nfs/dbraw/zinc/39/08/40/1054390840.db2.gz PIWKUODGFRSNJI-IAGOWNOFSA-N 2 0 343.490 4.222 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CC[C@@H](C)[C@H](C)C1 ZINC001199329098 1054392896 /nfs/dbraw/zinc/39/28/96/1054392896.db2.gz NEAYVFVJFIKHQO-QWFCFKBJSA-N 2 0 332.532 4.322 20 0 EIADRP CC(C)(C)[C@H](Cn1ccnc1)[NH2+]Cc1cnc(-c2cccs2)s1 ZINC001199608063 1054432165 /nfs/dbraw/zinc/43/21/65/1054432165.db2.gz BRSJLMLPPUVCPI-HNNXBMFYSA-N 2 0 346.525 4.273 20 0 EIADRP CC(C)[C@@H](C[NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccccc1 ZINC001199821655 1054480606 /nfs/dbraw/zinc/48/06/06/1054480606.db2.gz ACQIOGCTCYVHAL-OAQYLSRUSA-N 2 0 340.511 4.156 20 0 EIADRP CCSc1ccc([C@@H](C)[NH2+]Cc2cc3c(s2)CC[NH2+]C3)cc1 ZINC000873213026 1054510846 /nfs/dbraw/zinc/51/08/46/1054510846.db2.gz UPSDARIPYICXOX-CYBMUJFWSA-N 2 0 332.538 4.357 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc(SC(F)F)cc1 ZINC000873236770 1054512228 /nfs/dbraw/zinc/51/22/28/1054512228.db2.gz DIQKNCWDXITDBS-CYBMUJFWSA-N 2 0 348.462 4.498 20 0 EIADRP c1ccc2c(c1)CCC[C@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)C2 ZINC001200863752 1054558678 /nfs/dbraw/zinc/55/86/78/1054558678.db2.gz IUWMKZYQQSSQOL-NRFANRHFSA-N 2 0 326.528 4.321 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)CC1 ZINC000776166995 1054800838 /nfs/dbraw/zinc/80/08/38/1054800838.db2.gz ILFIWIHCYNKINZ-KRWDZBQOSA-N 2 0 338.467 4.230 20 0 EIADRP CCC(CC)C[NH+]1CCC2(CC1)C[N@H+](Cc1ccc(C)cc1)CCO2 ZINC001201528150 1054845438 /nfs/dbraw/zinc/84/54/38/1054845438.db2.gz KZKZMJVDFADHSO-UHFFFAOYSA-N 2 0 344.543 4.098 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3cc(F)ccc3N(C)C)CC2)CC1 ZINC001201608946 1054864127 /nfs/dbraw/zinc/86/41/27/1054864127.db2.gz SKNWOAKAMMFPFJ-UHFFFAOYSA-N 2 0 347.522 4.024 20 0 EIADRP CC[NH+]1CCC(CC2CC[NH+](CCCc3ccccc3)CC2)CC1 ZINC001201671793 1054872764 /nfs/dbraw/zinc/87/27/64/1054872764.db2.gz LVLBJQKGIGZIQP-UHFFFAOYSA-N 2 0 328.544 4.453 20 0 EIADRP C[N@H+](CCCc1ccccc1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001201673819 1054873118 /nfs/dbraw/zinc/87/31/18/1054873118.db2.gz QFIQUHKFQVOSKI-UHFFFAOYSA-N 2 0 336.523 4.463 20 0 EIADRP c1ccc(CCC[NH+]2CCC3(C[NH+](Cc4ccccc4)C3)CC2)cc1 ZINC001201674364 1054873489 /nfs/dbraw/zinc/87/34/89/1054873489.db2.gz YEZGDVSXZMGKNP-UHFFFAOYSA-N 2 0 334.507 4.217 20 0 EIADRP CS[C@@H]1CC[C@H]([NH2+][C@@H]2CCN(C3CC3)[C@H](c3ccccc3)C2)C1 ZINC000877070923 1055012481 /nfs/dbraw/zinc/01/24/81/1055012481.db2.gz YVAQTJYWMDZCNL-CUDHKJQZSA-N 2 0 330.541 4.228 20 0 EIADRP C[C@]1(C[NH2+]C/C=C/c2ccc(F)cc2)CC[N@H+](Cc2ccccc2)C1 ZINC001202221006 1055093595 /nfs/dbraw/zinc/09/35/95/1055093595.db2.gz XUTUWIFFHNUYMW-QNBZTBGESA-N 2 0 338.470 4.341 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)C1CCCC1 ZINC001202388582 1055146257 /nfs/dbraw/zinc/14/62/57/1055146257.db2.gz TWQDLAHSYUFRAJ-OAQYLSRUSA-N 2 0 330.516 4.220 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1cccnc1 ZINC000112528578 1055236302 /nfs/dbraw/zinc/23/63/02/1055236302.db2.gz XLAUUHRRRAYEAO-OTWHNJEPSA-N 2 0 337.511 4.410 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CC2CC[NH+](C)CC2)ccc1OCCC(C)C ZINC000765778760 1055272488 /nfs/dbraw/zinc/27/24/88/1055272488.db2.gz AHNLYAMTZNNLBL-QGZVFWFLSA-N 2 0 348.531 4.113 20 0 EIADRP C[C@H](NCc1cc(C(F)(F)F)co1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000878411522 1055293956 /nfs/dbraw/zinc/29/39/56/1055293956.db2.gz LHUJNKKRVBAIKM-STQMWFEESA-N 2 0 330.394 4.041 20 0 EIADRP CC1(C)OCc2cc(C[NH2+]CCCCC[NH+]3CCCCC3)ccc2O1 ZINC000186378103 1055418671 /nfs/dbraw/zinc/41/86/71/1055418671.db2.gz LZWFLMVLSFSHTJ-UHFFFAOYSA-N 2 0 346.515 4.078 20 0 EIADRP C[C@H](Cc1ccccn1)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000655833882 1055700413 /nfs/dbraw/zinc/70/04/13/1055700413.db2.gz HPYIVCXQYGLKPT-HOHBBMLPSA-N 2 0 337.511 4.045 20 0 EIADRP C[C@H](Cc1ccccn1)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000655834872 1055704625 /nfs/dbraw/zinc/70/46/25/1055704625.db2.gz SDAZVOQWCISRHT-QGZVFWFLSA-N 2 0 331.548 4.281 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@H](C)C2CCC(C(F)(F)F)CC2)CC1 ZINC000474481428 1055886001 /nfs/dbraw/zinc/88/60/01/1055886001.db2.gz VROSFSCHWSVNBD-QQFBHYJXSA-N 2 0 334.470 4.454 20 0 EIADRP CCN(c1ccccc1)c1ccc(C[NH2+]CC2CC[NH+](C)CC2)cc1 ZINC000742370061 1058576746 /nfs/dbraw/zinc/57/67/46/1058576746.db2.gz FAUXQMGZEHXWSG-UHFFFAOYSA-N 2 0 337.511 4.276 20 0 EIADRP C[C@H](CC[NH2+]Cc1ccc2cnccc2c1)[N@H+](C)Cc1ccccc1 ZINC000379641187 1060143097 /nfs/dbraw/zinc/14/30/97/1060143097.db2.gz CVVAESXBXDFIRZ-GOSISDBHSA-N 2 0 333.479 4.235 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)CCc2c(F)cccc2Cl)cc1 ZINC001168839081 1060451546 /nfs/dbraw/zinc/45/15/46/1060451546.db2.gz SDGORHDWQHBYEB-UHFFFAOYSA-N 2 0 334.866 4.215 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H]1CCCc3cc(Br)ccc31)C2 ZINC001169101516 1060636517 /nfs/dbraw/zinc/63/65/17/1060636517.db2.gz TZEYQEIFWNTAQB-DFGXFYAUSA-N 2 0 349.316 4.041 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CC(C)(c1ccccc1)c1ccccc1)C2 ZINC001169089554 1060643794 /nfs/dbraw/zinc/64/37/94/1060643794.db2.gz CPVBCJOHMCNHSX-DKUWSORSSA-N 2 0 334.507 4.207 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1c1ccc(N[C@@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)nc1 ZINC001169141794 1060663744 /nfs/dbraw/zinc/66/37/44/1060663744.db2.gz KWSLKQMCLDDPLD-DBXWQHBBSA-N 2 0 344.547 4.194 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CC[C@H](c3ccc(C(F)(F)F)cc3)C1)C2 ZINC001169147657 1060665340 /nfs/dbraw/zinc/66/53/40/1060665340.db2.gz VSUPYEFXNMBVGX-OWLYRPNTSA-N 2 0 338.417 4.120 20 0 EIADRP CC1(C)C[C@H](Nc2cc(N3CCCCC3)cc[nH+]2)C[C@](C)(C[NH3+])C1 ZINC001169147489 1060666486 /nfs/dbraw/zinc/66/64/86/1060666486.db2.gz XBRIIXYKLIQNTE-JXFKEZNVSA-N 2 0 330.520 4.028 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1ccc([C@@H]2CCC[NH2+]C2)cc1 ZINC001169689304 1060899526 /nfs/dbraw/zinc/89/95/26/1060899526.db2.gz HUPLRHCHWWCYML-WIYYLYMNSA-N 2 0 335.495 4.394 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)c(C)o1 ZINC000767361264 1061210364 /nfs/dbraw/zinc/21/03/64/1061210364.db2.gz LAOOBRKHYOQFHJ-UHFFFAOYSA-N 2 0 326.484 4.418 20 0 EIADRP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(Br)cc1 ZINC000036991668 522811892 /nfs/dbraw/zinc/81/18/92/522811892.db2.gz LVSRREZYZJLHHH-NPYXIHBLSA-N 2 0 337.305 4.115 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)sc1Br ZINC000512011437 1025715960 /nfs/dbraw/zinc/71/59/60/1025715960.db2.gz VUNJVCATZGETLG-XQQFMLRXSA-N 2 0 345.350 4.342 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@@H]3C)s2)cc1 ZINC000532249379 1032110145 /nfs/dbraw/zinc/11/01/45/1032110145.db2.gz WYXNNSZKMKCTEY-QMTMVMCOSA-N 2 0 344.524 4.242 20 0 EIADRP Fc1cc(C[NH2+]CCCCCCC[NH+]2CCCC2)cc(F)c1F ZINC000729682098 1032131732 /nfs/dbraw/zinc/13/17/32/1032131732.db2.gz LBHYEXWEWSCDPV-UHFFFAOYSA-N 2 0 328.422 4.240 20 0 EIADRP FC(F)(F)C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000459380380 1032142469 /nfs/dbraw/zinc/14/24/69/1032142469.db2.gz ZSNWKDWKSIVANP-GOSISDBHSA-N 2 0 349.400 4.334 20 0 EIADRP Cc1c2ccccc2oc1[C@H](C)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459383838 1032395631 /nfs/dbraw/zinc/39/56/31/1032395631.db2.gz FWEAZMUJIWRITL-INIZCTEOSA-N 2 0 335.451 4.456 20 0 EIADRP C[C@H]([NH2+][C@H]1CCN(Cc2ccccc2)CC1(C)C)C1CC(F)(F)C1 ZINC000529556104 1032452339 /nfs/dbraw/zinc/45/23/39/1032452339.db2.gz JTQAXXBMAOOBNC-YJBOKZPZSA-N 2 0 336.470 4.311 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc(Cl)c(N)c(Cl)c2)C1 ZINC000760161688 1032484590 /nfs/dbraw/zinc/48/45/90/1032484590.db2.gz ZDVFOMBJNWWUQH-CHWSQXEVSA-N 2 0 344.330 4.347 20 0 EIADRP CC(C)[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)CS1 ZINC000683108321 1018836034 /nfs/dbraw/zinc/83/60/34/1018836034.db2.gz BPQXJIZNJGCTKU-AQNXPRMDSA-N 2 0 332.557 4.018 20 0 EIADRP CCOc1ccc([C@H](CC)[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1OCC ZINC000643546046 1018897465 /nfs/dbraw/zinc/89/74/65/1018897465.db2.gz HITQEUCZHHHWOL-ROUUACIJSA-N 2 0 346.515 4.199 20 0 EIADRP CCOc1cccc2cc([C@H](C)N[C@H]3CC[NH2+]C4(CCC4)C3)oc21 ZINC000643547885 1018929288 /nfs/dbraw/zinc/92/92/88/1018929288.db2.gz KGTZSWXJQMKMJK-HOCLYGCPSA-N 2 0 328.456 4.157 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1ccc(Cl)cn1 ZINC000274928807 1019867892 /nfs/dbraw/zinc/86/78/92/1019867892.db2.gz QKRPMVDXCBDSCF-OAHLLOKOSA-N 2 0 331.891 4.426 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cccc3c[nH]nc32)CC1)CC(C)C ZINC000579887179 1020327842 /nfs/dbraw/zinc/32/78/42/1020327842.db2.gz QWGSXOFLEDZORE-UHFFFAOYSA-N 2 0 342.531 4.143 20 0 EIADRP CN(c1ccccc1)c1ccc(C[N@@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000683357891 1020380213 /nfs/dbraw/zinc/38/02/13/1020380213.db2.gz PIPBENXUWPYRGY-HXUWFJFHSA-N 2 0 337.511 4.371 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2nc3ccccc3s2)CC1 ZINC000510223424 1020501423 /nfs/dbraw/zinc/50/14/23/1020501423.db2.gz PWVXUQVPZCSPGF-UHFFFAOYSA-N 2 0 331.529 4.240 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CS1 ZINC000655710805 1020909128 /nfs/dbraw/zinc/90/91/28/1020909128.db2.gz FSTUBCMALRSBBL-XAOHYQHJSA-N 2 0 330.541 4.056 20 0 EIADRP Cc1ccc(-c2ncc(C[NH2+]CCCC[N@@H+](C)C3CC3)s2)cc1C ZINC000655792599 1020965310 /nfs/dbraw/zinc/96/53/10/1020965310.db2.gz MIOQNPSUGBCKRD-UHFFFAOYSA-N 2 0 343.540 4.391 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000655804783 1020972204 /nfs/dbraw/zinc/97/22/04/1020972204.db2.gz BKJDXRAYDDKWFZ-PWNZVWSESA-N 2 0 345.314 4.079 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000655804781 1020972610 /nfs/dbraw/zinc/97/26/10/1020972610.db2.gz BKJDXRAYDDKWFZ-BHPKHCPMSA-N 2 0 345.314 4.079 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000655805486 1020976071 /nfs/dbraw/zinc/97/60/71/1020976071.db2.gz OGTOPNYFPMCFJI-VOBQZIQPSA-N 2 0 346.877 4.498 20 0 EIADRP Cc1ccsc1CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000538116110 1021006097 /nfs/dbraw/zinc/00/60/97/1021006097.db2.gz DZHWNKNFWBEJFP-IEBWSBKVSA-N 2 0 328.525 4.099 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](c1cccc(F)c1)C(C)(C)C ZINC000422841876 1021649315 /nfs/dbraw/zinc/64/93/15/1021649315.db2.gz XAHGTZMFMGYEHR-IFXJQAMLSA-N 2 0 329.463 4.426 20 0 EIADRP C[C@H](c1cccnc1)[NH+](C)CCCCC[N@@H+](C)[C@H](C)c1cccnc1 ZINC000245537621 1033008373 /nfs/dbraw/zinc/00/83/73/1033008373.db2.gz MICZDEPOUZNDIT-RTBURBONSA-N 2 0 340.515 4.333 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+]CCc2cccc3ccccc32)cc1 ZINC000613260312 1021833085 /nfs/dbraw/zinc/83/30/85/1021833085.db2.gz NMTVTBAQBPIFTL-UHFFFAOYSA-N 2 0 348.490 4.113 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)c1cc(F)c(Cl)cc1Cl ZINC000377799699 1022011733 /nfs/dbraw/zinc/01/17/33/1022011733.db2.gz YFXZWOGTRIJNDI-RKDXNWHRSA-N 2 0 328.218 4.064 20 0 EIADRP CC[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccccc1OC(F)F ZINC000414172929 1022028840 /nfs/dbraw/zinc/02/88/40/1022028840.db2.gz FUCDELJDGFKITB-GDBMZVCRSA-N 2 0 326.431 4.061 20 0 EIADRP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414186493 1022073200 /nfs/dbraw/zinc/07/32/00/1022073200.db2.gz PBZYJVGPUMXIRN-CYBMUJFWSA-N 2 0 329.831 4.237 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414192273 1022092913 /nfs/dbraw/zinc/09/29/13/1022092913.db2.gz SWAICKQTGRIBCU-FQEVSTJZSA-N 2 0 330.435 4.291 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414197236 1022097507 /nfs/dbraw/zinc/09/75/07/1022097507.db2.gz XUVZLBLXYRBADR-HXUWFJFHSA-N 2 0 335.451 4.461 20 0 EIADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccc(OCC(F)(F)F)cc1 ZINC000414202822 1022123547 /nfs/dbraw/zinc/12/35/47/1022123547.db2.gz ZGTPHSNWUGHIHE-CABCVRRESA-N 2 0 344.421 4.010 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc(C[N@H+]3CCC[C@@H](C)C3)cc2)cnc1F ZINC000892574871 1022263370 /nfs/dbraw/zinc/26/33/70/1022263370.db2.gz OTAJSXGKRIWZPV-MRXNPFEDSA-N 2 0 341.474 4.051 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](C[C@@H]2CCCC23CCOCC3)C1 ZINC001167424093 1022314940 /nfs/dbraw/zinc/31/49/40/1022314940.db2.gz AXNRWPIMZJTFCO-NJYVYQBISA-N 2 0 348.575 4.170 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](C[C@@H]2CC(C)(C)OC2(C)C)C1 ZINC001167424514 1022318016 /nfs/dbraw/zinc/31/80/16/1022318016.db2.gz KUTWADINFHPBPO-QRVBRYPASA-N 2 0 336.564 4.167 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2coc(-c3cccc(F)c3)n2)CC1 ZINC000047978256 1022342210 /nfs/dbraw/zinc/34/22/10/1022342210.db2.gz IUQLKLVCBNRNAQ-UHFFFAOYSA-N 2 0 345.462 4.035 20 0 EIADRP CC(C)(C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccnc1 ZINC000414324209 1022543035 /nfs/dbraw/zinc/54/30/35/1022543035.db2.gz BCNMWZZGNNLELM-KOUNCHBCSA-N 2 0 349.522 4.144 20 0 EIADRP CCc1ccc(-c2ccc(C[NH2+]CCC3CC[NH+](C)CC3)o2)cc1 ZINC000465011669 1022571645 /nfs/dbraw/zinc/57/16/45/1022571645.db2.gz CSQJEYJHDALPLZ-UHFFFAOYSA-N 2 0 326.484 4.331 20 0 EIADRP C[C@@H](Cc1cn(C)c2ccc(F)cc12)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000414342751 1022651364 /nfs/dbraw/zinc/65/13/64/1022651364.db2.gz JHEBEAMWJMRPGG-HNNXBMFYSA-N 2 0 345.506 4.101 20 0 EIADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl ZINC000647552029 1022813053 /nfs/dbraw/zinc/81/30/53/1022813053.db2.gz ASLWTFYXRAWUGU-ZIAGYGMSSA-N 2 0 348.922 4.174 20 0 EIADRP CC[NH2+]CC1CC[NH+](Cc2csc(-c3ccc(CC)cc3)n2)CC1 ZINC000430576581 1023082558 /nfs/dbraw/zinc/08/25/58/1023082558.db2.gz SDZPLGCFINWBHQ-UHFFFAOYSA-N 2 0 343.540 4.194 20 0 EIADRP COc1ccc([C@@H]([NH2+]CCC2CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000180455630 1023227529 /nfs/dbraw/zinc/22/75/29/1023227529.db2.gz BPYSZUKQFNVMMO-QFIPXVFZSA-N 2 0 338.495 4.106 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)C1 ZINC000584819128 1023346000 /nfs/dbraw/zinc/34/60/00/1023346000.db2.gz DWIHZDUNRLXAJE-WIYYLYMNSA-N 2 0 326.459 4.041 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+]Cc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000415015656 1023391081 /nfs/dbraw/zinc/39/10/81/1023391081.db2.gz BBJQWCLMUXEXCO-JTQLQIEISA-N 2 0 344.311 4.334 20 0 EIADRP C[C@H](NCc1nsc2ccccc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000660258049 1023394453 /nfs/dbraw/zinc/39/44/53/1023394453.db2.gz YVVYQIVNLLVQSE-LSDHHAIUSA-N 2 0 329.513 4.039 20 0 EIADRP CCC[NH+]1CCC([N@H+](C)Cc2ccc(Br)cc2C)CC1 ZINC000510435170 1023398164 /nfs/dbraw/zinc/39/81/64/1023398164.db2.gz JCDMRFKTOACPKU-UHFFFAOYSA-N 2 0 339.321 4.064 20 0 EIADRP Cc1ccc(-c2ncc(C[N@@H+]3CCCC[C@@H]3[C@@H]3CC[NH2+]C3)s2)cc1 ZINC000415038596 1023404267 /nfs/dbraw/zinc/40/42/67/1023404267.db2.gz IABAIWHEXITKRM-IEBWSBKVSA-N 2 0 341.524 4.083 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc2c(c1)OCO2 ZINC000537942938 1033130452 /nfs/dbraw/zinc/13/04/52/1033130452.db2.gz VOKALKHYSXBCBE-IPJUCJBFSA-N 2 0 344.499 4.109 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1ccc(Br)s1)c1ccccc1 ZINC000415050602 1023409662 /nfs/dbraw/zinc/40/96/62/1023409662.db2.gz IUUHDOMTSQUJCN-AWEZNQCLSA-N 2 0 339.302 4.080 20 0 EIADRP Cc1ccc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1Br ZINC000415058120 1023410711 /nfs/dbraw/zinc/41/07/11/1023410711.db2.gz SMMXTEUSOJDBMD-GOSISDBHSA-N 2 0 347.300 4.327 20 0 EIADRP CCO[C@@H]1C[C@H]([N@H+](C)Cc2cccc(C[NH+]3CCCCC3)c2)C1(C)C ZINC001167473935 1023426219 /nfs/dbraw/zinc/42/62/19/1023426219.db2.gz NOZIBWOICQMNIT-LEWJYISDSA-N 2 0 344.543 4.308 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000415089950 1023434245 /nfs/dbraw/zinc/43/42/45/1023434245.db2.gz ZJKNXLXKIQGKLN-RVKKMQEKSA-N 2 0 343.540 4.466 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cccc(Cl)c1 ZINC000656683546 1023439483 /nfs/dbraw/zinc/43/94/83/1023439483.db2.gz NDAYWABDTBGLJF-MRXNPFEDSA-N 2 0 343.902 4.298 20 0 EIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+][C@H]2COC(C)(C)C2)cc1 ZINC000417863832 1023439695 /nfs/dbraw/zinc/43/96/95/1023439695.db2.gz SWBGBIZBILJNJG-HXUWFJFHSA-N 2 0 338.495 4.072 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+]Cc3cccc4[nH]ccc43)CC2)c1 ZINC000236742994 1023485099 /nfs/dbraw/zinc/48/50/99/1023485099.db2.gz RHOORDOSCITQSM-UHFFFAOYSA-N 2 0 339.508 4.231 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Br)c(C)c2)C[C@@H]1C ZINC000500088699 1023494147 /nfs/dbraw/zinc/49/41/47/1023494147.db2.gz FQDAPNMFPWXYDZ-GOEBONIOSA-N 2 0 339.321 4.062 20 0 EIADRP Cc1oc(-c2cccs2)nc1C[N@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000377401413 1023511083 /nfs/dbraw/zinc/51/10/83/1023511083.db2.gz OKJBGTMRTVQPOI-UHFFFAOYSA-N 2 0 345.512 4.019 20 0 EIADRP c1nc(C2CCCC2)sc1C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656782686 1023517843 /nfs/dbraw/zinc/51/78/43/1023517843.db2.gz ILSXHWJFFWQFLA-KRWDZBQOSA-N 2 0 333.545 4.012 20 0 EIADRP Clc1cc2cccnc2c(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)c1 ZINC000656784759 1023528571 /nfs/dbraw/zinc/52/85/71/1023528571.db2.gz CDJSWECQVRUBRD-QGZVFWFLSA-N 2 0 343.902 4.100 20 0 EIADRP c1csc(-c2nc(C[N@@H+]3CCC[C@H](C4CC[NH2+]CC4)C3)cs2)c1 ZINC000656783983 1023529380 /nfs/dbraw/zinc/52/93/80/1023529380.db2.gz BYPICGGRUOXIQK-HNNXBMFYSA-N 2 0 347.553 4.083 20 0 EIADRP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)C1 ZINC000684369841 1023540153 /nfs/dbraw/zinc/54/01/53/1023540153.db2.gz BYKOLPKQRJCXQU-JRGCBEDISA-N 2 0 330.516 4.108 20 0 EIADRP C[C@@]1(C[NH2+]Cc2ccc3cnccc3c2)CCCN1Cc1ccccc1 ZINC000397914471 1023588077 /nfs/dbraw/zinc/58/80/77/1023588077.db2.gz GAIIAFQKVGOVAD-QHCPKHFHSA-N 2 0 345.490 4.379 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCCCC1(F)F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000394556586 1023606860 /nfs/dbraw/zinc/60/68/60/1023606860.db2.gz IXSPKLHYOKXVBD-QXAKKESOSA-N 2 0 336.470 4.312 20 0 EIADRP CCC1(C[NH2+][C@H]2CCC[C@H](OC)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000684388553 1023616718 /nfs/dbraw/zinc/61/67/18/1023616718.db2.gz UPXBXRQFFHQCAA-SFTDATJTSA-N 2 0 344.543 4.226 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H](C)c1cnc(C)s1 ZINC000090403137 1023620550 /nfs/dbraw/zinc/62/05/50/1023620550.db2.gz JOLNPHZWJYPDMN-OAHLLOKOSA-N 2 0 347.528 4.023 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCNc1ccc(F)c(C[NH+]2CCCC2)c1 ZINC001167753035 1023629277 /nfs/dbraw/zinc/62/92/77/1023629277.db2.gz AWGDZHPKNVOKFZ-KRWDZBQOSA-N 2 0 333.495 4.098 20 0 EIADRP CCCOc1ccc(C[NH+]2CCC(CC[NH+](C)C)CC2)cc1OCC ZINC000511526671 1023635646 /nfs/dbraw/zinc/63/56/46/1023635646.db2.gz QMACLCRFPUCJPB-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2c(c1)CCC2 ZINC000398017872 1023643356 /nfs/dbraw/zinc/64/33/56/1023643356.db2.gz IIXQUYISKOXQAP-JPYJTQIMSA-N 2 0 334.507 4.176 20 0 EIADRP CC(C)=CCC[C@@H](C)CC[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000377705707 1023699239 /nfs/dbraw/zinc/69/92/39/1023699239.db2.gz XUIFIVFLNYDGDL-IZCSPVGOSA-N 2 0 347.591 4.002 20 0 EIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1N[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000390625717 1023735616 /nfs/dbraw/zinc/73/56/16/1023735616.db2.gz HXFSLUXDESUTEZ-FKBYEOEOSA-N 2 0 349.522 4.022 20 0 EIADRP Cn1cncc1CC[NH2+][C@H](CCCc1ccccc1)c1ccccc1 ZINC000471763864 1023818653 /nfs/dbraw/zinc/81/86/53/1023818653.db2.gz XTXFGUUBAVCISG-JOCHJYFZSA-N 2 0 333.479 4.316 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000500426892 1023822133 /nfs/dbraw/zinc/82/21/33/1023822133.db2.gz HEAJOVMDEXPFDW-SVFBPWRDSA-N 2 0 329.532 4.065 20 0 EIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@H]2CCCC23CCOCC3)c1 ZINC000500426716 1023822593 /nfs/dbraw/zinc/82/25/93/1023822593.db2.gz ITMIUWOKQLZIQQ-NRFANRHFSA-N 2 0 342.527 4.111 20 0 EIADRP FC1(F)CC[C@H](C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000430750923 1024007285 /nfs/dbraw/zinc/00/72/85/1024007285.db2.gz QOJRTGZZCGJBAI-LWYYNNOASA-N 2 0 348.481 4.312 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CCC[NH+]1CCCC1 ZINC000510667447 1024203054 /nfs/dbraw/zinc/20/30/54/1024203054.db2.gz HFUQJEBGPVDCOV-OAHLLOKOSA-N 2 0 328.422 4.102 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1cncs1 ZINC000164500884 1024464573 /nfs/dbraw/zinc/46/45/73/1024464573.db2.gz CPDDZYTXPJIGSV-OAHLLOKOSA-N 2 0 341.480 4.219 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@H](C)C[C@@H]1c1ccccc1 ZINC000348835693 1024722844 /nfs/dbraw/zinc/72/28/44/1024722844.db2.gz AVRCSSOZFISROU-IIBYNOLFSA-N 2 0 332.451 4.159 20 0 EIADRP C[N@H+](CCCCC(F)(F)F)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000092821308 1024813010 /nfs/dbraw/zinc/81/30/10/1024813010.db2.gz IBSOIHHCVMADAT-UHFFFAOYSA-N 2 0 343.437 4.353 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)o1 ZINC000548482335 1024826439 /nfs/dbraw/zinc/82/64/39/1024826439.db2.gz GDXCIRCCZXLUCZ-CUWPLCDZSA-N 2 0 340.511 4.409 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CC3c4ccccc4C2c2ccccc23)CC[N@@H+]1C ZINC000246937136 1024864305 /nfs/dbraw/zinc/86/43/05/1024864305.db2.gz HKSRUBZRQXHUFG-JRHJTHGVSA-N 2 0 346.518 4.356 20 0 EIADRP FC(F)(F)CC[N@H+](Cc1ccccc1)Cc1cccc2c1CC[NH2+]C2 ZINC000662277005 1025020275 /nfs/dbraw/zinc/02/02/75/1025020275.db2.gz CISHOVFYGLYLIV-UHFFFAOYSA-N 2 0 348.412 4.287 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc(Cl)cc1Cl ZINC000662283800 1025031237 /nfs/dbraw/zinc/03/12/37/1025031237.db2.gz VLNUIRMLWGKFDT-GFCCVEGCSA-N 2 0 335.278 4.490 20 0 EIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](Cc3ccnc4ccccc34)C2)CC1 ZINC000535826696 1025074852 /nfs/dbraw/zinc/07/48/52/1025074852.db2.gz SCZQCVQVWPAHFG-IBGZPJMESA-N 2 0 337.511 4.179 20 0 EIADRP c1cncc([C@H]([NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)C2CCCCC2)c1 ZINC000663467014 1025402063 /nfs/dbraw/zinc/40/20/63/1025402063.db2.gz YZWZURYEBFPYEW-DENIHFKCSA-N 2 0 341.543 4.415 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cnc2ccsc2c1 ZINC000663470613 1025418787 /nfs/dbraw/zinc/41/87/87/1025418787.db2.gz VMOQNMWCNJMMKX-GDBMZVCRSA-N 2 0 329.513 4.069 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)CC(F)(F)F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000663478479 1025466978 /nfs/dbraw/zinc/46/69/78/1025466978.db2.gz RENAFAOTWRLTKD-DOTOQJQBSA-N 2 0 342.449 4.465 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]Cc2cc(O)cc(F)c2)cc1 ZINC000472040312 1025474230 /nfs/dbraw/zinc/47/42/30/1025474230.db2.gz BUNXJUUZQJURKL-INIZCTEOSA-N 2 0 342.458 4.196 20 0 EIADRP c1c2ccccc2[nH]c1CC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000090577239 1025484467 /nfs/dbraw/zinc/48/44/67/1025484467.db2.gz ODTXDMWXSANBQE-UHFFFAOYSA-N 2 0 325.500 4.097 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@@H]1c1ccc(OC)c(OC)c1 ZINC001167825467 1025605319 /nfs/dbraw/zinc/60/53/19/1025605319.db2.gz JHQOVICCIUBRFH-PKOBYXMFSA-N 2 0 348.531 4.351 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(Oc2ccc(C)cc2)CC1 ZINC001167827441 1025657712 /nfs/dbraw/zinc/65/77/12/1025657712.db2.gz WBHXOCGKGJCZTF-IBGZPJMESA-N 2 0 332.532 4.349 20 0 EIADRP Cc1cc([C@@H](C)[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)sc1Br ZINC000643547894 1025751423 /nfs/dbraw/zinc/75/14/23/1025751423.db2.gz KKIYIDIBJDKESO-VXGBXAGGSA-N 2 0 343.334 4.144 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cc2ccncc2s1 ZINC000657298340 1025795565 /nfs/dbraw/zinc/79/55/65/1025795565.db2.gz SKBWUSNMPQYXKC-UHFFFAOYSA-N 2 0 339.508 4.428 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(n2cnc3ccccc32)CC1 ZINC001167833964 1025808553 /nfs/dbraw/zinc/80/85/53/1025808553.db2.gz GPBDWENBPMGJJQ-SFHVURJKSA-N 2 0 342.531 4.184 20 0 EIADRP CC[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1cccc(Cl)c1 ZINC000319750397 1025815932 /nfs/dbraw/zinc/81/59/32/1025815932.db2.gz UMMWUJZGBKYPIA-IBGZPJMESA-N 2 0 329.875 4.445 20 0 EIADRP CC[C@H]1C[C@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)CO1 ZINC000657304322 1025838564 /nfs/dbraw/zinc/83/85/64/1025838564.db2.gz YKRJZRDOGBWOPC-SFTDATJTSA-N 2 0 338.495 4.072 20 0 EIADRP CCc1ccc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)cn1 ZINC000512047151 1025843859 /nfs/dbraw/zinc/84/38/59/1025843859.db2.gz XRMRDKQSQYBOHP-UYAOXDASSA-N 2 0 337.511 4.034 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CC2(CC(OCc3ccccc3)C2)C1 ZINC001167836767 1025846631 /nfs/dbraw/zinc/84/66/31/1025846631.db2.gz GWAQOAAFKFSLET-LJQANCHMSA-N 2 0 344.543 4.178 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC2(CC1)OCCc1ccccc12 ZINC001167836781 1025846975 /nfs/dbraw/zinc/84/69/75/1025846975.db2.gz HCBKDJSMCYPUNZ-LJQANCHMSA-N 2 0 344.543 4.061 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1ccc(OCc2cccc(F)c2)cc1 ZINC000415014885 1025856519 /nfs/dbraw/zinc/85/65/19/1025856519.db2.gz NMJRNSOWTZZKEQ-INIZCTEOSA-N 2 0 330.447 4.012 20 0 EIADRP CC[C@H](C)Oc1cc(C[N@H+](C)[C@@H]2CC[NH+](CC)C[C@@H]2C)ccc1OC ZINC000130479214 1025872723 /nfs/dbraw/zinc/87/27/23/1025872723.db2.gz UAWIULJMYFJLLA-JENIJYKNSA-N 2 0 348.531 4.035 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)c1cnn(C)c1 ZINC000157653428 1025906756 /nfs/dbraw/zinc/90/67/56/1025906756.db2.gz WXIFTLYPYRJPKO-UWJYYQICSA-N 2 0 340.515 4.035 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCC4)C1 ZINC000431333172 1025923751 /nfs/dbraw/zinc/92/37/51/1025923751.db2.gz MWJLVVBLPPQEQJ-DYESRHJHSA-N 2 0 342.527 4.099 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167968912 1025936556 /nfs/dbraw/zinc/93/65/56/1025936556.db2.gz WSJOZLHANZAXER-VHRCFOOQSA-N 2 0 339.527 4.000 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCC[NH2+]1)c1ccc(C(F)(F)F)cc1 ZINC000415114445 1025979725 /nfs/dbraw/zinc/97/97/25/1025979725.db2.gz XTPASHBJPWWOON-BNEJOLLZSA-N 2 0 340.433 4.319 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+]Cc2ccc(C3CCC3)cc2)c1 ZINC000550098155 1026094662 /nfs/dbraw/zinc/09/46/62/1026094662.db2.gz YGBPDBOCHWCNOV-UHFFFAOYSA-N 2 0 338.495 4.184 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3ccc(F)cc32)c1 ZINC000344181386 1026099545 /nfs/dbraw/zinc/09/95/45/1026099545.db2.gz ZJFRTRFIFWEDLM-NRFANRHFSA-N 2 0 326.459 4.445 20 0 EIADRP CC1CC[NH+](CCC[C@H]([NH2+]C[C@H]2CCCO2)c2ccc(F)cc2)CC1 ZINC000344182325 1026102897 /nfs/dbraw/zinc/10/28/97/1026102897.db2.gz HBEQBOARFGLJLE-RTWAWAEBSA-N 2 0 348.506 4.148 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000511075249 1026188765 /nfs/dbraw/zinc/18/87/65/1026188765.db2.gz RGDCFJQBNDXMSG-FXAWDEMLSA-N 2 0 336.470 4.423 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]CC3=CC[N@H+](C)CC3)cs2)cs1 ZINC000344291993 1026219832 /nfs/dbraw/zinc/21/98/32/1026219832.db2.gz NLUHAWMUNJNWLH-GFCCVEGCSA-N 2 0 333.526 4.093 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C3CCC3)cc2)[C@@H](C)C1 ZINC000550138374 1026223248 /nfs/dbraw/zinc/22/32/48/1026223248.db2.gz DKRAVRWHUSBTAN-PGRDOPGGSA-N 2 0 344.543 4.181 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCCOc3c(Cl)c(Cl)ccc32)CC1 ZINC000344307601 1026230777 /nfs/dbraw/zinc/23/07/77/1026230777.db2.gz XEZLEJIGMYBFIN-HNNXBMFYSA-N 2 0 341.282 4.059 20 0 EIADRP CC[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)cc1 ZINC000320102672 1026350406 /nfs/dbraw/zinc/35/04/06/1026350406.db2.gz QLAHILMXKGENAS-LJQANCHMSA-N 2 0 329.875 4.445 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2cccc(OCc3ccccc3)c2)CC1 ZINC000514098048 1026422658 /nfs/dbraw/zinc/42/26/58/1026422658.db2.gz CWJMSZZHVAHCLU-UHFFFAOYSA-N 2 0 338.495 4.228 20 0 EIADRP CCC(CC)[N@H+](CC(C)C)C[C@@H]1CN(Cc2ccccc2)CCCO1 ZINC001167562662 1026435376 /nfs/dbraw/zinc/43/53/76/1026435376.db2.gz OJUXEPQJLHZRJY-QFIPXVFZSA-N 2 0 346.559 4.424 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cccc3[nH]ccc32)C1 ZINC000512210345 1026470926 /nfs/dbraw/zinc/47/09/26/1026470926.db2.gz CRSIVWJQOHJUJC-ZWKOTPCHSA-N 2 0 325.500 4.254 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cc(C)nc3ccccc23)CC1 ZINC000506860109 1026478765 /nfs/dbraw/zinc/47/87/65/1026478765.db2.gz HOCWSRGOUQOEME-UHFFFAOYSA-N 2 0 325.500 4.097 20 0 EIADRP CCOc1ccc(C[NH+]2CCC(C[NH+](CC)CC)CC2)cc1OCC ZINC000506906937 1026505493 /nfs/dbraw/zinc/50/54/93/1026505493.db2.gz DWQVEPAITMKWFE-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP CO[C@H](CC(C)C)C[N@H+](C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC001167571827 1026584907 /nfs/dbraw/zinc/58/49/07/1026584907.db2.gz BAVWZTYANQEMTE-HLAWJBBLSA-N 2 0 332.532 4.032 20 0 EIADRP Cc1cccc2[nH]c(C[NH2+][C@H](C)[C@H]3CCC[N@@H+](C4CCC4)C3)cc21 ZINC000657428874 1026629453 /nfs/dbraw/zinc/62/94/53/1026629453.db2.gz CQLSRBFZCNQMFZ-SJORKVTESA-N 2 0 325.500 4.219 20 0 EIADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC(C)(c2nc3ccccc3s2)CC1 ZINC000511128567 1026658441 /nfs/dbraw/zinc/65/84/41/1026658441.db2.gz XLDQWOPHMLTJSY-INIZCTEOSA-N 2 0 343.540 4.134 20 0 EIADRP CCOc1ccccc1[C@H](C)N[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512330904 1026710551 /nfs/dbraw/zinc/71/05/51/1026710551.db2.gz VVLQVQPPLDAPRY-BZSNNMDCSA-N 2 0 330.516 4.389 20 0 EIADRP C[C@H](NC1CC[NH+](C2CCCCC2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512333832 1026724294 /nfs/dbraw/zinc/72/42/94/1026724294.db2.gz XOSKDQZJOVRKRN-OALUTQOASA-N 2 0 347.591 4.026 20 0 EIADRP C[C@@H](NC1CC[NH+](C2CCCCC2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512333831 1026724789 /nfs/dbraw/zinc/72/47/89/1026724789.db2.gz XOSKDQZJOVRKRN-MOPGFXCFSA-N 2 0 347.591 4.026 20 0 EIADRP C[NH+](C)C[C@@]12C[C@@H]1C[N@H+](CC(C)(C)Sc1ccc(Cl)cc1)C2 ZINC001207299782 1026731724 /nfs/dbraw/zinc/73/17/24/1026731724.db2.gz QASRDPQQXKGKHO-RDTXWAMCSA-N 2 0 338.948 4.094 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1ccccn1 ZINC000159053416 1026744658 /nfs/dbraw/zinc/74/46/58/1026744658.db2.gz VVRJBFBJFZSCPO-INIZCTEOSA-N 2 0 343.902 4.298 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000507440704 1026802478 /nfs/dbraw/zinc/80/24/78/1026802478.db2.gz ITUORMSBCQHZTN-QGZVFWFLSA-N 2 0 340.433 4.478 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cccc2cnccc21 ZINC000236913921 1026812376 /nfs/dbraw/zinc/81/23/76/1026812376.db2.gz IXMPPIJUMXHKKV-UHFFFAOYSA-N 2 0 333.479 4.366 20 0 EIADRP CCC[NH+]1CCC(N(C)CCOc2cc(Cl)cc(Cl)c2)CC1 ZINC001167585685 1026825072 /nfs/dbraw/zinc/82/50/72/1026825072.db2.gz ADWMZACGGXLGOS-UHFFFAOYSA-N 2 0 345.314 4.178 20 0 EIADRP C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)C1(c2ccccc2)CCCC1 ZINC000582629543 1026881262 /nfs/dbraw/zinc/88/12/62/1026881262.db2.gz IKZFRJQSVPHGKL-PELRDEGISA-N 2 0 326.528 4.493 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CCCc3cccnc32)C[N@@H+]1Cc1ccccc1 ZINC000684960973 1026899874 /nfs/dbraw/zinc/89/98/74/1026899874.db2.gz VVQREQUABORPIE-KAGYGMCKSA-N 2 0 349.522 4.349 20 0 EIADRP Cc1nccn1CCCCS[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000582666648 1026920432 /nfs/dbraw/zinc/92/04/32/1026920432.db2.gz XMZHRKWKBNMEPR-HXUWFJFHSA-N 2 0 343.540 4.370 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)C1CCOCC1 ZINC000474483446 1027120706 /nfs/dbraw/zinc/12/07/06/1027120706.db2.gz AAALBMQDAJBZBG-CEXWTWQISA-N 2 0 344.543 4.069 20 0 EIADRP CS[C@@H]1CCCC[NH+](CC(C)C[N@H+]2CCCC[C@@H](SC)C2)C1 ZINC000441136043 1027299146 /nfs/dbraw/zinc/29/91/46/1027299146.db2.gz UXTYYTNSAHFJQD-QZTJIDSGSA-N 2 0 344.634 4.058 20 0 EIADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1cc2ccnc(Cl)c2s1 ZINC000894904199 1027407284 /nfs/dbraw/zinc/40/72/84/1027407284.db2.gz GEBLUCMVWFKFTK-UHFFFAOYSA-N 2 0 325.909 4.160 20 0 EIADRP CC(C)Sc1cccc(Cl)c1C[NH2+]CC1CC[NH+](C)CC1 ZINC000474713251 1027433817 /nfs/dbraw/zinc/43/38/17/1027433817.db2.gz LMJCOQSANREEKL-UHFFFAOYSA-N 2 0 326.937 4.272 20 0 EIADRP CC1(C)CC([NH3+])CC(C)(C)N1c1cc(OCc2ccccc2)cc[nH+]1 ZINC001167624845 1027443325 /nfs/dbraw/zinc/44/33/25/1027443325.db2.gz BRPPNROHBLXMCU-UHFFFAOYSA-N 2 0 339.483 4.145 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCCCc2cccc(C(F)(F)F)c2)CC[N@@H+]1C ZINC000474818034 1027541259 /nfs/dbraw/zinc/54/12/59/1027541259.db2.gz RJOIYUWTFAWKDB-PBHICJAKSA-N 2 0 328.422 4.100 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(Cl)s1 ZINC000120861069 1027596543 /nfs/dbraw/zinc/59/65/43/1027596543.db2.gz NEPGNMRUYHGBBQ-NSHDSACASA-N 2 0 326.868 4.453 20 0 EIADRP Cc1ccc(C[NH+]2CCCCC2)cc1N(C(N)=[NH2+])c1ccc(F)cc1 ZINC001167994846 1027735687 /nfs/dbraw/zinc/73/56/87/1027735687.db2.gz PKTOGXWIRHJMBV-UHFFFAOYSA-N 2 0 340.446 4.152 20 0 EIADRP Fc1ccccc1[C@H]1CCC[N@@H+]1C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995701 1027799558 /nfs/dbraw/zinc/79/95/58/1027799558.db2.gz OKIOBKOBZDXGBS-PGGWPXBNSA-N 2 0 328.475 4.368 20 0 EIADRP CC[N@H+](C)C[C@@H]1CCN(c2cc[nH+]c3cc(C(F)(F)F)ccc32)C1 ZINC000125653733 1027881566 /nfs/dbraw/zinc/88/15/66/1027881566.db2.gz MADRLPMPTDQWFC-ZDUSSCGKSA-N 2 0 337.389 4.032 20 0 EIADRP FC(F)(F)c1cccc([C@H]2CC[N@H+](CCC[NH+]3CCCCC3)C2)c1 ZINC000444608392 1027887321 /nfs/dbraw/zinc/88/73/21/1027887321.db2.gz KZMSAEGABOJFSG-KRWDZBQOSA-N 2 0 340.433 4.371 20 0 EIADRP c1cc(-c2ccc(C[N@H+]3CC[C@H](C[NH+]4CCCC4)C3)cc2)cs1 ZINC000444650117 1027920389 /nfs/dbraw/zinc/92/03/89/1027920389.db2.gz CHXCNLDLOGDBCP-GOSISDBHSA-N 2 0 326.509 4.333 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C[C@H]1CC[N@@H+](C(C)C)C1 ZINC000548786338 1027932630 /nfs/dbraw/zinc/93/26/30/1027932630.db2.gz KJQZTKGRJGTALY-DDITZMBXSA-N 2 0 340.433 4.429 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000188657866 1028015569 /nfs/dbraw/zinc/01/55/69/1028015569.db2.gz FWUYJXWUEOMHOY-KEYYUXOJSA-N 2 0 340.433 4.055 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(OC)c(OC)c1 ZINC000123639737 1028084046 /nfs/dbraw/zinc/08/40/46/1028084046.db2.gz NADZHLOMDWOUSV-IBGZPJMESA-N 2 0 342.483 4.006 20 0 EIADRP COc1cc([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)ccc1SC ZINC000123685969 1028092870 /nfs/dbraw/zinc/09/28/70/1028092870.db2.gz DWWOCEOSFWKKRN-HNNXBMFYSA-N 2 0 344.524 4.330 20 0 EIADRP CC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@@H](C)c1ccc(F)cc1 ZINC000346142142 1028280134 /nfs/dbraw/zinc/28/01/34/1028280134.db2.gz ACBMKYVCDDNBAO-INIZCTEOSA-N 2 0 338.430 4.298 20 0 EIADRP CC(C)n1nccc1C[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000281010026 1028335682 /nfs/dbraw/zinc/33/56/82/1028335682.db2.gz WSIHYSPVKFUCTF-UHFFFAOYSA-N 2 0 340.515 4.130 20 0 EIADRP FC1(F)CC[C@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000281080523 1028378426 /nfs/dbraw/zinc/37/84/26/1028378426.db2.gz JGEPWXACDHOWRX-OKYOBFRVSA-N 2 0 334.454 4.207 20 0 EIADRP Cc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)C[C@@H]3CCC(F)(F)C3)C2)s1 ZINC000583325120 1028517419 /nfs/dbraw/zinc/51/74/19/1028517419.db2.gz APPVRYBLUIIIQQ-HZPDHXFCSA-N 2 0 342.499 4.246 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CC2 ZINC000162910768 1028536937 /nfs/dbraw/zinc/53/69/37/1028536937.db2.gz MELZEXGJCUGBCM-QFIPXVFZSA-N 2 0 336.479 4.068 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](c1cncc(F)c1)C1CC1 ZINC000281380521 1028552908 /nfs/dbraw/zinc/55/29/08/1028552908.db2.gz XERIULIHOLIKLO-OAQYLSRUSA-N 2 0 341.474 4.303 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)CC[N@@H+]1C ZINC000443983777 1028692183 /nfs/dbraw/zinc/69/21/83/1028692183.db2.gz FXZFFQDJODLJKW-QAPCUYQASA-N 2 0 328.431 4.190 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cc(Cl)cc3cccnc32)CC1 ZINC000524156082 1028720609 /nfs/dbraw/zinc/72/06/09/1028720609.db2.gz HURAOPRYPBCFON-UHFFFAOYSA-N 2 0 345.918 4.440 20 0 EIADRP CC(=O)c1c(C)cc(C)c(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)c1C ZINC000524156136 1028723557 /nfs/dbraw/zinc/72/35/57/1028723557.db2.gz MMOOAIKVDZFNPL-UHFFFAOYSA-N 2 0 344.543 4.367 20 0 EIADRP C[C@H](c1cccnc1)[N@H+](C)CCCCC[NH+](C)[C@@H](C)c1cccnc1 ZINC000093234348 1028728786 /nfs/dbraw/zinc/72/87/86/1028728786.db2.gz MICZDEPOUZNDIT-KDURUIRLSA-N 2 0 340.515 4.333 20 0 EIADRP COc1cc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)ccc1F ZINC000152722948 1028831609 /nfs/dbraw/zinc/83/16/09/1028831609.db2.gz HPYJRNTUGJBCSH-INIZCTEOSA-N 2 0 342.458 4.281 20 0 EIADRP C[C@@H](C[NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(C(F)(F)F)cc1 ZINC000650716756 1028870137 /nfs/dbraw/zinc/87/01/37/1028870137.db2.gz INQBRJWUORLYGH-LBPRGKRZSA-N 2 0 340.364 4.197 20 0 EIADRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc2ccccc2c1OC(F)F ZINC000650743516 1029052729 /nfs/dbraw/zinc/05/27/29/1029052729.db2.gz VJFQRYSNTOVINR-CYBMUJFWSA-N 2 0 334.410 4.221 20 0 EIADRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000650744607 1029060487 /nfs/dbraw/zinc/06/04/87/1029060487.db2.gz RQQCNGSWQXSTGL-MRXNPFEDSA-N 2 0 342.458 4.184 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)ccc1F ZINC000129935388 1029106978 /nfs/dbraw/zinc/10/69/78/1029106978.db2.gz RXGIOMDUIBTWLY-LSDHHAIUSA-N 2 0 332.385 4.098 20 0 EIADRP COCCC1CC[NH+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001168053296 1029158019 /nfs/dbraw/zinc/15/80/19/1029158019.db2.gz NCYBYCFUKZHZEF-RTBURBONSA-N 2 0 344.543 4.177 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H]1CCSc2cc(C)c(C)cc21 ZINC000650756644 1029196247 /nfs/dbraw/zinc/19/62/47/1029196247.db2.gz GUXRSFFSIRUMIJ-IBGZPJMESA-N 2 0 326.509 4.350 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCCOc2c(C)cc(Cl)cc21 ZINC000650757098 1029201801 /nfs/dbraw/zinc/20/18/01/1029201801.db2.gz OUQUYHSCYUHUML-LJQANCHMSA-N 2 0 344.886 4.371 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000650757175 1029202477 /nfs/dbraw/zinc/20/24/77/1029202477.db2.gz QLHNZNXXRAEEFF-QGZVFWFLSA-N 2 0 335.278 4.490 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CCSCc2cccc3ccccc32)CC[N@@H+]1C ZINC000151159484 1029217986 /nfs/dbraw/zinc/21/79/86/1029217986.db2.gz QMXJVMOVDKUQIQ-LPHOPBHVSA-N 2 0 328.525 4.145 20 0 EIADRP COc1cccc2c1CCC[C@@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000583851023 1029274795 /nfs/dbraw/zinc/27/47/95/1029274795.db2.gz PBTHIWMBESKENH-NRFANRHFSA-N 2 0 342.527 4.459 20 0 EIADRP c1cc2cc(C[NH2+]CC3CC[NH+](Cc4ccccc4)CC3)ccc2[nH]1 ZINC000397707607 1029288346 /nfs/dbraw/zinc/28/83/46/1029288346.db2.gz XVUWIOZTNYCRPO-UHFFFAOYSA-N 2 0 333.479 4.170 20 0 EIADRP C[C@@H]1CC([N@@H+]2CC[C@]3(CC3(F)F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168058827 1029376776 /nfs/dbraw/zinc/37/67/76/1029376776.db2.gz CPEDYAHEHKEJCY-MDZRGWNJSA-N 2 0 334.454 4.159 20 0 EIADRP C[C@H](CCc1ccc(F)cc1)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475270421 1029487731 /nfs/dbraw/zinc/48/77/31/1029487731.db2.gz SEXAYVRXHQITJI-NQIIRXRSSA-N 2 0 340.486 4.259 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21)CC(F)F ZINC000647319348 1029520327 /nfs/dbraw/zinc/52/03/27/1029520327.db2.gz WVDMGSMTBDSFAC-JCHJZTRSSA-N 2 0 336.470 4.168 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@@H](C(F)(F)F)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168061383 1029540793 /nfs/dbraw/zinc/54/07/93/1029540793.db2.gz IFESMEYCIUAQKE-CYGHRXIMSA-N 2 0 340.433 4.312 20 0 EIADRP FC(F)(F)c1cc(Cl)cc(C[NH2+]CC2CC[NH+](C3CC3)CC2)c1 ZINC000446890476 1029627759 /nfs/dbraw/zinc/62/77/59/1029627759.db2.gz LCMKPBZAHHCNOR-UHFFFAOYSA-N 2 0 346.824 4.323 20 0 EIADRP CC(C)[C@H](COCc1ccccc1)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000446937919 1029646517 /nfs/dbraw/zinc/64/65/17/1029646517.db2.gz UBCDYYNWSQSJCS-FQEVSTJZSA-N 2 0 332.532 4.080 20 0 EIADRP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+][C@@H](C)Cn1ccnc1 ZINC000657833380 1029658788 /nfs/dbraw/zinc/65/87/88/1029658788.db2.gz FRMMYELSINSMQD-NEPJUHHUSA-N 2 0 345.796 4.165 20 0 EIADRP CCOc1cccc(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000090578207 1029867640 /nfs/dbraw/zinc/86/76/40/1029867640.db2.gz KUPISYMTZIYUOI-UHFFFAOYSA-N 2 0 330.516 4.015 20 0 EIADRP FC(F)(F)c1cccc([C@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)C2CC2)c1 ZINC000091284507 1029882762 /nfs/dbraw/zinc/88/27/62/1029882762.db2.gz UDAASVJVOSSRAX-FZKQIMNGSA-N 2 0 338.417 4.230 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000091335688 1029884042 /nfs/dbraw/zinc/88/40/42/1029884042.db2.gz FZTJSTWUJDVXQW-SUMWQHHRSA-N 2 0 326.406 4.088 20 0 EIADRP Cc1ccoc1C[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000525694532 1029934915 /nfs/dbraw/zinc/93/49/15/1029934915.db2.gz ACCDUGKHDOTXJL-IRXDYDNUSA-N 2 0 326.484 4.356 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2sccc2Br)CC1 ZINC000142825225 1030062487 /nfs/dbraw/zinc/06/24/87/1030062487.db2.gz OCYOZILHKCETNG-UHFFFAOYSA-N 2 0 345.350 4.064 20 0 EIADRP Fc1ccc(C[C@@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000447536258 1030141775 /nfs/dbraw/zinc/14/17/75/1030141775.db2.gz LZPUEEIWBHOTNO-PGRDOPGGSA-N 2 0 338.470 4.183 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(-c2ccncc2)cc1 ZINC000447569704 1030153532 /nfs/dbraw/zinc/15/35/32/1030153532.db2.gz QFKNPBHQNOZMGY-QGZVFWFLSA-N 2 0 335.495 4.274 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(c2c(Cl)cccc2Cl)CCC1 ZINC000447571375 1030157153 /nfs/dbraw/zinc/15/71/53/1030157153.db2.gz XXIAANBZCJNINZ-CJNGLKHVSA-N 2 0 341.326 4.345 20 0 EIADRP Cc1[nH]c2ccc(F)cc2c1CC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000530221302 1030216426 /nfs/dbraw/zinc/21/64/26/1030216426.db2.gz OWOYZLQOHLVMQA-YZGWKJHDSA-N 2 0 343.490 4.058 20 0 EIADRP C[C@@H](CC(F)(F)F)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447601975 1030220798 /nfs/dbraw/zinc/22/07/98/1030220798.db2.gz RBPKUHFFCRJILV-LLLHUVSDSA-N 2 0 326.406 4.113 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H](C)c2ccc3cc(OC)ccc3c2)CC1 ZINC000391965508 1030234991 /nfs/dbraw/zinc/23/49/91/1030234991.db2.gz FOPHICXFAAESIH-MRXNPFEDSA-N 2 0 326.484 4.231 20 0 EIADRP Cc1ccc(F)cc1C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000526082777 1030264188 /nfs/dbraw/zinc/26/41/88/1030264188.db2.gz LJKNRBFHKCTSRV-UHFFFAOYSA-N 2 0 341.474 4.268 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2cscc2C(F)(F)F)C1 ZINC000685612952 1030572287 /nfs/dbraw/zinc/57/22/87/1030572287.db2.gz KPKXMVMKUWTVPN-CYBMUJFWSA-N 2 0 334.451 4.369 20 0 EIADRP CCOC1CCC([NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000657933746 1030629851 /nfs/dbraw/zinc/62/98/51/1030629851.db2.gz VFCDYNUWTHIUGV-GRTSPXDGSA-N 2 0 344.543 4.224 20 0 EIADRP C[C@@H](CC1CCOCC1)[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000685665256 1030665240 /nfs/dbraw/zinc/66/52/40/1030665240.db2.gz ZWTBYODIVNWVFH-UGKGYDQZSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2[nH]ccc2c1 ZINC000398179856 1030730771 /nfs/dbraw/zinc/73/07/71/1030730771.db2.gz WUURNDQBGOEJMI-LAUBAEHRSA-N 2 0 333.479 4.168 20 0 EIADRP CC(C)[N@@H+]1CCCC[C@@H]1CN1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000451896107 1030769904 /nfs/dbraw/zinc/76/99/04/1030769904.db2.gz BCSXOPDUHYCTQG-LJQANCHMSA-N 2 0 337.596 4.082 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(C(F)F)nc1 ZINC000657999288 1030770580 /nfs/dbraw/zinc/77/05/80/1030770580.db2.gz TXCYQKJMBFALSV-DOTOQJQBSA-N 2 0 345.437 4.192 20 0 EIADRP CCOC1CCC([NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000658018536 1030780854 /nfs/dbraw/zinc/78/08/54/1030780854.db2.gz ITZABOUJHDBJML-HWELCPFYSA-N 2 0 344.543 4.226 20 0 EIADRP CN1CCC[C@H](C[NH2+]Cc2ccc3cc[nH]c3c2)[C@@H]1c1cccs1 ZINC000527669035 1030807212 /nfs/dbraw/zinc/80/72/12/1030807212.db2.gz WSPZSNIJISZGCE-YLJYHZDGSA-N 2 0 339.508 4.402 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(F)cc1 ZINC000122383985 1030811338 /nfs/dbraw/zinc/81/13/38/1030811338.db2.gz ZHZORKFKELUTLS-LJQANCHMSA-N 2 0 330.447 4.007 20 0 EIADRP Cc1cc(C)c([C@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1C ZINC000658069010 1030813697 /nfs/dbraw/zinc/81/36/97/1030813697.db2.gz JKLJITBJFYVYQN-IBGZPJMESA-N 2 0 344.543 4.153 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cccs1 ZINC000658164384 1030861111 /nfs/dbraw/zinc/86/11/11/1030861111.db2.gz CTXAMLYQIWBWJF-GOSISDBHSA-N 2 0 329.513 4.096 20 0 EIADRP c1cc2c(s1)CCC[C@H]2[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658165367 1030862315 /nfs/dbraw/zinc/86/23/15/1030862315.db2.gz IUTGHUKTDAYJPJ-LJQANCHMSA-N 2 0 341.524 4.022 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cccc(F)c1 ZINC000658168753 1030864987 /nfs/dbraw/zinc/86/49/87/1030864987.db2.gz YKDALUAJNGAPQJ-NRFANRHFSA-N 2 0 341.474 4.174 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCOc2cccc3ccccc32)C[C@@H]1C ZINC000531140877 1030913491 /nfs/dbraw/zinc/91/34/91/1030913491.db2.gz MCHAGDIHZULHQR-PKOBYXMFSA-N 2 0 326.484 4.023 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2C(C)(C)C2(F)F)CC1 ZINC000658281056 1030938812 /nfs/dbraw/zinc/93/88/12/1030938812.db2.gz NJQMTKPCXKYHON-ABHNRTSZSA-N 2 0 336.470 4.311 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)cc1OCCC ZINC000392722148 1030946429 /nfs/dbraw/zinc/94/64/29/1030946429.db2.gz PTWYZTCJCPXEGI-ROUUACIJSA-N 2 0 348.531 4.257 20 0 EIADRP C[C@H](Cc1ccoc1)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658317410 1030979880 /nfs/dbraw/zinc/97/98/80/1030979880.db2.gz KBPMAQSBOBACFD-WIYYLYMNSA-N 2 0 338.495 4.103 20 0 EIADRP COc1cccc2cc([C@@H](C)[NH2+]CC3CC[NH+](CC4CC4)CC3)oc21 ZINC000658354364 1031025508 /nfs/dbraw/zinc/02/55/08/1031025508.db2.gz CIPQPJSUKUZBAI-OAHLLOKOSA-N 2 0 342.483 4.214 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)cc1Cl ZINC000658357693 1031029954 /nfs/dbraw/zinc/02/99/54/1031029954.db2.gz VKBMJHPWYXXMJK-AWEZNQCLSA-N 2 0 336.907 4.121 20 0 EIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2CCc3cccnc3CC2)c1 ZINC000421822431 1031033618 /nfs/dbraw/zinc/03/36/18/1031033618.db2.gz WYGJFCMYMRWPHC-JOCHJYFZSA-N 2 0 349.522 4.105 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](C)c1ccc(F)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000532480466 1031215925 /nfs/dbraw/zinc/21/59/25/1031215925.db2.gz XMIIPMXKCAJVIN-IAGOWNOFSA-N 2 0 344.474 4.220 20 0 EIADRP Cc1noc(C)c1C[N@H+]1CCCC12CC[NH+](C1CCC(C)CC1)CC2 ZINC001168211703 1031275764 /nfs/dbraw/zinc/27/57/64/1031275764.db2.gz HQUAVCCMXZEFBR-UHFFFAOYSA-N 2 0 345.531 4.301 20 0 EIADRP c1cncc(C2CC[NH+](Cc3cccc(C[NH+]4CCCCC4)c3)CC2)c1 ZINC001168214870 1031302701 /nfs/dbraw/zinc/30/27/01/1031302701.db2.gz JPLAJBINIFIUGE-UHFFFAOYSA-N 2 0 349.522 4.447 20 0 EIADRP C[C@H](CN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)c1cc(F)cc(F)c1 ZINC000449044069 1031396820 /nfs/dbraw/zinc/39/68/20/1031396820.db2.gz BJUZQIUZIQVOAR-QEEYODRMSA-N 2 0 334.454 4.017 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCOC2(CCC2)C1 ZINC000449084226 1031413191 /nfs/dbraw/zinc/41/31/91/1031413191.db2.gz XABGBPIYMUBUKX-NQIIRXRSSA-N 2 0 342.527 4.252 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCc2c[nH]c3ccccc23)CCN1Cc1ccccc1 ZINC000531677775 1031470986 /nfs/dbraw/zinc/47/09/86/1031470986.db2.gz ZTALYEMLJCXDEL-NQIIRXRSSA-N 2 0 347.506 4.353 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CCc2c[nH]c3ccccc23)CCN1Cc1ccccc1 ZINC000531677777 1031471490 /nfs/dbraw/zinc/47/14/90/1031471490.db2.gz ZTALYEMLJCXDEL-WIYYLYMNSA-N 2 0 347.506 4.353 20 0 EIADRP Cc1cccc([C@@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c1C ZINC000531704777 1031490086 /nfs/dbraw/zinc/49/00/86/1031490086.db2.gz MCUKPCOIZQBBCH-LJQANCHMSA-N 2 0 340.511 4.485 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)c1ccccc1OC ZINC000123986657 1031496539 /nfs/dbraw/zinc/49/65/39/1031496539.db2.gz KFXJFLMNMKGIPM-FQEVSTJZSA-N 2 0 326.484 4.388 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CCCC(C)(C)CO)CC1 ZINC000449166169 1031506985 /nfs/dbraw/zinc/50/69/85/1031506985.db2.gz YZFQWFARUBJCSA-UHFFFAOYSA-N 2 0 326.569 4.054 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCOC3(CCC3)C2)CC1 ZINC000449194098 1031513964 /nfs/dbraw/zinc/51/39/64/1031513964.db2.gz XJMYQOVRIGWSQD-SFHVURJKSA-N 2 0 336.564 4.357 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC(C)(C)c1ccc(F)cc1Cl ZINC000531718364 1031517828 /nfs/dbraw/zinc/51/78/28/1031517828.db2.gz WNYOXBZCPLLBQG-IGCXYCKISA-N 2 0 326.887 4.075 20 0 EIADRP CCO[C@@H](CC[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1)C(C)C ZINC000449180793 1031518670 /nfs/dbraw/zinc/51/86/70/1031518670.db2.gz CCTVAUJPHYYWEH-KNQAVFIVSA-N 2 0 346.559 4.123 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1cc(-c2ccccc2)nn1C ZINC000453067201 1031528905 /nfs/dbraw/zinc/52/89/05/1031528905.db2.gz YVKUSOHWJMQNMW-ROUUACIJSA-N 2 0 342.531 4.248 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)o1 ZINC000124649726 1031545436 /nfs/dbraw/zinc/54/54/36/1031545436.db2.gz KWLNYRNDEJJFQJ-FGTMMUONSA-N 2 0 342.483 4.048 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccncc1 ZINC000453099263 1031557127 /nfs/dbraw/zinc/55/71/27/1031557127.db2.gz YRYOVZWVFJKGAC-IBGZPJMESA-N 2 0 329.513 4.096 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cc(F)cc(F)c1 ZINC000449232836 1031563604 /nfs/dbraw/zinc/56/36/04/1031563604.db2.gz JGOXTYFLVQFORB-OWCLPIDISA-N 2 0 336.470 4.311 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)CC(F)(F)F)CC1 ZINC000449249485 1031565012 /nfs/dbraw/zinc/56/50/12/1031565012.db2.gz LVJZINZFTZKKHI-LSDHHAIUSA-N 2 0 328.422 4.013 20 0 EIADRP CC[C@H]([NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C)c1ccncc1 ZINC000453153553 1031629746 /nfs/dbraw/zinc/62/97/46/1031629746.db2.gz VKGGJTCVKCEZRL-OPYAIIAOSA-N 2 0 337.511 4.279 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)c1cc[nH]c(=O)c1 ZINC000449339379 1031658349 /nfs/dbraw/zinc/65/83/49/1031658349.db2.gz JSVIRENZLVHZIF-HNNXBMFYSA-N 2 0 333.520 4.117 20 0 EIADRP CCC(C)(C)[NH2+][C@@H](C)C(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000475900069 1031731357 /nfs/dbraw/zinc/73/13/57/1031731357.db2.gz SEFGEIKHWBTQRS-KRWDZBQOSA-N 2 0 345.531 4.168 20 0 EIADRP Cc1cc(C[NH2+]C(C)(C)CCC[NH+](C)C)ccc1Oc1cccnc1 ZINC000449528899 1031823167 /nfs/dbraw/zinc/82/31/67/1031823167.db2.gz SXFPYONEPPFTKJ-UHFFFAOYSA-N 2 0 341.499 4.392 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000531944453 1031826385 /nfs/dbraw/zinc/82/63/85/1031826385.db2.gz NNOXLFJNYMCUOK-IAGOWNOFSA-N 2 0 326.484 4.039 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)C1CCOCC1 ZINC000531949844 1031862105 /nfs/dbraw/zinc/86/21/05/1031862105.db2.gz HPIPWXJFLFELRS-JOCHJYFZSA-N 2 0 344.543 4.357 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(Br)s1 ZINC000453404704 1031938740 /nfs/dbraw/zinc/93/87/40/1031938740.db2.gz BPBUQMMDGBWDMP-LLVKDONJSA-N 2 0 331.323 4.036 20 0 EIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453406477 1031941406 /nfs/dbraw/zinc/94/14/06/1031941406.db2.gz RBDFDHLBHDIIKK-CQSZACIVSA-N 2 0 328.422 4.100 20 0 EIADRP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000531993867 1031960776 /nfs/dbraw/zinc/96/07/76/1031960776.db2.gz CLAQBNDNXQCGCH-VFNWGFHPSA-N 2 0 330.491 4.446 20 0 EIADRP Cc1cnc(CC[N@@H+](C)Cc2ccc(C[NH+]3CCCCC3)cc2)s1 ZINC000411407164 1033883791 /nfs/dbraw/zinc/88/37/91/1033883791.db2.gz KTEYHLKGWSPWDJ-UHFFFAOYSA-N 2 0 343.540 4.112 20 0 EIADRP Cc1nccn1CC[NH2+][C@H](Cc1ccccc1Cl)c1ccco1 ZINC000924873332 1033891127 /nfs/dbraw/zinc/89/11/27/1033891127.db2.gz MDAFCURRPQFINQ-QGZVFWFLSA-N 2 0 329.831 4.012 20 0 EIADRP FC(F)(F)c1ccc(C[NH2+]CCCCC[NH+]2CCCCC2)cc1 ZINC000500925812 1034205024 /nfs/dbraw/zinc/20/50/24/1034205024.db2.gz YRDMCVREVURMDA-UHFFFAOYSA-N 2 0 328.422 4.451 20 0 EIADRP FC(F)(F)c1ccc(CCC[N@@H+]2CCCC3(CC[NH2+]CC3)C2)cc1 ZINC001204727665 1034716084 /nfs/dbraw/zinc/71/60/84/1034716084.db2.gz IWIBAHHXEBBFJU-UHFFFAOYSA-N 2 0 340.433 4.104 20 0 EIADRP CCc1ncc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)s1 ZINC000513500612 1034997478 /nfs/dbraw/zinc/99/74/78/1034997478.db2.gz NMKKXRFBVBDCFV-FUHWJXTLSA-N 2 0 343.540 4.096 20 0 EIADRP COc1cccc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000513510915 1035006241 /nfs/dbraw/zinc/00/62/41/1035006241.db2.gz GNHOOBOTGVCYPJ-RXVVDRJESA-N 2 0 338.495 4.086 20 0 EIADRP Cc1ccccc1[C@H](CC(C)C)[NH2+]CCCN1CC[NH+](C(C)C)CC1 ZINC000501056785 1035362624 /nfs/dbraw/zinc/36/26/24/1035362624.db2.gz UNQNALNTWUPTIO-QFIPXVFZSA-N 2 0 345.575 4.088 20 0 EIADRP C[N@@H+](Cc1ccccc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501069902 1035367538 /nfs/dbraw/zinc/36/75/38/1035367538.db2.gz QQDSFMYBMPMDIR-UHFFFAOYSA-N 2 0 329.875 4.083 20 0 EIADRP CCC[N@H+](CCCN1CC[NH+](C(C)C)CC1)[C@H](CC)c1ccccc1 ZINC000501103160 1035378595 /nfs/dbraw/zinc/37/85/95/1035378595.db2.gz FXSMZVADRBDRNR-JOCHJYFZSA-N 2 0 345.575 4.266 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CCCc2cccc(C(F)(F)F)c2)[C@H]2CCC[C@H]21 ZINC000513712194 1035425874 /nfs/dbraw/zinc/42/58/74/1035425874.db2.gz AJPCAEFOAIROLQ-FGTMMUONSA-N 2 0 340.433 4.100 20 0 EIADRP C[NH+](C)CCCC[NH2+]CC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000501396106 1035435095 /nfs/dbraw/zinc/43/50/95/1035435095.db2.gz CPSOENAKFDBLAN-UHFFFAOYSA-N 2 0 332.438 4.028 20 0 EIADRP C[N@H+](CCC[NH2+][C@H]1CCC[C@H](c2cccnc2)C1)C1CCCCC1 ZINC000501379492 1035436029 /nfs/dbraw/zinc/43/60/29/1035436029.db2.gz BBZVFUPJFKATMS-ICSRJNTNSA-N 2 0 329.532 4.352 20 0 EIADRP c1cncc([C@@H]2CCC[C@H]([NH2+]CCCCC[NH+]3CCCCC3)C2)c1 ZINC000501425815 1035442904 /nfs/dbraw/zinc/44/29/04/1035442904.db2.gz PHFHFPOCNBDGAH-CTNGQTDRSA-N 2 0 329.532 4.354 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@H+](C)[C@H](C)C1 ZINC000501466378 1035449268 /nfs/dbraw/zinc/44/92/68/1035449268.db2.gz JNXGAHNQKXKFCR-RNTKJRCOSA-N 2 0 326.406 4.181 20 0 EIADRP C[N@@H+](Cc1cc2ccccc2o1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501541701 1035462676 /nfs/dbraw/zinc/46/26/76/1035462676.db2.gz SFCLPEXREDBMHL-UHFFFAOYSA-N 2 0 335.451 4.176 20 0 EIADRP Cc1nc([C@@H](C)[N@@H+]2CCC[C@H](CC[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420319113 1035513039 /nfs/dbraw/zinc/51/30/39/1035513039.db2.gz XDBOUXCEDPHRDM-HUUCEWRRSA-N 2 0 347.890 4.425 20 0 EIADRP Brc1ccc([C@@H]2CCC[N@@H+]2CC[C@H]2CCC[NH2+]C2)s1 ZINC000420372162 1035556593 /nfs/dbraw/zinc/55/65/93/1035556593.db2.gz LGSBFONKUOMVFO-OLZOCXBDSA-N 2 0 343.334 4.037 20 0 EIADRP Brc1ccc([C@@H]2CCC[N@@H+]2CC[C@@H]2CCC[NH2+]C2)s1 ZINC000420372164 1035557605 /nfs/dbraw/zinc/55/76/05/1035557605.db2.gz LGSBFONKUOMVFO-STQMWFEESA-N 2 0 343.334 4.037 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)C[C@H](C)O1 ZINC000574897713 1035578744 /nfs/dbraw/zinc/57/87/44/1035578744.db2.gz RMCCUNOQKANDSL-WGMWDUQUSA-N 2 0 330.516 4.108 20 0 EIADRP CCN(CCC[NH+](C)C)Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000575028278 1035656665 /nfs/dbraw/zinc/65/66/65/1035656665.db2.gz ZNSBEFRIECIUGQ-UHFFFAOYSA-N 2 0 337.920 4.237 20 0 EIADRP Cc1cccc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC000571380349 1036035095 /nfs/dbraw/zinc/03/50/95/1036035095.db2.gz IPAXKICDKUKXEN-AKIFATBCSA-N 2 0 349.522 4.170 20 0 EIADRP Cc1cccc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)n1 ZINC000571380347 1036036138 /nfs/dbraw/zinc/03/61/38/1036036138.db2.gz IPAXKICDKUKXEN-ACIOBRDBSA-N 2 0 349.522 4.170 20 0 EIADRP C[N@@H+](Cc1c(OC(F)F)ccc2ccccc21)CC1CC[NH+](C)CC1 ZINC000513742629 1036061368 /nfs/dbraw/zinc/06/13/68/1036061368.db2.gz ZRUKMCTYXGTSIO-UHFFFAOYSA-N 2 0 348.437 4.215 20 0 EIADRP CC(C)OCc1ccccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000571789628 1036254432 /nfs/dbraw/zinc/25/44/32/1036254432.db2.gz VEKHZTXTUAKDDE-PWRODBHTSA-N 2 0 330.516 4.012 20 0 EIADRP COc1ccccc1/C=C/C[NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000588177757 1036283340 /nfs/dbraw/zinc/28/33/40/1036283340.db2.gz FPBIHGYKSGUNJN-HLKZIGTNSA-N 2 0 330.516 4.056 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C[C@@H]2CC23CCSCC3)CC1 ZINC000421374820 1036321456 /nfs/dbraw/zinc/32/14/56/1036321456.db2.gz HLHMZNUQORXVSD-ZIFCJYIRSA-N 2 0 336.589 4.152 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000421372321 1036322489 /nfs/dbraw/zinc/32/24/89/1036322489.db2.gz MCZLPVNJAPELHD-UHFFFAOYSA-N 2 0 334.813 4.321 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000502593154 1036386030 /nfs/dbraw/zinc/38/60/30/1036386030.db2.gz SBWKFVNKBMACOG-JKSUJKDBSA-N 2 0 340.458 4.103 20 0 EIADRP CC[N@H+](CCC1CC[NH+](CCc2ccccc2F)CC1)CC(C)C ZINC001168412669 1036465022 /nfs/dbraw/zinc/46/50/22/1036465022.db2.gz BCYGZWGPZFEPAW-UHFFFAOYSA-N 2 0 334.523 4.448 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1cnn(C2CCCC2)c1 ZINC000502720347 1036562263 /nfs/dbraw/zinc/56/22/63/1036562263.db2.gz BEVYRYITZNLGBE-SFHVURJKSA-N 2 0 332.536 4.305 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1cnn(C2CCCC2)c1 ZINC000502727535 1036585057 /nfs/dbraw/zinc/58/50/57/1036585057.db2.gz NRVMEIMBNUTJDW-QZTJIDSGSA-N 2 0 332.536 4.303 20 0 EIADRP C[C@H]([NH2+]C/C=C/c1ccc(F)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486473101 1036718157 /nfs/dbraw/zinc/71/81/57/1036718157.db2.gz DPKARZYRVMHYLF-QSSYGXSSSA-N 2 0 338.470 4.339 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)CC[NH+](C)CC1 ZINC000589349422 1036760350 /nfs/dbraw/zinc/76/03/50/1036760350.db2.gz REJIRRMSFFTAGY-LBPRGKRZSA-N 2 0 347.355 4.471 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)cc1 ZINC000613259560 1036811504 /nfs/dbraw/zinc/81/15/04/1036811504.db2.gz IDWWLSJWMUCYDL-VAMGGRTRSA-N 2 0 330.516 4.076 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000421846942 1036823416 /nfs/dbraw/zinc/82/34/16/1036823416.db2.gz VIKJAMZUYPUENM-ZDUSSCGKSA-N 2 0 326.887 4.263 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(F)cc1Br ZINC000421877813 1036829699 /nfs/dbraw/zinc/82/96/99/1036829699.db2.gz MMGQNMJUWPVIHC-LMWSTFAQSA-N 2 0 343.284 4.112 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1cc2ccc(F)cc2[nH]1 ZINC000486727354 1036831478 /nfs/dbraw/zinc/83/14/78/1036831478.db2.gz DZJVIHDJIAEUSZ-UHFFFAOYSA-N 2 0 339.458 4.437 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(OC(F)(F)F)cc2)C1 ZINC000589836077 1036879751 /nfs/dbraw/zinc/87/97/51/1036879751.db2.gz FYWPEHLTHRBYIA-OAHLLOKOSA-N 2 0 344.421 4.187 20 0 EIADRP C[N@@H+]1CCC[C@H]1CCN1CC=C(c2ccccc2C(F)(F)F)CC1 ZINC000503071937 1036889016 /nfs/dbraw/zinc/88/90/16/1036889016.db2.gz JJSBXVVCUGNNPO-INIZCTEOSA-N 2 0 338.417 4.279 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C/C=C/c3ccncc3)cc2)C1 ZINC000486943621 1036897373 /nfs/dbraw/zinc/89/73/73/1036897373.db2.gz OBKWRIRGHWCTDJ-XUYKHGSPSA-N 2 0 335.495 4.117 20 0 EIADRP CCOc1c(Cl)cccc1C[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000486945174 1036899602 /nfs/dbraw/zinc/89/96/02/1036899602.db2.gz XWYHTBKQUWYMEO-UHFFFAOYSA-N 2 0 332.875 4.090 20 0 EIADRP CC1CC[NH+](Cc2ccccc2C[NH2+]C/C=C/c2ccncc2)CC1 ZINC000486990980 1036937789 /nfs/dbraw/zinc/93/77/89/1036937789.db2.gz SAVBGXHYBZRHIL-SNAWJCMRSA-N 2 0 335.495 4.117 20 0 EIADRP C[NH+](C)CC1CC[NH+](Cc2ccc(OCc3ccccc3)cc2)CC1 ZINC000590125082 1036981154 /nfs/dbraw/zinc/98/11/54/1036981154.db2.gz CEIATDCBGUEOQF-UHFFFAOYSA-N 2 0 338.495 4.039 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)C(C)(C)c1ccccc1 ZINC000590302443 1037038579 /nfs/dbraw/zinc/03/85/79/1037038579.db2.gz CWSJONKZVSJXFJ-GOSISDBHSA-N 2 0 340.511 4.083 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311088389 1037080090 /nfs/dbraw/zinc/08/00/90/1037080090.db2.gz NJNYOPFCJYHFPH-LQWHRVPQSA-N 2 0 340.486 4.257 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311088391 1037082255 /nfs/dbraw/zinc/08/22/55/1037082255.db2.gz NJNYOPFCJYHFPH-OPYAIIAOSA-N 2 0 340.486 4.257 20 0 EIADRP CC(C)n1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cn1 ZINC000272298758 1037152793 /nfs/dbraw/zinc/15/27/93/1037152793.db2.gz GNLATBODLQRPQL-WSTZPKSXSA-N 2 0 340.515 4.025 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccccc2C(F)(F)F)CC1 ZINC000590786708 1037165411 /nfs/dbraw/zinc/16/54/11/1037165411.db2.gz NEZUFDIQTHRPBP-UHFFFAOYSA-N 2 0 328.422 4.258 20 0 EIADRP CC(C)(C)[C@H]1C[C@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)CS1 ZINC000488402697 1037570274 /nfs/dbraw/zinc/57/02/74/1037570274.db2.gz CCLXYXWUIVPESY-RBUKOAKNSA-N 2 0 332.557 4.292 20 0 EIADRP [NH3+]C1CC[NH+](Cc2ccc(-c3ccc(C(F)(F)F)cc3)s2)CC1 ZINC000414648868 1037659423 /nfs/dbraw/zinc/65/94/23/1037659423.db2.gz BPXMMHBRKVUPIH-UHFFFAOYSA-N 2 0 340.414 4.357 20 0 EIADRP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2N[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000513787595 1037713197 /nfs/dbraw/zinc/71/31/97/1037713197.db2.gz BLMGIIJUIBCZBP-HBFSDRIKSA-N 2 0 340.511 4.430 20 0 EIADRP CCCOCc1ccccc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000422697043 1037799503 /nfs/dbraw/zinc/79/95/03/1037799503.db2.gz TYSBQOTWRQOUJX-PCCBWWKXSA-N 2 0 330.516 4.014 20 0 EIADRP C(CC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1)CCOC1CCCCC1 ZINC000422704253 1037802059 /nfs/dbraw/zinc/80/20/59/1037802059.db2.gz KEHVASLDUXZZMN-QHAWAJNXSA-N 2 0 336.564 4.406 20 0 EIADRP C[C@H]([NH2+]C(C)(C)CN[C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1)c1ccccc1 ZINC000422733028 1037808218 /nfs/dbraw/zinc/80/82/18/1037808218.db2.gz QLWLXHJNNKYTJB-FYZZASKESA-N 2 0 343.559 4.016 20 0 EIADRP Cc1[nH]c2c(cc(C)cc2C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)c1C ZINC000422746700 1037824265 /nfs/dbraw/zinc/82/42/65/1037824265.db2.gz WYOQVTUGDJZLBG-YZGWKJHDSA-N 2 0 325.500 4.103 20 0 EIADRP Cc1c2ccccc2oc1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422748888 1037825943 /nfs/dbraw/zinc/82/59/43/1037825943.db2.gz WQCLRHGHHZHJIG-AVRDEDQJSA-N 2 0 348.446 4.087 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](c1ccc(Cl)cc1)C1CC1 ZINC000422769112 1037828967 /nfs/dbraw/zinc/82/89/67/1037828967.db2.gz STIMPJWXUJYTFZ-YJYMSZOUSA-N 2 0 329.875 4.304 20 0 EIADRP COc1ccc([C@H]([NH2+][C@@H](C)CCC[NH3+])c2ccccc2Cl)c(C)c1 ZINC000422797011 1037835161 /nfs/dbraw/zinc/83/51/61/1037835161.db2.gz KWNOHSFJYVDNBS-YWZLYKJASA-N 2 0 346.902 4.463 20 0 EIADRP CC1CC[NH+](Cc2ccc(CN[C@@H]3C[C@H]([NH3+])c4ccccc43)cc2)CC1 ZINC000422800324 1037836570 /nfs/dbraw/zinc/83/65/70/1037836570.db2.gz BGIKWOZIMUEWGY-XZOQPEGZSA-N 2 0 349.522 4.153 20 0 EIADRP C[C@H]1C[C@@H](C[NH+]2CCC(c3nc4cc(Cl)ccc4o3)CC2)CC[NH2+]1 ZINC000414694035 1037837767 /nfs/dbraw/zinc/83/77/67/1037837767.db2.gz CRBSWYNSKVXEEU-KBPBESRZSA-N 2 0 347.890 4.049 20 0 EIADRP COc1ccc([C@H](C)CC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000422791219 1037840193 /nfs/dbraw/zinc/84/01/93/1037840193.db2.gz YIAXPBMXMQFHRH-QYRPDUKASA-N 2 0 330.516 4.089 20 0 EIADRP Cc1ccc([C@H]([NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C2CC2)cc1 ZINC000422813365 1037840485 /nfs/dbraw/zinc/84/04/85/1037840485.db2.gz RQWYTOFKZCESFC-PMVMPFDFSA-N 2 0 348.490 4.292 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000422823927 1037842197 /nfs/dbraw/zinc/84/21/97/1037842197.db2.gz FLTMMKYTDNSMDH-SOAGJPPSSA-N 2 0 330.422 4.108 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000422832525 1037842838 /nfs/dbraw/zinc/84/28/38/1037842838.db2.gz XWIRNIXAKIHSIH-COXVUDFISA-N 2 0 328.422 4.449 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@H](C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)C1 ZINC000422853091 1037847269 /nfs/dbraw/zinc/84/72/69/1037847269.db2.gz RVZUYMBYJUVYRR-JZAWBGDQSA-N 2 0 332.454 4.256 20 0 EIADRP [NH3+]CC1CCC([NH2+]Cc2ccc(-c3nc4ccccc4s3)o2)CC1 ZINC000422866470 1037849003 /nfs/dbraw/zinc/84/90/03/1037849003.db2.gz QIILQYOPWCQSPN-UHFFFAOYSA-N 2 0 341.480 4.163 20 0 EIADRP c1cc(-c2ccc3c(c2)CCCO3)ccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422845048 1037849916 /nfs/dbraw/zinc/84/99/16/1037849916.db2.gz AULAMAUAJZJCSH-CBQGHPETSA-N 2 0 348.490 4.051 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC(C)(C)Cc1cccc(Cl)c1 ZINC000422873021 1037857879 /nfs/dbraw/zinc/85/78/79/1037857879.db2.gz JMTQVYCOZYWRMK-CQSZACIVSA-N 2 0 345.918 4.422 20 0 EIADRP CC(C)[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc(C(F)(F)F)c1 ZINC000422899988 1037861696 /nfs/dbraw/zinc/86/16/96/1037861696.db2.gz IQBUBJJXHWBGTG-FCLJQHQZSA-N 2 0 326.406 4.275 20 0 EIADRP c1ccc([C@@H]2OCCC[C@@H]2C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000422908796 1037864391 /nfs/dbraw/zinc/86/43/91/1037864391.db2.gz ZIADPJLVGMZWPH-LMYCIYFBSA-N 2 0 342.527 4.055 20 0 EIADRP COc1cccc(C[C@H]([NH2+][C@H](C)CCCC[NH3+])c2ccccc2)c1 ZINC000422941955 1037874842 /nfs/dbraw/zinc/87/48/42/1037874842.db2.gz OZWMWSOMPMQKST-UTKZUKDTSA-N 2 0 326.484 4.086 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@H](c1ccc(Br)cc1)C1CCC1 ZINC000422935785 1037875057 /nfs/dbraw/zinc/87/50/57/1037875057.db2.gz DRBVASUXYUDQRJ-LRDDRELGSA-N 2 0 325.294 4.007 20 0 EIADRP c1ccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422965829 1037880204 /nfs/dbraw/zinc/88/02/04/1037880204.db2.gz MBUKKSSYJFDNPG-BWKHYTDRSA-N 2 0 348.490 4.168 20 0 EIADRP Cc1sc(C[NH2+][C@H](C)CCCC[NH3+])nc1-c1ccc(Cl)cc1 ZINC000422945667 1037885248 /nfs/dbraw/zinc/88/52/48/1037885248.db2.gz NPSVOSAZGMRQJJ-GFCCVEGCSA-N 2 0 337.920 4.379 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc(OC2CCCC2)cc1 ZINC000422948016 1037886002 /nfs/dbraw/zinc/88/60/02/1037886002.db2.gz RLMMWSBPDJUXMM-OAHLLOKOSA-N 2 0 339.483 4.021 20 0 EIADRP [NH3+]CC1CCC([NH2+]C2(c3cccc(C(F)(F)F)c3)CCC2)CC1 ZINC000422953531 1037887740 /nfs/dbraw/zinc/88/77/40/1037887740.db2.gz FVJYMPMGVCETDW-UHFFFAOYSA-N 2 0 326.406 4.192 20 0 EIADRP COc1ccc([C@@H]([NH2+][C@H](C)CCCC[NH3+])c2ccc(F)cc2)cc1 ZINC000422950968 1037887914 /nfs/dbraw/zinc/88/79/14/1037887914.db2.gz ZFRHFIZRETWCOB-QRWLVFNGSA-N 2 0 330.447 4.031 20 0 EIADRP C[C@H]([NH2+][C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1)C1C[NH2+]C1 ZINC000423019395 1037903792 /nfs/dbraw/zinc/90/37/92/1037903792.db2.gz VLNIMHKCKAHBPZ-VFZGTOFNSA-N 2 0 332.797 4.007 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC1(c2ccc(F)cc2Cl)CC1 ZINC000423025270 1037909958 /nfs/dbraw/zinc/90/99/58/1037909958.db2.gz NVQNHXBYXLOIMQ-LBPRGKRZSA-N 2 0 347.865 4.024 20 0 EIADRP C[C@H](C[C@H](C)[NH3+])[NH2+]CC1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000423070847 1037932074 /nfs/dbraw/zinc/93/20/74/1037932074.db2.gz NWXWKXWVLOPYNB-WDEREUQCSA-N 2 0 334.813 4.106 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]C1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000423070560 1037932663 /nfs/dbraw/zinc/93/26/63/1037932663.db2.gz GEJILYZOGLLUEC-LLVKDONJSA-N 2 0 334.813 4.455 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1cc2cccc(F)c2o1 ZINC000423074977 1037937501 /nfs/dbraw/zinc/93/75/01/1037937501.db2.gz VVJBTQXSRMLKSK-AAEUAGOBSA-N 2 0 327.403 4.146 20 0 EIADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000423096958 1037953386 /nfs/dbraw/zinc/95/33/86/1037953386.db2.gz QDTZSZYOXGDCBO-NXNVCVFFSA-N 2 0 326.406 4.059 20 0 EIADRP CC(C)Oc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000574226556 1037955045 /nfs/dbraw/zinc/95/50/45/1037955045.db2.gz LXEUECOKWKUMSH-CEXWTWQISA-N 2 0 348.531 4.014 20 0 EIADRP Fc1ccc(C2CC([NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)C2)cc1Cl ZINC000423099246 1037958361 /nfs/dbraw/zinc/95/83/61/1037958361.db2.gz LUFAADCATFSCJY-XMMNMGKXSA-N 2 0 336.882 4.235 20 0 EIADRP Cc1ccc(C(C)(C)C[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)c(C)c1 ZINC000423131805 1037962746 /nfs/dbraw/zinc/96/27/46/1037962746.db2.gz OLHPKNCVUJKKBK-INIZCTEOSA-N 2 0 325.500 4.094 20 0 EIADRP CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423101823 1037964000 /nfs/dbraw/zinc/96/40/00/1037964000.db2.gz DFRGJPBIGBFZBZ-MSOXQGRFSA-N 2 0 336.479 4.072 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423127847 1037972749 /nfs/dbraw/zinc/97/27/49/1037972749.db2.gz PSHKXABLJGFXBU-QNWVGRARSA-N 2 0 348.490 4.218 20 0 EIADRP [NH3+]CC1CCC([NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC1 ZINC000423107755 1037982992 /nfs/dbraw/zinc/98/29/92/1037982992.db2.gz QGRGAVVEZDLQKI-QOJXUVEWSA-N 2 0 342.405 4.143 20 0 EIADRP [NH3+]CC1CCC([NH2+][C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)CC1 ZINC000423107754 1037985572 /nfs/dbraw/zinc/98/55/72/1037985572.db2.gz QGRGAVVEZDLQKI-MWHAMWOXSA-N 2 0 342.405 4.143 20 0 EIADRP COCC[C@@H]([NH2+]C1CCC(C[NH3+])CC1)c1ccc(Cl)c(Cl)c1 ZINC000423113109 1037992618 /nfs/dbraw/zinc/99/26/18/1037992618.db2.gz YLAIBHGDYKUQPA-MKTAYPAQSA-N 2 0 345.314 4.178 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1F ZINC000423145669 1037996300 /nfs/dbraw/zinc/99/63/00/1037996300.db2.gz LYCFIIBPQGFCAV-JJXUHFIVSA-N 2 0 340.442 4.041 20 0 EIADRP [NH3+][C@@H]1C[C@H]([NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)c2ccccc21 ZINC000423140106 1038012533 /nfs/dbraw/zinc/01/25/33/1038012533.db2.gz XHYHTQUZEGSOTH-KSZLIROESA-N 2 0 334.385 4.457 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(Cl)cc1 ZINC000423170479 1038022509 /nfs/dbraw/zinc/02/25/09/1038022509.db2.gz MDZNLDSIVONFDC-WNYOCNMUSA-N 2 0 342.870 4.247 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(Cl)cc1 ZINC000423170478 1038024304 /nfs/dbraw/zinc/02/43/04/1038024304.db2.gz MDZNLDSIVONFDC-LXGCGDOSSA-N 2 0 342.870 4.247 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000503940533 1038027238 /nfs/dbraw/zinc/02/72/38/1038027238.db2.gz ABVQAJAAEWPXAK-QINSGFPZSA-N 2 0 340.433 4.382 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000423210419 1038038790 /nfs/dbraw/zinc/03/87/90/1038038790.db2.gz GFIKUABPNOZISN-ZACQAIPSSA-N 2 0 327.516 4.202 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(SCC(F)F)cc1)[C@H]1CCC[NH2+]C1 ZINC000423214930 1038063549 /nfs/dbraw/zinc/06/35/49/1038063549.db2.gz MBCLGANOCUZQQF-GUTXKFCHSA-N 2 0 328.472 4.083 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423221164 1038066118 /nfs/dbraw/zinc/06/61/18/1038066118.db2.gz WLPIYVQSFSRHBD-RVKKMQEKSA-N 2 0 343.540 4.081 20 0 EIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+]CC[C@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423256477 1038086310 /nfs/dbraw/zinc/08/63/10/1038086310.db2.gz FGIMGAWRSIZOSB-NVXWUHKLSA-N 2 0 341.524 4.167 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423282381 1038089047 /nfs/dbraw/zinc/08/90/47/1038089047.db2.gz WMDHTQXCOISYEY-GDBMZVCRSA-N 2 0 328.422 4.006 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cccc2c1OC(C)(C)C2 ZINC000606469328 1038092450 /nfs/dbraw/zinc/09/24/50/1038092450.db2.gz RAJHQOIYLPYSFV-KRWDZBQOSA-N 2 0 330.516 4.144 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(C(F)(F)F)s2)CC1 ZINC000570506078 1038092532 /nfs/dbraw/zinc/09/25/32/1038092532.db2.gz KBQKVJVKRZUPBN-UHFFFAOYSA-N 2 0 334.451 4.319 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCC4)cc1 ZINC000423293340 1038094928 /nfs/dbraw/zinc/09/49/28/1038094928.db2.gz QZURVEFUAMXDHG-YCRPNKLZSA-N 2 0 336.479 4.199 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)cc1 ZINC000423292954 1038095247 /nfs/dbraw/zinc/09/52/47/1038095247.db2.gz PBRKOOZFGZIPKU-HZUJVAHNSA-N 2 0 342.458 4.103 20 0 EIADRP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000423293578 1038096723 /nfs/dbraw/zinc/09/67/23/1038096723.db2.gz RTAQIMVERCVJSK-UONOGXRCSA-N 2 0 334.410 4.467 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2cc(Br)cs2)cc1 ZINC000423293461 1038097029 /nfs/dbraw/zinc/09/70/29/1038097029.db2.gz RKBDMDIJOQPFMN-GHMZBOCLSA-N 2 0 339.302 4.381 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1OC ZINC000423296234 1038122803 /nfs/dbraw/zinc/12/28/03/1038122803.db2.gz YPWQTYXVPALZEG-OWCLPIDISA-N 2 0 342.483 4.005 20 0 EIADRP C[C@@H]([NH2+]CC1C[NH2+]C1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000423303093 1038128613 /nfs/dbraw/zinc/12/86/13/1038128613.db2.gz KYIFYDOEZSNLLW-LLVKDONJSA-N 2 0 340.414 4.304 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423327700 1038141225 /nfs/dbraw/zinc/14/12/25/1038141225.db2.gz LPAJFQHBNIZFTF-YWZLYKJASA-N 2 0 343.540 4.083 20 0 EIADRP CSc1cccc([C@@H]([NH2+]CCCC[NH3+])c2ccc(F)c(F)c2)c1 ZINC000423335677 1038147936 /nfs/dbraw/zinc/14/79/36/1038147936.db2.gz UCIKBGRLEDWJHF-GOSISDBHSA-N 2 0 336.451 4.105 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423333008 1038148987 /nfs/dbraw/zinc/14/89/87/1038148987.db2.gz PSEZMBOEQNABFS-OAHLLOKOSA-N 2 0 343.540 4.083 20 0 EIADRP FC(F)(F)c1cccc(C2CCC([NH2+]CC3=CC[NH2+]CC3)CC2)c1 ZINC000423356549 1038170547 /nfs/dbraw/zinc/17/05/47/1038170547.db2.gz QSBKRIZYGIGQHM-UHFFFAOYSA-N 2 0 338.417 4.241 20 0 EIADRP COc1ccc(C2CCC([NH2+]Cc3ccc4c(c3)C[NH2+]C4)CC2)cc1 ZINC000423368860 1038182165 /nfs/dbraw/zinc/18/21/65/1038182165.db2.gz DKFIKRTWPXOKRA-UHFFFAOYSA-N 2 0 336.479 4.114 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423368908 1038184538 /nfs/dbraw/zinc/18/45/38/1038184538.db2.gz DMNIISVCNWNTLY-IACUBPJLSA-N 2 0 333.476 4.178 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423367936 1038185180 /nfs/dbraw/zinc/18/51/80/1038185180.db2.gz RSRLVWMUDQMKFO-GXTWGEPZSA-N 2 0 333.476 4.050 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)C1 ZINC000423366073 1038187164 /nfs/dbraw/zinc/18/71/64/1038187164.db2.gz LFPLJONJPXSVOB-LTIDMASMSA-N 2 0 326.406 4.201 20 0 EIADRP Clc1ccc([C@H]2CC[C@H]([NH2+]Cc3ccc4c(c3)C[NH2+]C4)C2)cc1 ZINC000423370760 1038191212 /nfs/dbraw/zinc/19/12/12/1038191212.db2.gz FWAFVZJMMTZTNL-JXFKEZNVSA-N 2 0 326.871 4.369 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC[NH2+]1 ZINC000423380576 1038194953 /nfs/dbraw/zinc/19/49/53/1038194953.db2.gz MZAYVAXNNPGAOH-ODVANORSSA-N 2 0 326.406 4.072 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423386675 1038195871 /nfs/dbraw/zinc/19/58/71/1038195871.db2.gz MIQFMTLCKLSWMP-NRFANRHFSA-N 2 0 336.479 4.417 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)C1CC1 ZINC000423388889 1038199358 /nfs/dbraw/zinc/19/93/58/1038199358.db2.gz NRTUJLJDZSSBSW-HXUWFJFHSA-N 2 0 326.871 4.054 20 0 EIADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@@H](Cc1ccccc1Cl)c1ccsc1 ZINC000423407938 1038219871 /nfs/dbraw/zinc/21/98/71/1038219871.db2.gz WPXZFXUVTLLIEK-XWIAVFTESA-N 2 0 334.916 4.273 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@H](C)CCCC[NH3+] ZINC000423432570 1038234197 /nfs/dbraw/zinc/23/41/97/1038234197.db2.gz MLZIULCKWYWRIX-CABCVRRESA-N 2 0 331.529 4.210 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1C[C@@H](C)c2c1cccc2Br ZINC000423434067 1038236944 /nfs/dbraw/zinc/23/69/44/1038236944.db2.gz NSOWKIZRPTYTGW-LALPHHSUSA-N 2 0 325.294 4.105 20 0 EIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000423464704 1038243422 /nfs/dbraw/zinc/24/34/22/1038243422.db2.gz GYLSNCRNVYGWAP-UZKOGDIHSA-N 2 0 338.495 4.086 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423467248 1038244091 /nfs/dbraw/zinc/24/40/91/1038244091.db2.gz BIAHKUZYPOHTHJ-UKRRQHHQSA-N 2 0 347.503 4.440 20 0 EIADRP Clc1cccc([C@H](Cc2cccnc2)[NH2+]CCC[C@@H]2CCC[NH2+]2)c1 ZINC000423469090 1038245155 /nfs/dbraw/zinc/24/51/55/1038245155.db2.gz CHLJRHVTOPDTFC-PMACEKPBSA-N 2 0 343.902 4.141 20 0 EIADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(SCC(F)F)cc1 ZINC000423476708 1038247128 /nfs/dbraw/zinc/24/71/28/1038247128.db2.gz JIYOVKAAPSTNOT-DZGCQCFKSA-N 2 0 328.472 4.227 20 0 EIADRP C[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cc(Cl)ccc1OC(F)F ZINC000423477599 1038249441 /nfs/dbraw/zinc/24/94/41/1038249441.db2.gz KCUWRRWMSVSQCY-WCQYABFASA-N 2 0 332.822 4.124 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)s1 ZINC000423477283 1038250151 /nfs/dbraw/zinc/25/01/51/1038250151.db2.gz SEXKOYUEVSGIFG-UWWQBHOKSA-N 2 0 332.488 4.240 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cccc(F)c1 ZINC000423480403 1038251443 /nfs/dbraw/zinc/25/14/43/1038251443.db2.gz WBIPAIAELOWMDS-CFLQYTFWSA-N 2 0 330.422 4.009 20 0 EIADRP CSC[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1 ZINC000423479219 1038251629 /nfs/dbraw/zinc/25/16/29/1038251629.db2.gz USAMWMDXUYILCJ-KCXAZCMYSA-N 2 0 346.462 4.217 20 0 EIADRP Brc1ccc([C@@H]([NH2+]CCC[C@H]2CCC[NH2+]2)C2CC2)cc1 ZINC000423480983 1038252203 /nfs/dbraw/zinc/25/22/03/1038252203.db2.gz NVXUVOMWRHNOIS-SJORKVTESA-N 2 0 337.305 4.022 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CC[C@H]([NH2+]CCC[C@@H]3CCC[NH2+]3)C2)cc1 ZINC000423487918 1038260130 /nfs/dbraw/zinc/26/01/30/1038260130.db2.gz UUERBYIQAJNGKH-NJAFHUGGSA-N 2 0 340.433 4.463 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000423496253 1038264544 /nfs/dbraw/zinc/26/45/44/1038264544.db2.gz GGWSAGJGXRCVAU-BJZITVGISA-N 2 0 346.421 4.094 20 0 EIADRP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+][C@@H]2CC[C@@H](C[NH3+])C2)cc1 ZINC000423494484 1038264567 /nfs/dbraw/zinc/26/45/67/1038264567.db2.gz SFTBPWLBOASJFI-DFQSSKMNSA-N 2 0 330.516 4.070 20 0 EIADRP c1c2ccccc2oc1[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cccnc1 ZINC000423491003 1038265502 /nfs/dbraw/zinc/26/55/02/1038265502.db2.gz YLLOWEYSGOLUGW-WIYYLYMNSA-N 2 0 335.451 4.039 20 0 EIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cnc2ccsc2c1 ZINC000423497695 1038267877 /nfs/dbraw/zinc/26/78/77/1038267877.db2.gz HHPFODQPAWOQHJ-RHSMWYFYSA-N 2 0 325.481 4.427 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H](Cc2ccccc2Cl)c2cccs2)C1 ZINC000423512202 1038270490 /nfs/dbraw/zinc/27/04/90/1038270490.db2.gz QSOCQEBIQYRCOA-FRFSOERESA-N 2 0 334.916 4.402 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H](Cc2ccccc2Cl)c2cccs2)C1 ZINC000423512209 1038271060 /nfs/dbraw/zinc/27/10/60/1038271060.db2.gz QSOCQEBIQYRCOA-KMFMINBZSA-N 2 0 334.916 4.402 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000423519159 1038273445 /nfs/dbraw/zinc/27/34/45/1038273445.db2.gz VGUOCQWJXUNJPP-IRWJRLHMSA-N 2 0 326.406 4.059 20 0 EIADRP Cc1c([C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cnn1C(C)(C)C ZINC000423521106 1038274153 /nfs/dbraw/zinc/27/41/53/1038274153.db2.gz SDWFVKKERHJLCC-HNAYVOBHSA-N 2 0 328.504 4.077 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H](Cc2ccccc2Cl)c2ccsc2)C1 ZINC000423522168 1038277228 /nfs/dbraw/zinc/27/72/28/1038277228.db2.gz XOQQEHVAMGHYKM-SKDZVZGDSA-N 2 0 334.916 4.402 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CCC[NH2+]C1CC1 ZINC000423526591 1038279173 /nfs/dbraw/zinc/27/91/73/1038279173.db2.gz LSSUXNIWJHIIIB-GFCCVEGCSA-N 2 0 333.476 4.050 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc(SCC(F)F)cc1 ZINC000423557444 1038283491 /nfs/dbraw/zinc/28/34/91/1038283491.db2.gz ZRNJQWNIOHXFBH-ARLBYUKCSA-N 2 0 340.483 4.083 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423535268 1038286141 /nfs/dbraw/zinc/28/61/41/1038286141.db2.gz CMNWKZXGGRJZPA-AWEZNQCLSA-N 2 0 327.497 4.079 20 0 EIADRP Fc1ccc(C([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c2ccc(F)cc2)cc1 ZINC000423540610 1038289323 /nfs/dbraw/zinc/28/93/23/1038289323.db2.gz KALRFJHKYJTQMZ-SQGPQFPESA-N 2 0 342.433 4.032 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@H](Cc2cccnc2)c2cccc(Cl)c2)C1 ZINC000574749288 1038324880 /nfs/dbraw/zinc/32/48/80/1038324880.db2.gz HLTMUAQBEJPSRX-CWFSZBLJSA-N 2 0 343.902 4.126 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@@H](c1cccc(F)c1)c1cccc(Cl)c1 ZINC000490155542 1038347338 /nfs/dbraw/zinc/34/73/38/1038347338.db2.gz DPBKQFDOEWAGMC-LJQANCHMSA-N 2 0 334.866 4.500 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@H](c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000490157858 1038364132 /nfs/dbraw/zinc/36/41/32/1038364132.db2.gz OSQSXKUBUFMIHJ-LJQANCHMSA-N 2 0 348.437 4.309 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(F)cc2C)CC1)CC1CC1 ZINC001168423748 1038498504 /nfs/dbraw/zinc/49/85/04/1038498504.db2.gz QDKIBHCCJBWSPY-UHFFFAOYSA-N 2 0 332.507 4.468 20 0 EIADRP Clc1ccc2c(c1)[C@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CC2 ZINC000539036499 1038789194 /nfs/dbraw/zinc/78/91/94/1038789194.db2.gz GOGYFVPPUSTWFG-HXUWFJFHSA-N 2 0 341.886 4.229 20 0 EIADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1 ZINC000480763877 1038803514 /nfs/dbraw/zinc/80/35/14/1038803514.db2.gz WQDIHPYEQDJFEE-PBASOCQRSA-N 2 0 336.564 4.213 20 0 EIADRP CC(C)CCOc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000480775859 1038811795 /nfs/dbraw/zinc/81/17/95/1038811795.db2.gz QPKPYDLFMQXTRH-ZWKOTPCHSA-N 2 0 330.516 4.246 20 0 EIADRP C[NH+](C)C1CCC([NH+]2CCC3(CCCc4ccccc43)CC2)CC1 ZINC001168313416 1038813447 /nfs/dbraw/zinc/81/34/47/1038813447.db2.gz BXAXCSTUOZCTTI-UHFFFAOYSA-N 2 0 326.528 4.229 20 0 EIADRP CCCCCC[C@](CC)([NH2+]C1CCC([NH+](C)C)CC1)C(=O)OCC ZINC001168315926 1038825451 /nfs/dbraw/zinc/82/54/51/1038825451.db2.gz RBYMLZFCXWKFKK-QLOJAFMTSA-N 2 0 340.552 4.131 20 0 EIADRP Cc1cccc2c1CC[C@@H]2[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000539082142 1038828730 /nfs/dbraw/zinc/82/87/30/1038828730.db2.gz LWJGXWRRGFMAKB-VGSWGCGISA-N 2 0 338.495 4.274 20 0 EIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1C[C@@H]1Cc1ccccc1 ZINC000539088419 1038830710 /nfs/dbraw/zinc/83/07/10/1038830710.db2.gz SHKGEYDSSOOHOU-PVSGBFIBSA-N 2 0 334.507 4.118 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000424369185 1038838712 /nfs/dbraw/zinc/83/87/12/1038838712.db2.gz BIGLCJRJVLRBOY-BAESOJJISA-N 2 0 331.287 4.009 20 0 EIADRP CC1(c2ccccc2)CCC([NH2+]C2CC[NH+](C3CCC3)CC2)CC1 ZINC000504911979 1038849018 /nfs/dbraw/zinc/84/90/18/1038849018.db2.gz OKTQFBAIBHZQFC-UHFFFAOYSA-N 2 0 326.528 4.493 20 0 EIADRP Fc1ccccc1CC1(C[NH2+]C2CC[NH+](CC3CC3)CC2)CCC1 ZINC001168364838 1038851625 /nfs/dbraw/zinc/85/16/25/1038851625.db2.gz IQSXIUYOHGQNGN-UHFFFAOYSA-N 2 0 330.491 4.003 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000539160620 1038862962 /nfs/dbraw/zinc/86/29/62/1038862962.db2.gz QKFXDEDQGIWJGV-GUYCJALGSA-N 2 0 326.406 4.088 20 0 EIADRP Brc1ccc(C2([NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)CCC2)cc1 ZINC000252734721 1038862926 /nfs/dbraw/zinc/86/29/26/1038862926.db2.gz ZEUIZNQQZUQMGP-IRXDYDNUSA-N 2 0 349.316 4.045 20 0 EIADRP C[NH+](C)C1CCC(n2cc(C3CC[NH2+]CC3)c3ccccc32)CC1 ZINC001168322748 1038871509 /nfs/dbraw/zinc/87/15/09/1038871509.db2.gz GYISCRPOFVGYGV-UHFFFAOYSA-N 2 0 325.500 4.154 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000539201327 1038879025 /nfs/dbraw/zinc/87/90/25/1038879025.db2.gz WTWIIUSWZHCSHY-KDOFPFPSSA-N 2 0 340.433 4.478 20 0 EIADRP COc1ccc([C@@H]([NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)C2CC2)cc1 ZINC000539215682 1038886543 /nfs/dbraw/zinc/88/65/43/1038886543.db2.gz BZBQSDINQUHZDR-UWJYYQICSA-N 2 0 330.516 4.104 20 0 EIADRP C[NH+](C)C1CCC([N@@H+]2CCSC[C@@H]2c2cccc(Cl)c2)CC1 ZINC001168327562 1038898317 /nfs/dbraw/zinc/89/83/17/1038898317.db2.gz OQZBDRJLLGDFBC-DAWZGUTISA-N 2 0 338.948 4.303 20 0 EIADRP CC[NH+]1CCC([NH2+]C[C@H]2CC3c4ccccc4C2c2ccccc23)CC1 ZINC000539308077 1038974885 /nfs/dbraw/zinc/97/48/85/1038974885.db2.gz FLLJYTBEUGGUJI-ZPSAWSNLSA-N 2 0 346.518 4.358 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2ccc(F)cc2C(F)(F)F)cc1 ZINC000414805562 1038987445 /nfs/dbraw/zinc/98/74/45/1038987445.db2.gz GNQYIJPDABCKDZ-NSHDSACASA-N 2 0 326.337 4.154 20 0 EIADRP CCOc1cc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc(Cl)c1OC ZINC000414804491 1039000651 /nfs/dbraw/zinc/00/06/51/1039000651.db2.gz FIRXEQPMOKNWCK-ZDUSSCGKSA-N 2 0 348.874 4.057 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2cc(C(F)(F)F)ccc2F)cc1 ZINC000414806681 1039018764 /nfs/dbraw/zinc/01/87/64/1039018764.db2.gz HYRQWISRGVBLTC-LLVKDONJSA-N 2 0 326.337 4.154 20 0 EIADRP CC(C)CCOc1ccc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1 ZINC000414815113 1039091235 /nfs/dbraw/zinc/09/12/35/1039091235.db2.gz WUSFANUZBVVUIT-QGZVFWFLSA-N 2 0 326.484 4.421 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2ccc(-c3ccc(F)cc3)o2)C[C@@H]1C ZINC000552070780 1039097008 /nfs/dbraw/zinc/09/70/08/1039097008.db2.gz DJZFMJRANKPBFA-YJBOKZPZSA-N 2 0 330.447 4.390 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCc3c2cccc3OC)c1 ZINC000481295304 1039232085 /nfs/dbraw/zinc/23/20/85/1039232085.db2.gz OHYHUWXAXNYELX-NRFANRHFSA-N 2 0 338.495 4.314 20 0 EIADRP C[NH+](C)C1CCC([NH2+]C(Cc2ccccc2)Cc2ccccc2)CC1 ZINC000552248438 1039298149 /nfs/dbraw/zinc/29/81/49/1039298149.db2.gz HEEOCYSYFKXASG-UHFFFAOYSA-N 2 0 336.523 4.303 20 0 EIADRP Cc1ccnc([C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000552277141 1039349659 /nfs/dbraw/zinc/34/96/59/1039349659.db2.gz PJUCXQMDZIZKDG-SVFBPWRDSA-N 2 0 337.511 4.341 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1)c1ccc2n[nH]cc2c1 ZINC000552338648 1039403206 /nfs/dbraw/zinc/40/32/06/1039403206.db2.gz LCBYTTIECYXVNT-GQIGUUNPSA-N 2 0 340.515 4.257 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2ccc(SC)c(OC)c2)CC1 ZINC000121779958 1039419907 /nfs/dbraw/zinc/41/99/07/1039419907.db2.gz HBHNBNVXTPRXLA-OAHLLOKOSA-N 2 0 336.545 4.190 20 0 EIADRP C[N@@H+]1CC[C@]2(CC[NH+](C3CCC(c4ccc(Cl)cc4)CC3)C2)C1 ZINC001168348484 1039552470 /nfs/dbraw/zinc/55/24/70/1039552470.db2.gz YYMGVMMQXNYNHE-UUKMXZOPSA-N 2 0 332.919 4.394 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)c(C)c1 ZINC000122367375 1039680810 /nfs/dbraw/zinc/68/08/10/1039680810.db2.gz GAIVDGVTGLBBIE-GOSISDBHSA-N 2 0 326.484 4.095 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000643534629 1039715893 /nfs/dbraw/zinc/71/58/93/1039715893.db2.gz ZEFNQKRRGHEGDC-LRDDRELGSA-N 2 0 345.487 4.050 20 0 EIADRP CCCOc1ccc(C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1OCC ZINC000061003160 1039781153 /nfs/dbraw/zinc/78/11/53/1039781153.db2.gz DXYGHAMZHXOFPR-UHFFFAOYSA-N 2 0 348.531 4.273 20 0 EIADRP FC(F)(F)[C@@H](CC[NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1 ZINC000550858125 1039789089 /nfs/dbraw/zinc/78/90/89/1039789089.db2.gz KJOAIMXDNQNZQS-SFHVURJKSA-N 2 0 340.433 4.187 20 0 EIADRP C[N@@H+]1CC[C@@]2(CC[NH+](CCCCc3cccc(C(F)(F)F)c3)C2)C1 ZINC000430121181 1039845219 /nfs/dbraw/zinc/84/52/19/1039845219.db2.gz GIVINGOSNIDYIB-GOSISDBHSA-N 2 0 340.433 4.056 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC23CC[NH2+]CC3)cc1 ZINC000666954264 1039860879 /nfs/dbraw/zinc/86/08/79/1039860879.db2.gz SUDJWKZZLCXDIX-YESZJQIVSA-N 2 0 338.417 4.073 20 0 EIADRP C(=C/c1ccc(OCc2ccccc2)cc1)\C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666955510 1039866660 /nfs/dbraw/zinc/86/66/60/1039866660.db2.gz SMVPJOZWEJENII-SNXGKTBFSA-N 2 0 348.490 4.011 20 0 EIADRP Cc1cccc(C)c1OCC[NH2+][C@@H]1CCN(C)[C@@H](c2ccccc2)C1 ZINC000551013212 1039877203 /nfs/dbraw/zinc/87/72/03/1039877203.db2.gz GVXIAUWJKFJCRC-NHCUHLMSSA-N 2 0 338.495 4.107 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cccc(-c3ccccn3)c2)CC1 ZINC000535082789 1039918158 /nfs/dbraw/zinc/91/81/58/1039918158.db2.gz BECLYDWIKDAHMP-UHFFFAOYSA-N 2 0 337.511 4.301 20 0 EIADRP COc1ccc(CC[C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000481978127 1039924416 /nfs/dbraw/zinc/92/44/16/1039924416.db2.gz ZJLPEQFGKBXERU-SFHVURJKSA-N 2 0 344.543 4.403 20 0 EIADRP C[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]CCc1cc(F)cc(F)c1 ZINC000482132480 1040026030 /nfs/dbraw/zinc/02/60/30/1040026030.db2.gz YHANFRQDDNUZKB-HRAATJIYSA-N 2 0 344.449 4.008 20 0 EIADRP COc1cccc2cc([C@H](C)[NH2+]CCCCC[NH+]3CCCC3)oc21 ZINC000551259402 1040103399 /nfs/dbraw/zinc/10/33/99/1040103399.db2.gz PADIMLMJZMFEAS-INIZCTEOSA-N 2 0 330.472 4.358 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(F)c1 ZINC000162903801 1040107215 /nfs/dbraw/zinc/10/72/15/1040107215.db2.gz BXFUGZOSHXDODD-MRXNPFEDSA-N 2 0 342.458 4.281 20 0 EIADRP CC(C)CC[C@@](C)(O)C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000551266771 1040129017 /nfs/dbraw/zinc/12/90/17/1040129017.db2.gz DUCTULVQMKIMSR-LZBANZJXSA-N 2 0 346.559 4.206 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccc(F)c(F)c2)CC1 ZINC000551271131 1040134502 /nfs/dbraw/zinc/13/45/02/1040134502.db2.gz UZYMZBDZLNTLNK-UHFFFAOYSA-N 2 0 344.449 4.498 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC000479197772 1040194115 /nfs/dbraw/zinc/19/41/15/1040194115.db2.gz VDQLNLQJZQFCKT-LJQANCHMSA-N 2 0 344.886 4.058 20 0 EIADRP COc1ccc([C@H]2CCCC[C@H]2[NH2+]CCC2CC[NH+](C)CC2)cc1F ZINC000482358714 1040195273 /nfs/dbraw/zinc/19/52/73/1040195273.db2.gz NGKIQFJMPDBBNI-UYAOXDASSA-N 2 0 348.506 4.182 20 0 EIADRP CC1=CC[C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000551308382 1040197065 /nfs/dbraw/zinc/19/70/65/1040197065.db2.gz KKCQMEUQEIAPKD-OAQYLSRUSA-N 2 0 342.527 4.146 20 0 EIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]CC1CC[NH+](C)CC1 ZINC000482540798 1040327472 /nfs/dbraw/zinc/32/74/72/1040327472.db2.gz VJSNMFMTIIWGFC-IBGZPJMESA-N 2 0 328.525 4.272 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H]2CCCc3c(Cl)sc(Cl)c32)CC1 ZINC000482562311 1040353684 /nfs/dbraw/zinc/35/36/84/1040353684.db2.gz QEHDCGJTJUHUQC-LBPRGKRZSA-N 2 0 333.328 4.364 20 0 EIADRP C[C@@H](C[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000666993721 1040365881 /nfs/dbraw/zinc/36/58/81/1040365881.db2.gz GIUWQYBUYCFZFX-XJKSGUPXSA-N 2 0 326.406 4.073 20 0 EIADRP COC1CCC(C)(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000479447864 1040376276 /nfs/dbraw/zinc/37/62/76/1040376276.db2.gz DRMJOMMKMZWRPQ-NTYOPAKOSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000479466322 1040390931 /nfs/dbraw/zinc/39/09/31/1040390931.db2.gz RNJJXZYXLKYOIR-TVTNDZMWSA-N 2 0 338.470 4.171 20 0 EIADRP c1ccc(C[NH+]2CCC[C@@H]3C[N@H+](CCCc4ccncc4)CC[C@H]32)cc1 ZINC000462314225 1040474337 /nfs/dbraw/zinc/47/43/37/1040474337.db2.gz JBUAKLCMTLYAFJ-DHIUTWEWSA-N 2 0 349.522 4.001 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccnc(Cl)c2)c1 ZINC000163556743 1040507365 /nfs/dbraw/zinc/50/73/65/1040507365.db2.gz DESYXCLHKYGULQ-HNNXBMFYSA-N 2 0 331.891 4.428 20 0 EIADRP CCc1nc2c(s1)[C@H]([NH2+]CCCCC[NH+]1CCCCC1)CCC2 ZINC000482948830 1040588855 /nfs/dbraw/zinc/58/88/55/1040588855.db2.gz SOIDTOXTMIOMNC-MRXNPFEDSA-N 2 0 335.561 4.329 20 0 EIADRP COc1cc2c(NC[C@@H](c3cccs3)[NH+](C)C)cc[nH+]c2cc1F ZINC000479855406 1040709722 /nfs/dbraw/zinc/70/97/22/1040709722.db2.gz ZCELWYXZBSHRTN-INIZCTEOSA-N 2 0 345.443 4.159 20 0 EIADRP C[C@@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1ccccc1OC(F)F ZINC000483188975 1040764645 /nfs/dbraw/zinc/76/46/45/1040764645.db2.gz YHOXJVZEFABAIP-CJNGLKHVSA-N 2 0 328.447 4.305 20 0 EIADRP C[C@H]([NH2+]CCOC1CCCCCC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000483189800 1040767224 /nfs/dbraw/zinc/76/72/24/1040767224.db2.gz CNKPXQVKAXTIOW-SFHVURJKSA-N 2 0 348.531 4.017 20 0 EIADRP CC[NH+](CC)C[C@H]1CCN([C@@H](C)c2cccc(Br)c2)C1 ZINC000483209517 1040769521 /nfs/dbraw/zinc/76/95/21/1040769521.db2.gz BVGDNQKOEJWQNO-LSDHHAIUSA-N 2 0 339.321 4.174 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2sccc2OC)CC1)CC1CC1 ZINC000537755605 1040808240 /nfs/dbraw/zinc/80/82/40/1040808240.db2.gz MSNCYCLXTNNTON-UHFFFAOYSA-N 2 0 336.545 4.091 20 0 EIADRP COc1ccc(C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)cc1Cl ZINC000462671957 1040816414 /nfs/dbraw/zinc/81/64/14/1040816414.db2.gz DEUYEWFVOZVPKV-IYBDPMFKSA-N 2 0 338.923 4.196 20 0 EIADRP C[N@H+](Cc1ccnn1-c1cc[nH+]cc1)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000668235278 1040818456 /nfs/dbraw/zinc/81/84/56/1040818456.db2.gz HRDSXDUIDXKPBP-NHCUHLMSSA-N 2 0 332.451 4.035 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(F)cc2C(F)(F)F)[C@@H](C)C1 ZINC000539834792 1040829831 /nfs/dbraw/zinc/82/98/31/1040829831.db2.gz FZURXILMAVCPNV-BLLLJJGKSA-N 2 0 332.385 4.007 20 0 EIADRP Cc1ncsc1CN(C[C@H]1CC[NH2+]C1)[C@H](C)c1cccc(Cl)c1 ZINC000436045938 1040838042 /nfs/dbraw/zinc/83/80/42/1040838042.db2.gz AAZMLIUXAPEVHS-CABCVRRESA-N 2 0 349.931 4.278 20 0 EIADRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)CC1 ZINC000462766170 1040904024 /nfs/dbraw/zinc/90/40/24/1040904024.db2.gz JAJRGNBMLMXYMR-UHFFFAOYSA-N 2 0 348.437 4.436 20 0 EIADRP CC[NH+]1CCC(CC[NH2+]Cc2cc(C)c(C)cc2OC(F)F)CC1 ZINC000462766884 1040904088 /nfs/dbraw/zinc/90/40/88/1040904088.db2.gz QZEDKWOCSXAEKQ-UHFFFAOYSA-N 2 0 340.458 4.116 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCCN2CC)cc1OC ZINC000480082867 1040938603 /nfs/dbraw/zinc/93/86/03/1040938603.db2.gz GTIQOVXBTMSKJN-SJLPKXTDSA-N 2 0 334.504 4.009 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1ccc(COc2ccccc2)cc1 ZINC000537988283 1040964515 /nfs/dbraw/zinc/96/45/15/1040964515.db2.gz WHISYYCMHTXXKA-JBYIUTFZSA-N 2 0 338.495 4.084 20 0 EIADRP Clc1cccc([C@@H]([NH2+]CCCCn2ccnc2)c2ccccn2)c1 ZINC000924734087 1040965851 /nfs/dbraw/zinc/96/58/51/1040965851.db2.gz YAZYMPYIWUXNKJ-LJQANCHMSA-N 2 0 340.858 4.091 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2ccccc2Br)CC1 ZINC000483722466 1040974411 /nfs/dbraw/zinc/97/44/11/1040974411.db2.gz DIYZXVICCHAIQY-AWEZNQCLSA-N 2 0 339.321 4.222 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)c1ccccn1 ZINC000898523030 1040977281 /nfs/dbraw/zinc/97/72/81/1040977281.db2.gz XLSSUQWYBOFJTM-AYWYSENESA-N 2 0 335.495 4.033 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000483737429 1040991632 /nfs/dbraw/zinc/99/16/32/1040991632.db2.gz VDDUFOJCKWMKQL-RHSMWYFYSA-N 2 0 340.433 4.057 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2cc3c(cccc3F)[nH]2)C1 ZINC000436277027 1041023021 /nfs/dbraw/zinc/02/30/21/1041023021.db2.gz VXSUHGGWGIORDW-HOTGVXAUSA-N 2 0 331.479 4.155 20 0 EIADRP C[C@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000480170114 1041031480 /nfs/dbraw/zinc/03/14/80/1041031480.db2.gz XVXNOWSEXRVFKO-KSFYIVLOSA-N 2 0 338.470 4.445 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H]2CCCC[C@H]2c2ccc(OC)c(F)c2)CC1 ZINC000480170794 1041033819 /nfs/dbraw/zinc/03/38/19/1041033819.db2.gz RGWYZKOYTTZNRC-ICSRJNTNSA-N 2 0 348.506 4.325 20 0 EIADRP F[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000554374164 1041058256 /nfs/dbraw/zinc/05/82/56/1041058256.db2.gz PKOFMVVZQXZXPM-QGLKVJOYSA-N 2 0 330.491 4.157 20 0 EIADRP C([NH2+]C1CCC2(CCOCC2)CC1)[C@@H]1CCC[N@@H+]1C1CCCCC1 ZINC000436296300 1041062648 /nfs/dbraw/zinc/06/26/48/1041062648.db2.gz RDYPIIUIANJKJW-FQEVSTJZSA-N 2 0 334.548 4.113 20 0 EIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H]3CC[C@@H]3C(C)(C)C)cc2)CC1 ZINC000554378064 1041063690 /nfs/dbraw/zinc/06/36/90/1041063690.db2.gz ZHPGULOQJXOICV-VQTJNVASSA-N 2 0 330.516 4.074 20 0 EIADRP C[C@H]1Cc2ccc(F)cc2[C@H]1[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000480244550 1041101823 /nfs/dbraw/zinc/10/18/23/1041101823.db2.gz VMXBQDHDJWRSKK-AOMKIAJQSA-N 2 0 338.470 4.445 20 0 EIADRP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000480253197 1041134896 /nfs/dbraw/zinc/13/48/96/1041134896.db2.gz WOSGGUXKBRVXJV-WMZOPIPTSA-N 2 0 342.449 4.262 20 0 EIADRP COc1cc(CC[NH2+][C@H](C)c2ccc(-n3ccnc3)cc2)ccc1C ZINC000484160257 1041148086 /nfs/dbraw/zinc/14/80/86/1041148086.db2.gz LVZXZLMCPLGHOT-QGZVFWFLSA-N 2 0 335.451 4.083 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cc(Cl)cc(Cl)c1 ZINC000484289491 1041195550 /nfs/dbraw/zinc/19/55/50/1041195550.db2.gz FXQQQBPMPTVTEA-MLGOLLRUSA-N 2 0 333.303 4.001 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccc(Sc2ccccc2)cc1 ZINC000540148278 1041196241 /nfs/dbraw/zinc/19/62/41/1041196241.db2.gz YKEWNEZPRJDYCY-OXQOHEQNSA-N 2 0 326.509 4.268 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@H](c2ccccc2)C(C)C)[C@H](C)C1 ZINC000480331508 1041217737 /nfs/dbraw/zinc/21/77/37/1041217737.db2.gz HBIHUOZWCJGSGI-HJNYFJLDSA-N 2 0 346.559 4.153 20 0 EIADRP CSc1ccccc1[C@H](C)[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000194855125 1041232788 /nfs/dbraw/zinc/23/27/88/1041232788.db2.gz UAJKGUMQIHSXSM-INIZCTEOSA-N 2 0 344.524 4.200 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]C2CC(c3cc(F)cc(F)c3)C2)c1 ZINC000515918819 1041263021 /nfs/dbraw/zinc/26/30/21/1041263021.db2.gz WZVBYHQRZOHYMO-UHFFFAOYSA-N 2 0 344.449 4.452 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]C2CCC3(CCCO3)CC2)c1 ZINC000567416703 1041324997 /nfs/dbraw/zinc/32/49/97/1041324997.db2.gz ZPVKZWQOZUKKNP-UHFFFAOYSA-N 2 0 330.516 4.110 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](c2ccc(C(F)(F)F)cc2)C(C)C)C1 ZINC000540258969 1041326318 /nfs/dbraw/zinc/32/63/18/1041326318.db2.gz KLUZKOPAYWHPDU-WMLDXEAASA-N 2 0 328.422 4.334 20 0 EIADRP CC[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000538408849 1041328022 /nfs/dbraw/zinc/32/80/22/1041328022.db2.gz UKAKJSONDKBXFK-INIZCTEOSA-N 2 0 327.299 4.166 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CCc2cccc(F)c2)CCN1Cc1ccccc1 ZINC000463138084 1041372601 /nfs/dbraw/zinc/37/26/01/1041372601.db2.gz UNOZMODIRBJRIK-LAUBAEHRSA-N 2 0 326.459 4.011 20 0 EIADRP c1ccc(C[N@@H+]2CC[C@]3(CC[NH+]([C@H]4C[C@H]4c4ccccc4)C3)C2)cc1 ZINC000463195389 1041409804 /nfs/dbraw/zinc/40/98/04/1041409804.db2.gz WXQLQIMQIKDFFF-VABKMULXSA-N 2 0 332.491 4.141 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]CC[C@H]2CCC[N@@H+]2C)cc1OC ZINC000540377593 1041427700 /nfs/dbraw/zinc/42/77/00/1041427700.db2.gz QHYHLNPFPKZLNH-FUHWJXTLSA-N 2 0 334.504 4.009 20 0 EIADRP CCc1nc2c(s1)[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)CCC2 ZINC000480628801 1041432757 /nfs/dbraw/zinc/43/27/57/1041432757.db2.gz ZSSITPGBCKNOMI-MRXNPFEDSA-N 2 0 335.561 4.185 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(OC(F)F)cc1 ZINC000480629484 1041433195 /nfs/dbraw/zinc/43/31/95/1041433195.db2.gz DVGRKGHDZNNMQG-HOTGVXAUSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CCSCc2ccc(Cl)cc2Cl)CC[N@@H+]1C ZINC000540396775 1041440708 /nfs/dbraw/zinc/44/07/08/1041440708.db2.gz DLILSPOWAWAWBZ-WFASDCNBSA-N 2 0 347.355 4.299 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]C1CC(C[NH3+])C1 ZINC000904361996 1041450901 /nfs/dbraw/zinc/45/09/01/1041450901.db2.gz FIXIDAPIHNDZDX-CKQAKLJMSA-N 2 0 335.904 4.160 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(OCC3CC3)cc2)C1 ZINC000480658365 1041458264 /nfs/dbraw/zinc/45/82/64/1041458264.db2.gz CLAIATDHOARKIM-GOSISDBHSA-N 2 0 330.516 4.077 20 0 EIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]C3(Cc4ccccc4)CC3)CC2)C1 ZINC000480668078 1041460301 /nfs/dbraw/zinc/46/03/01/1041460301.db2.gz VDHWVBLGLJIIEX-GHTZIAJQSA-N 2 0 326.528 4.394 20 0 EIADRP COCCC[C@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000480723742 1041491100 /nfs/dbraw/zinc/49/11/00/1041491100.db2.gz FCPDDIBIHIVNBU-OTWHNJEPSA-N 2 0 332.532 4.069 20 0 EIADRP CC(C)c1ccc(-c2nc(CN3CC[C@@H]([C@@H](C)[NH3+])C3)cs2)cc1 ZINC000484908981 1041515684 /nfs/dbraw/zinc/51/56/84/1041515684.db2.gz SCZGAYAXZZWWMF-RHSMWYFYSA-N 2 0 329.513 4.103 20 0 EIADRP CC[C@@H](C[NH+]1CCC(OCC[NH+](CC)CC)CC1)c1ccccc1 ZINC000538763441 1041536818 /nfs/dbraw/zinc/53/68/18/1041536818.db2.gz DWNPXFQWJGAUHT-IBGZPJMESA-N 2 0 332.532 4.003 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc(-c4ccccc4F)o3)CC[C@@H]21 ZINC000538799164 1041539108 /nfs/dbraw/zinc/53/91/08/1041539108.db2.gz RRENVKHCEKAYTI-BEFAXECRSA-N 2 0 328.431 4.002 20 0 EIADRP Cc1nccn1CCC[NH2+][C@@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000516881759 1041794418 /nfs/dbraw/zinc/79/44/18/1041794418.db2.gz GCGUBAXTWFKXPF-INIZCTEOSA-N 2 0 338.499 4.409 20 0 EIADRP CC(C)(C)[C@H]1CCC[N@@H+]1CC1(C[NH+]2CCC[C@H]2C(C)(C)C)COC1 ZINC000541071927 1041798339 /nfs/dbraw/zinc/79/83/39/1041798339.db2.gz RDLDVISRDQIQPI-HDICACEKSA-N 2 0 336.564 4.024 20 0 EIADRP C[C@@H](C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cccc(Cl)c1 ZINC000470357612 1041822360 /nfs/dbraw/zinc/82/23/60/1041822360.db2.gz QJACVQWWCOTKKQ-INIZCTEOSA-N 2 0 343.902 4.345 20 0 EIADRP c1ccc(OCCCC[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1 ZINC000437751846 1041896165 /nfs/dbraw/zinc/89/61/65/1041896165.db2.gz LUNZCWGSOTZMPY-UHFFFAOYSA-N 2 0 330.516 4.090 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccc(OCc2ccccc2)cc1 ZINC000301219593 1041897542 /nfs/dbraw/zinc/89/75/42/1041897542.db2.gz XUHYYTOYZQVADR-GOSISDBHSA-N 2 0 326.484 4.258 20 0 EIADRP FC1(F)CC(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000425940690 1042017698 /nfs/dbraw/zinc/01/76/98/1042017698.db2.gz XNIPNMOUVJKIMA-HSALFYBXSA-N 2 0 348.481 4.312 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCn1c2ccccc2c2ccccc21 ZINC000541571129 1042019592 /nfs/dbraw/zinc/01/95/92/1042019592.db2.gz OSXMEAVDWABZPZ-FUHIMQAGSA-N 2 0 335.495 4.113 20 0 EIADRP c1ccc(OCCCCC[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1 ZINC000438100028 1042048359 /nfs/dbraw/zinc/04/83/59/1042048359.db2.gz YEJNBWKHWKYFNO-FQEVSTJZSA-N 2 0 330.516 4.186 20 0 EIADRP CC(C)Oc1ccccc1C[NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000517537497 1042070281 /nfs/dbraw/zinc/07/02/81/1042070281.db2.gz VZJUCCNFFKJOCC-KDURUIRLSA-N 2 0 332.532 4.322 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](CSC)c2ccc(C(F)(F)F)cc2)C1 ZINC000541916180 1042178761 /nfs/dbraw/zinc/17/87/61/1042178761.db2.gz DTIGOMLQKZAYKM-CZUORRHYSA-N 2 0 346.462 4.041 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000414933627 1042218189 /nfs/dbraw/zinc/21/81/89/1042218189.db2.gz XBKXOFQCQSQPPW-QZWWFDLISA-N 2 0 326.406 4.201 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2cccc(F)c2F)CCCC1 ZINC000426063596 1042238676 /nfs/dbraw/zinc/23/86/76/1042238676.db2.gz PPOGMKDSJBBIFP-IIDMSEBBSA-N 2 0 336.470 4.095 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2cccc(F)c2F)CCCC1 ZINC000426063598 1042240181 /nfs/dbraw/zinc/24/01/81/1042240181.db2.gz PPOGMKDSJBBIFP-RVKKMQEKSA-N 2 0 336.470 4.095 20 0 EIADRP OC[C@@H]1CCC[N@@H+]1CCCC[NH2+][C@H](c1ccccc1)C1CCCCC1 ZINC000542084054 1042270098 /nfs/dbraw/zinc/27/00/98/1042270098.db2.gz AJFCAXCQVRZOPK-FCHUYYIVSA-N 2 0 344.543 4.135 20 0 EIADRP Cc1cc(CN(C)C2CC[NH+](C(C)C)CC2)sc1Br ZINC000506344026 1042338954 /nfs/dbraw/zinc/33/89/54/1042338954.db2.gz WSRZZBSDQXMZJX-UHFFFAOYSA-N 2 0 345.350 4.124 20 0 EIADRP COc1ccc2cc(C[N@H+](C)C3CC[NH+](C(C)C)CC3)ccc2c1 ZINC000506386035 1042367301 /nfs/dbraw/zinc/36/73/01/1042367301.db2.gz NMEUMFSNNRBNBA-UHFFFAOYSA-N 2 0 326.484 4.153 20 0 EIADRP COc1ccc(C[N@H+](C)C2CC[NH+](C(C)C)CC2)c2ccccc12 ZINC000506386014 1042367495 /nfs/dbraw/zinc/36/74/95/1042367495.db2.gz NGJFDEIBYCGLFD-UHFFFAOYSA-N 2 0 326.484 4.153 20 0 EIADRP C[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCN3)CC[N@@H+]1Cc1ccccc1 ZINC000414974628 1042461824 /nfs/dbraw/zinc/46/18/24/1042461824.db2.gz DUDJKIOKKVBLDZ-PGRDOPGGSA-N 2 0 349.522 4.187 20 0 EIADRP CSc1ccc([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1 ZINC000173364756 1042567747 /nfs/dbraw/zinc/56/77/47/1042567747.db2.gz MIRPHRKCZSVTCX-MRXNPFEDSA-N 2 0 344.524 4.200 20 0 EIADRP C[C@@H]([NH2+]CCOC1CCCCCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492398269 1042634634 /nfs/dbraw/zinc/63/46/34/1042634634.db2.gz GVDWKSMOSKSGOY-CTNGQTDRSA-N 2 0 344.543 4.226 20 0 EIADRP S=c1oc2cc(Cl)ccc2n1CN1CCC(n2ccnc2)CC1 ZINC000152079055 1042638097 /nfs/dbraw/zinc/63/80/97/1042638097.db2.gz LYEOENHEOAMQSL-UHFFFAOYSA-N 2 0 348.859 4.108 20 0 EIADRP CCSc1cccc(C[NH2+]Cc2cc(-n3ccnc3)cs2)c1 ZINC000492482095 1042667669 /nfs/dbraw/zinc/66/76/69/1042667669.db2.gz FZCOFTKQJPVAQJ-UHFFFAOYSA-N 2 0 329.494 4.336 20 0 EIADRP CCCc1csc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)n1 ZINC000426417204 1042680067 /nfs/dbraw/zinc/68/00/67/1042680067.db2.gz PXZMBMCNVLZWPT-UHFFFAOYSA-N 2 0 335.561 4.184 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccc(Br)cc1F ZINC000036984880 1042723758 /nfs/dbraw/zinc/72/37/58/1042723758.db2.gz UQJVYYJAUDXPPM-CYBMUJFWSA-N 2 0 345.300 4.188 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(Cl)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309875648 1042823143 /nfs/dbraw/zinc/82/31/43/1042823143.db2.gz SYKBHBQASWVKIU-VQIMIIECSA-N 2 0 328.887 4.340 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)c1ccc(OCc2ccccc2)cc1 ZINC000309876398 1042823858 /nfs/dbraw/zinc/82/38/58/1042823858.db2.gz JCDHVRIXCGSZSY-ZWKOTPCHSA-N 2 0 326.484 4.256 20 0 EIADRP C[C@H]([NH2+]CCSc1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310170866 1042830178 /nfs/dbraw/zinc/83/01/78/1042830178.db2.gz UAUPBAFOHWMDDW-ICSRJNTNSA-N 2 0 340.536 4.279 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310236023 1042832230 /nfs/dbraw/zinc/83/22/30/1042832230.db2.gz KSFFZNFLYDVSOF-QXAKKESOSA-N 2 0 336.470 4.312 20 0 EIADRP CC(C)Oc1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000310991159 1042849949 /nfs/dbraw/zinc/84/99/49/1042849949.db2.gz HTDJSTJXTMEJGQ-NRFANRHFSA-N 2 0 338.495 4.086 20 0 EIADRP FC(F)(F)C1CCC(C[NH2+]C2CC[NH+](C3CCCC3)CC2)CC1 ZINC000178216242 1042861294 /nfs/dbraw/zinc/86/12/94/1042861294.db2.gz XYGZHCCHGHAWGY-UHFFFAOYSA-N 2 0 332.454 4.352 20 0 EIADRP CSc1ccc(C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000178590710 1042869692 /nfs/dbraw/zinc/86/96/92/1042869692.db2.gz UEJBLAIYYZMZQT-INIZCTEOSA-N 2 0 344.524 4.200 20 0 EIADRP CC[C@@H]1C[C@H](C[N@H+](CC)C[C@@H]2CC[NH+](Cc3ccccc3)C2)CCO1 ZINC000507784520 1042928019 /nfs/dbraw/zinc/92/80/19/1042928019.db2.gz RNPZIUSHFZEVPR-BHIFYINESA-N 2 0 344.543 4.036 20 0 EIADRP Clc1ccc2c(c1)CC[C@@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000089215572 1042939599 /nfs/dbraw/zinc/93/95/99/1042939599.db2.gz KBLIYIVMTTXLAM-FQEVSTJZSA-N 2 0 341.886 4.229 20 0 EIADRP C[C@@H]1CC([NH2+]C2Cc3ccccc3C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168006364 1043000353 /nfs/dbraw/zinc/00/03/53/1043000353.db2.gz NONMJRSHUDZXQQ-QZTJIDSGSA-N 2 0 334.507 4.185 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc2cc(OC)ccc2c1 ZINC000152418117 1043006371 /nfs/dbraw/zinc/00/63/71/1043006371.db2.gz ANTQRRABYMDJEE-KSFYIVLOSA-N 2 0 338.495 4.373 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(Oc3ccccc3)o2)C[C@H]1C ZINC000507809880 1043042031 /nfs/dbraw/zinc/04/20/31/1043042031.db2.gz AMADFQBSMHULST-IAGOWNOFSA-N 2 0 328.456 4.377 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]C2CCN(c3ccc(N(C)C)cc3)CC2)[C@@H](C)C1 ZINC000765955660 1043085128 /nfs/dbraw/zinc/08/51/28/1043085128.db2.gz AURCJEFOSLJJBE-LLGFUMIMSA-N 2 0 329.532 4.136 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168008876 1043085643 /nfs/dbraw/zinc/08/56/43/1043085643.db2.gz YFHVVSLUQIPRRO-UPHUGPLXSA-N 2 0 326.459 4.357 20 0 EIADRP C[C@H]1CC([NH2+]Cc2ccc(F)cc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168008875 1043086277 /nfs/dbraw/zinc/08/62/77/1043086277.db2.gz YFHVVSLUQIPRRO-IRXDYDNUSA-N 2 0 326.459 4.357 20 0 EIADRP Cc1cncc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)c1 ZINC000184346040 1043091433 /nfs/dbraw/zinc/09/14/33/1043091433.db2.gz VZTRWRWAINVFMC-IBGZPJMESA-N 2 0 337.511 4.473 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000310336181 1043125538 /nfs/dbraw/zinc/12/55/38/1043125538.db2.gz BJYGGLMQZQMTDZ-IEBWSBKVSA-N 2 0 326.459 4.389 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc2cnccc2o1 ZINC000657965812 1043222085 /nfs/dbraw/zinc/22/20/85/1043222085.db2.gz BOBQZHSXLJZENT-LNLFQRSKSA-N 2 0 349.478 4.389 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cnc2ccccc2c1 ZINC000727465322 1043227670 /nfs/dbraw/zinc/22/76/70/1043227670.db2.gz AHTAUMXVCRVLEX-UHFFFAOYSA-N 2 0 333.479 4.366 20 0 EIADRP FC(F)(F)c1ccc(CCC[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000674005742 1043270539 /nfs/dbraw/zinc/27/05/39/1043270539.db2.gz NJLABTQLIJHLML-KRWDZBQOSA-N 2 0 340.433 4.056 20 0 EIADRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3OC)cc2)C1 ZINC000508135283 1043287933 /nfs/dbraw/zinc/28/79/33/1043287933.db2.gz DICRAPBCINJDPH-IBGZPJMESA-N 2 0 338.495 4.184 20 0 EIADRP CCOc1ccccc1[C@H](CC(C)C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000166755835 1043311603 /nfs/dbraw/zinc/31/16/03/1043311603.db2.gz PCSDHKPESNIUQL-GGPKGHCWSA-N 2 0 330.516 4.389 20 0 EIADRP C[C@@H]([NH2+][C@@H](c1ccccc1)c1cccc(F)c1)C1CC[NH+](C)CC1 ZINC000168565234 1043373764 /nfs/dbraw/zinc/37/37/64/1043373764.db2.gz KWTJSFICBRNXGZ-IERDGZPVSA-N 2 0 326.459 4.235 20 0 EIADRP CC(C)=CCC[C@H](C)[NH2+]C1CCN(c2ccc(N(C)C)cc2)CC1 ZINC000766189703 1043398397 /nfs/dbraw/zinc/39/83/97/1043398397.db2.gz HGZGEOSTWQHLAF-SFHVURJKSA-N 2 0 329.532 4.446 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3cccc(Cl)c3)s2)C1 ZINC000520974170 1043458549 /nfs/dbraw/zinc/45/85/49/1043458549.db2.gz RSXKKVMIKSUDEI-CQSZACIVSA-N 2 0 334.916 4.500 20 0 EIADRP FC(F)(F)CCC(CCC(F)(F)F)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000665272362 1043500365 /nfs/dbraw/zinc/50/03/65/1043500365.db2.gz DBIPDLSYBMAIKH-DMDPSCGWSA-N 2 0 346.359 4.018 20 0 EIADRP Fc1cc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)ccc1Cl ZINC000065933433 1043508796 /nfs/dbraw/zinc/50/87/96/1043508796.db2.gz UFQKJIMOTAEVOS-UHFFFAOYSA-N 2 0 346.877 4.481 20 0 EIADRP CCC1(C[NH2+]Cc2cncc(F)c2)CC[NH+](Cc2ccccc2)CC1 ZINC000494563589 1043597934 /nfs/dbraw/zinc/59/79/34/1043597934.db2.gz UNRLDLDJDNCSJE-UHFFFAOYSA-N 2 0 341.474 4.003 20 0 EIADRP C[C@@H](N[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc(F)cn1 ZINC001168013736 1043647895 /nfs/dbraw/zinc/64/78/95/1043647895.db2.gz IYTDXOCYFHABTD-AXVVYFOYSA-N 2 0 341.474 4.313 20 0 EIADRP CC(C)[C@H]([NH3+])CC[NH2+][C@@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000665281334 1043669932 /nfs/dbraw/zinc/66/99/32/1043669932.db2.gz ZTJFDEFOZWIQRQ-HZPDHXFCSA-N 2 0 329.513 4.151 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCCC[C@@H]3[C@@H]3CCOC3)CC2)CC1 ZINC000474034460 1043671058 /nfs/dbraw/zinc/67/10/58/1043671058.db2.gz SBUVJMHGKWJCIT-OAADDMNDSA-N 2 0 348.575 4.214 20 0 EIADRP CC(C)[NH+]1CCC([NH2+]CC[C@H](c2ccccc2)C(F)(F)F)CC1 ZINC000521281554 1043680156 /nfs/dbraw/zinc/68/01/56/1043680156.db2.gz RHHWTHMBHCRDMX-QGZVFWFLSA-N 2 0 328.422 4.185 20 0 EIADRP Cc1cccc2c1CCC[C@@H]2[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000665283663 1043689090 /nfs/dbraw/zinc/68/90/90/1043689090.db2.gz RYTLIWNDYGFXNR-FUDKSRODSA-N 2 0 348.490 4.218 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000474033790 1043691352 /nfs/dbraw/zinc/69/13/52/1043691352.db2.gz LUTFVOUQTQHRJI-OXJNMPFZSA-N 2 0 330.516 4.128 20 0 EIADRP CC(C)O[C@@H](C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000428251062 1043695481 /nfs/dbraw/zinc/69/54/81/1043695481.db2.gz YALIBPCCQYJKHA-SFTDATJTSA-N 2 0 330.516 4.103 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1Cc2[nH]c3ccccc3c2C1 ZINC000442714652 1043816584 /nfs/dbraw/zinc/81/65/84/1043816584.db2.gz KNZXCKPJXQAWKJ-IBGZPJMESA-N 2 0 347.506 4.265 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)CCS2 ZINC000191489094 1043820951 /nfs/dbraw/zinc/82/09/51/1043820951.db2.gz KZYACZMUTPCHEK-IBGZPJMESA-N 2 0 342.508 4.084 20 0 EIADRP C[C@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1cccc(O)c1 ZINC000442779929 1043831767 /nfs/dbraw/zinc/83/17/67/1043831767.db2.gz MEMAFWKKJBGKGW-RQXXJAGISA-N 2 0 338.495 4.199 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](CCCOC)c2ccc(F)cc2)CC1 ZINC000442769342 1043837383 /nfs/dbraw/zinc/83/73/83/1043837383.db2.gz PWYIWOYSBRVDMQ-HXUWFJFHSA-N 2 0 336.495 4.005 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442829247 1043859842 /nfs/dbraw/zinc/85/98/42/1043859842.db2.gz UJKWAAVFNUKVRJ-WMZOPIPTSA-N 2 0 338.417 4.193 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1cccc(O)c1 ZINC000442872450 1043871161 /nfs/dbraw/zinc/87/11/61/1043871161.db2.gz JNRWJFQWJJIIHR-BJLQDIEVSA-N 2 0 338.495 4.344 20 0 EIADRP CC(C)(C)C[N@H+]([C@H]1Cc2cccc(Cl)c2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168707188 1043895653 /nfs/dbraw/zinc/89/56/53/1043895653.db2.gz KIVDCCYJOAYXGJ-ULQDDVLXSA-N 2 0 334.935 4.425 20 0 EIADRP Cc1cc(C)cc(C[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)c1 ZINC000658176866 1043978814 /nfs/dbraw/zinc/97/88/14/1043978814.db2.gz NSASRGXDJMNYHQ-SFHVURJKSA-N 2 0 326.484 4.095 20 0 EIADRP c1ccc2c(c1)cccc2OCC[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000195690019 1044203320 /nfs/dbraw/zinc/20/33/20/1044203320.db2.gz LCAARLNCLHCJBE-UHFFFAOYSA-N 2 0 338.495 4.026 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCCC[C@H]1[C@@H]1CCOC1 ZINC000474046374 1044285113 /nfs/dbraw/zinc/28/51/13/1044285113.db2.gz NDVFJQFHLMFXCK-BHIFYINESA-N 2 0 344.543 4.213 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCC[C@@H]([C@H]4CCOC4)C3)CC2)CC1 ZINC000466346386 1044300612 /nfs/dbraw/zinc/30/06/12/1044300612.db2.gz LDKMNBPLQBYEON-BJOMATTFSA-N 2 0 348.575 4.214 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCC[C@@H]([C@@H]4CCOC4)C3)CC2)CC1 ZINC000466346388 1044301468 /nfs/dbraw/zinc/30/14/68/1044301468.db2.gz LDKMNBPLQBYEON-HHNWVEJHSA-N 2 0 348.575 4.214 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]CC2CCC(C(F)(F)F)CC2)CC1 ZINC000466361536 1044321995 /nfs/dbraw/zinc/32/19/95/1044321995.db2.gz BKXPVXDDCQSSFZ-UHFFFAOYSA-N 2 0 334.470 4.457 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000675489080 1044360219 /nfs/dbraw/zinc/36/02/19/1044360219.db2.gz FTWITTOWMBUAKI-RTBURBONSA-N 2 0 325.500 4.222 20 0 EIADRP CCn1c2ccccc2c2cc(C[NH2+][C@H]3CC[N@H+](C)[C@H](C)C3)ccc21 ZINC000327016909 1044405740 /nfs/dbraw/zinc/40/57/40/1044405740.db2.gz HMJOJOWVVUOPHZ-AEFFLSMTSA-N 2 0 335.495 4.387 20 0 EIADRP Clc1cccc2c1C[C@@H]([NH2+]C1CC[NH+](C[C@H]3CC=CCC3)CC1)C2 ZINC001168719144 1044409076 /nfs/dbraw/zinc/40/90/76/1044409076.db2.gz UYAWVCYYPGIPQX-LPHOPBHVSA-N 2 0 344.930 4.218 20 0 EIADRP CC[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cccc(Br)c1 ZINC000227495290 1044451172 /nfs/dbraw/zinc/45/11/72/1044451172.db2.gz LWUUGZISUZBIAT-MRXNPFEDSA-N 2 0 339.321 4.222 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H](C)C3CC[NH+](C)CC3)cc2)cs1 ZINC000675735438 1044452767 /nfs/dbraw/zinc/45/27/67/1044452767.db2.gz JIAPCDIHHNTABZ-GJZGRUSLSA-N 2 0 343.540 4.499 20 0 EIADRP CN1CCC([NH2+][C@H](Cc2ccccc2Cl)c2ccccc2)CC1 ZINC000675733726 1044453005 /nfs/dbraw/zinc/45/30/05/1044453005.db2.gz KEVAMFRZQHJEFF-HXUWFJFHSA-N 2 0 328.887 4.308 20 0 EIADRP C[C@@H]1CC([NH2+]CCCc2cccnc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168021954 1044461466 /nfs/dbraw/zinc/46/14/66/1044461466.db2.gz RNPFEWYOJVVLOG-RTBURBONSA-N 2 0 337.511 4.045 20 0 EIADRP CC(C)[C@H]1CCC[C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C1 ZINC000657613481 1044467929 /nfs/dbraw/zinc/46/79/29/1044467929.db2.gz KZVIHCPSZJLCAF-SFTDATJTSA-N 2 0 329.532 4.098 20 0 EIADRP COc1cc([C@@H](C)[NH2+][C@@H](C)C2CC[NH+](C)CC2)ccc1OCC(C)C ZINC000675775942 1044487664 /nfs/dbraw/zinc/48/76/64/1044487664.db2.gz BQFJLCIREQJPCD-DLBZAZTESA-N 2 0 348.531 4.111 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+][C@H](C)C2CC[NH+](C)CC2)cc1OC ZINC000675777143 1044489271 /nfs/dbraw/zinc/48/92/71/1044489271.db2.gz MEDLMWGLMUVRAL-IAGOWNOFSA-N 2 0 348.531 4.255 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](C/C=C\c2ccncc2)CC1 ZINC000494984911 1044570467 /nfs/dbraw/zinc/57/04/67/1044570467.db2.gz HQEDPDXVFVUXNP-UTSMFGRCSA-N 2 0 327.516 4.071 20 0 EIADRP CCC(C)(C)[NH2+][C@H](C)C(=O)Nc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000543431812 1044591796 /nfs/dbraw/zinc/59/17/96/1044591796.db2.gz WEYWKKVUUWYXQE-QGZVFWFLSA-N 2 0 345.531 4.024 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2C)C[C@@H]1C ZINC000443650244 1044619982 /nfs/dbraw/zinc/61/99/82/1044619982.db2.gz CNRDIWCSZUYYLO-YOEHRIQHSA-N 2 0 328.422 4.318 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@H]2CCSc3c(F)cccc32)C1 ZINC000359943104 1044651873 /nfs/dbraw/zinc/65/18/73/1044651873.db2.gz PSPRUQWKDFYUCS-QAPCUYQASA-N 2 0 336.520 4.464 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C[C@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000495092745 1044664929 /nfs/dbraw/zinc/66/49/29/1044664929.db2.gz IPGZZMDQKMKWKW-NQIIRXRSSA-N 2 0 348.506 4.005 20 0 EIADRP COC(=O)C1(C)CCC([NH2+]CCCCCCCCCCC[NH3+])CC1 ZINC001168761356 1044838346 /nfs/dbraw/zinc/83/83/46/1044838346.db2.gz BEALJYJHPBCXKG-UHFFFAOYSA-N 2 0 340.552 4.168 20 0 EIADRP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]CC1CC[NH+](C)CC1 ZINC000657871130 1044858826 /nfs/dbraw/zinc/85/88/26/1044858826.db2.gz HMPMPNZILCUTEE-GFCCVEGCSA-N 2 0 348.840 4.221 20 0 EIADRP CN(Cc1cccc(C(F)(F)F)c1)C1CC[NH+](CCCCF)CC1 ZINC000508980988 1044871392 /nfs/dbraw/zinc/87/13/92/1044871392.db2.gz XEKBOCDPLOPSEC-UHFFFAOYSA-N 2 0 346.412 4.351 20 0 EIADRP COC1CCC(CC[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)CC1 ZINC000543594951 1044879059 /nfs/dbraw/zinc/87/90/59/1044879059.db2.gz KILIBTDAZDLRDC-KJJOEJEFSA-N 2 0 336.564 4.214 20 0 EIADRP CCC(C)(C)c1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@H]32)cc1 ZINC000509022462 1044943756 /nfs/dbraw/zinc/94/37/56/1044943756.db2.gz PUPVVBJVJQUNND-PWRODBHTSA-N 2 0 344.543 4.058 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cscc1Br ZINC000512148702 1044968303 /nfs/dbraw/zinc/96/83/03/1044968303.db2.gz XVWISMMKMHIPOS-ZDUSSCGKSA-N 2 0 345.350 4.255 20 0 EIADRP CCN(Cc1cc(-c2ccco2)on1)Cc1ccc(C[NH+](C)C)cc1 ZINC000626061777 1045165141 /nfs/dbraw/zinc/16/51/41/1045165141.db2.gz VALZCDVFJOCJIY-UHFFFAOYSA-N 2 0 339.439 4.018 20 0 EIADRP CCN(Cc1cc(C(C)(C)C)on1)Cc1ccc(C[NH+](C)C)cc1 ZINC000626062659 1045166152 /nfs/dbraw/zinc/16/61/52/1045166152.db2.gz AMEZSVLJGNUTQP-UHFFFAOYSA-N 2 0 329.488 4.056 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(OCc3ccc(C)cc3)cc2)C1 ZINC000236826142 1045367190 /nfs/dbraw/zinc/36/71/90/1045367190.db2.gz SISYZVMZWKMAIR-OAQYLSRUSA-N 2 0 338.495 4.005 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)CCc1ccc(O)cc1 ZINC000236916304 1045371078 /nfs/dbraw/zinc/37/10/78/1045371078.db2.gz VYLFSMIFOCQDIY-SFHVURJKSA-N 2 0 340.511 4.345 20 0 EIADRP CCn1c2ccccc2c2cc(C[NH2+]C[C@@H]3CCC[N@H+](C)C3)ccc21 ZINC000237006617 1045372889 /nfs/dbraw/zinc/37/28/89/1045372889.db2.gz FLTCUGOJJNBEKR-SFHVURJKSA-N 2 0 335.495 4.246 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[N@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001168501373 1045498180 /nfs/dbraw/zinc/49/81/80/1045498180.db2.gz NWQGYCWPOPCJOZ-QGZVFWFLSA-N 2 0 332.507 4.486 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2ccc(Cl)c3cccnc23)CC1 ZINC000054337867 1045571954 /nfs/dbraw/zinc/57/19/54/1045571954.db2.gz LTVQPYZSFKHRSK-UHFFFAOYSA-N 2 0 331.891 4.052 20 0 EIADRP C[C@@H](Cc1ccccc1F)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000397560524 1045641250 /nfs/dbraw/zinc/64/12/50/1045641250.db2.gz QYYXIDBPGAZQCO-SFHVURJKSA-N 2 0 340.486 4.259 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2ccc(Br)c(Cl)c2)CC1 ZINC000421365837 1045656951 /nfs/dbraw/zinc/65/69/51/1045656951.db2.gz BMLMVXQDRADKQL-UHFFFAOYSA-N 2 0 345.712 4.065 20 0 EIADRP C[C@@H](C[NH2+]CC1(N[C@@H](C)c2ccccc2)CCOCC1)C(C)(C)C ZINC000670267811 1045759214 /nfs/dbraw/zinc/75/92/14/1045759214.db2.gz UVQGTZSPBFRHPC-ROUUACIJSA-N 2 0 332.532 4.158 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccccc2N2CCCCC2)CC1 ZINC000768302534 1045783761 /nfs/dbraw/zinc/78/37/61/1045783761.db2.gz HPEQGRABVMWUTQ-UHFFFAOYSA-N 2 0 343.559 4.231 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cncc3ccccc32)CC1 ZINC000768303477 1045784499 /nfs/dbraw/zinc/78/44/99/1045784499.db2.gz OVCAISYRAHHXGL-UHFFFAOYSA-N 2 0 325.500 4.179 20 0 EIADRP CC(C)[C@@H](C[NH2+][C@H](CC(C)(C)C)c1ccccc1)N1CC[NH+](C)CC1 ZINC000326429350 1045809670 /nfs/dbraw/zinc/80/96/70/1045809670.db2.gz VTYJDEZPQXGTRD-NHCUHLMSSA-N 2 0 345.575 4.026 20 0 EIADRP CC[C@@H]1C[C@H]([N@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170188949 1045920648 /nfs/dbraw/zinc/92/06/48/1045920648.db2.gz ABUPYMWCKAGVFT-XRXFAXGQSA-N 2 0 330.516 4.025 20 0 EIADRP C[N@@H+](Cc1ccc(SC(F)(F)F)cc1)CC1CC[NH+](C)CC1 ZINC000769331757 1045925178 /nfs/dbraw/zinc/92/51/78/1045925178.db2.gz XISRSQSFNAHNHM-UHFFFAOYSA-N 2 0 332.435 4.072 20 0 EIADRP Cc1cc(C)cc(C[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)c1 ZINC001170206171 1045926101 /nfs/dbraw/zinc/92/61/01/1045926101.db2.gz RJNURJMPOHTNCS-HSZRJFAPSA-N 2 0 334.507 4.401 20 0 EIADRP CC[NH+]1CCC([NH2+]CCCCCCOc2ccc(Cl)cc2)CC1 ZINC000769418897 1045956049 /nfs/dbraw/zinc/95/60/49/1045956049.db2.gz VRSSXOIZQUBHMW-UHFFFAOYSA-N 2 0 338.923 4.353 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CCCCCCOc2ccc(Cl)cc2)CC[N@@H+]1C ZINC000769418083 1045956715 /nfs/dbraw/zinc/95/67/15/1045956715.db2.gz TXKYLQFKIWMIBN-SJLPKXTDSA-N 2 0 338.923 4.352 20 0 EIADRP C[C@@H](Cc1ccccc1Cl)[NH2+]CCc1ccc(C[NH+](C)C)cc1 ZINC001170255815 1045974528 /nfs/dbraw/zinc/97/45/28/1045974528.db2.gz ZQKYPYFOQONCID-INIZCTEOSA-N 2 0 330.903 4.165 20 0 EIADRP [NH3+][C@@H]1CCc2c1cccc2N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001170336812 1046005761 /nfs/dbraw/zinc/00/57/61/1046005761.db2.gz FUZMTIXHVKRNCN-NXWNEQKCSA-N 2 0 347.506 4.240 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H](C)[C@@H](C)c2nc3ccccc3s2)CC1 ZINC000161622067 1046011602 /nfs/dbraw/zinc/01/16/02/1046011602.db2.gz AGSKNECYPUYYIX-HUUCEWRRSA-N 2 0 331.529 4.252 20 0 EIADRP Cc1ccc(C[NH2+]Cc2ccc(C[NH+]3C[C@H](C)C[C@@H](C)C3)cc2)o1 ZINC000237471739 1046103901 /nfs/dbraw/zinc/10/39/01/1046103901.db2.gz YCDGVIDCRLGVED-IAGOWNOFSA-N 2 0 326.484 4.356 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[N@H+](C)C[C@H]2CCC[NH2+]C2)cc1 ZINC000261745936 1046144196 /nfs/dbraw/zinc/14/41/96/1046144196.db2.gz BWMYVDZTRPWFBR-MSOLQXFVSA-N 2 0 338.495 4.355 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1cncc(F)c1 ZINC000125102079 1046287126 /nfs/dbraw/zinc/28/71/26/1046287126.db2.gz GWALAPFXWOAXHJ-KRWDZBQOSA-N 2 0 341.474 4.448 20 0 EIADRP C[C@H]([NH2+]CC1(c2ccccc2)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508710702 1046369334 /nfs/dbraw/zinc/36/93/34/1046369334.db2.gz NRFRVNSJNRLIAS-FPOVZHCZSA-N 2 0 334.507 4.218 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)cc1OCC ZINC000125985795 1046407780 /nfs/dbraw/zinc/40/77/80/1046407780.db2.gz VVTYGTIODRYDLR-ZWKOTPCHSA-N 2 0 348.531 4.255 20 0 EIADRP C[C@H](Cc1ccc(O)cc1)[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000509697828 1046575905 /nfs/dbraw/zinc/57/59/05/1046575905.db2.gz MHFDUPUZSSTURM-GOSISDBHSA-N 2 0 338.495 4.099 20 0 EIADRP c1ccc(C2(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)CCCC2)cc1 ZINC000459392230 1046609038 /nfs/dbraw/zinc/60/90/38/1046609038.db2.gz PZIBXMXOXPCUMC-UHFFFAOYSA-N 2 0 335.495 4.152 20 0 EIADRP c1cc(N2CCC([NH2+]CCCCCOC3CCCCC3)CC2)cc[nH+]1 ZINC000459395776 1046612553 /nfs/dbraw/zinc/61/25/53/1046612553.db2.gz BNEBMXLQPLGHGL-UHFFFAOYSA-N 2 0 345.531 4.160 20 0 EIADRP Cc1[nH]c2c(cc(C)cc2C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c1C ZINC000459408223 1046626511 /nfs/dbraw/zinc/62/65/11/1046626511.db2.gz MZGXFWIJKBPIJR-UHFFFAOYSA-N 2 0 348.494 4.247 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cnc(-c3ccsc3)s2)[C@@H](C)C1 ZINC000536661022 1046629195 /nfs/dbraw/zinc/62/91/95/1046629195.db2.gz VBTAQFGTOSWVRH-XJKSGUPXSA-N 2 0 335.542 4.034 20 0 EIADRP CCCCOc1ccc(C[N@H+](C)[C@@H]2CC[NH+](CC)C[C@@H]2C)cc1OC ZINC000536662350 1046631361 /nfs/dbraw/zinc/63/13/61/1046631361.db2.gz YEVPUQCZOXRDQR-PKOBYXMFSA-N 2 0 348.531 4.036 20 0 EIADRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc(OC)c3ccccc23)C1 ZINC000536695778 1046692666 /nfs/dbraw/zinc/69/26/66/1046692666.db2.gz FOHCGYIKXYMJDF-KRWDZBQOSA-N 2 0 326.484 4.012 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1c(C)nc2scc(C3CC3)n12 ZINC000459465978 1046705164 /nfs/dbraw/zinc/70/51/64/1046705164.db2.gz OKHVOTOVJHWOCU-CQSZACIVSA-N 2 0 348.560 4.182 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccc(F)cc1F ZINC000536714355 1046707167 /nfs/dbraw/zinc/70/71/67/1046707167.db2.gz XRUCMJPDOMPLQZ-UHFFFAOYSA-N 2 0 345.437 4.098 20 0 EIADRP CN(Cc1ccccn1)[C@H]1CCC[N@H+](Cc2ccc(C3CC3)cc2)CC1 ZINC000459501873 1046727623 /nfs/dbraw/zinc/72/76/23/1046727623.db2.gz FGQYJHDKVOHITG-QHCPKHFHSA-N 2 0 349.522 4.446 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCCCC2(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000379651223 1046744166 /nfs/dbraw/zinc/74/41/66/1046744166.db2.gz UJEQNTIMWVEJHV-NEWSRXKRSA-N 2 0 336.470 4.455 20 0 EIADRP Fc1ccccc1[C@H]1CC[C@@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000459517079 1046744328 /nfs/dbraw/zinc/74/43/28/1046744328.db2.gz RVRKDTXZNQJRIH-FUHWJXTLSA-N 2 0 339.458 4.115 20 0 EIADRP Fc1ccccc1[C@H]1CC[C@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000459517083 1046744509 /nfs/dbraw/zinc/74/45/09/1046744509.db2.gz RVRKDTXZNQJRIH-WMZOPIPTSA-N 2 0 339.458 4.115 20 0 EIADRP c1ccc(C[C@H]2CC[C@H]([NH2+]C3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000459510850 1046748392 /nfs/dbraw/zinc/74/83/92/1046748392.db2.gz MHPBJCWCNASVOU-CTNGQTDRSA-N 2 0 335.495 4.051 20 0 EIADRP CCOCCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CCC1 ZINC000536845148 1046817458 /nfs/dbraw/zinc/81/74/58/1046817458.db2.gz KRPJOJPOCREQLT-CTNGQTDRSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC(C)(C)c1c(Cl)cccc1Cl ZINC000536865824 1046830622 /nfs/dbraw/zinc/83/06/22/1046830622.db2.gz XXYXFRFIGLYFAS-IUODEOHRSA-N 2 0 329.315 4.201 20 0 EIADRP CC(C)CCC[C@@H](C)[NH2+]CCSCc1ccc(C[NH+](C)C)o1 ZINC001170057291 1046834263 /nfs/dbraw/zinc/83/42/63/1046834263.db2.gz HHQWXVYXOAQZRU-MRXNPFEDSA-N 2 0 326.550 4.379 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000459723562 1046864720 /nfs/dbraw/zinc/86/47/20/1046864720.db2.gz ADDZODQHPOSTON-ZQDZILKHSA-N 2 0 326.937 4.215 20 0 EIADRP CC(C)[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccc2[nH]c(=O)oc2c1 ZINC000536961941 1046869657 /nfs/dbraw/zinc/86/96/57/1046869657.db2.gz VMVPKWCRSKGGDB-DNVCBOLYSA-N 2 0 345.487 4.085 20 0 EIADRP CC(C)[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000536998059 1046889740 /nfs/dbraw/zinc/88/97/40/1046889740.db2.gz CYABIDFZTKQNEC-RHSMWYFYSA-N 2 0 328.422 4.334 20 0 EIADRP COc1cc([C@H](C)[NH2+]CCC[NH+]2CCCC2)ccc1OC1CCCC1 ZINC000537054048 1046918353 /nfs/dbraw/zinc/91/83/53/1046918353.db2.gz OCCCCBGXESEUNT-KRWDZBQOSA-N 2 0 346.515 4.153 20 0 EIADRP CC(C)CCC[C@@H](C)[NH2+]CCCP(CCC[NH3+])c1ccccc1 ZINC001170073712 1047008589 /nfs/dbraw/zinc/00/85/89/1047008589.db2.gz MGYUWDXZCPZXCT-HWYAHNCWSA-N 2 0 336.504 4.337 20 0 EIADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000537303717 1047086231 /nfs/dbraw/zinc/08/62/31/1047086231.db2.gz IVOYGQAYMOPURI-OLZOCXBDSA-N 2 0 343.298 4.001 20 0 EIADRP CC1(C)C[C@@H]([NH2+][C@@H]2CCN(Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000897793514 1047483013 /nfs/dbraw/zinc/48/30/13/1047483013.db2.gz NYKKORCOSLZHGD-MOPGFXCFSA-N 2 0 344.568 4.447 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCSC(C)(C)C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000897796005 1047484534 /nfs/dbraw/zinc/48/45/34/1047484534.db2.gz VUSHWYNCVIPERR-YTQUADARSA-N 2 0 332.557 4.161 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)[C@H]1CCOC1 ZINC000129870867 1047520750 /nfs/dbraw/zinc/52/07/50/1047520750.db2.gz JVLZYAAJTGNTJR-UNMCSNQZSA-N 2 0 344.543 4.356 20 0 EIADRP Cc1cccnc1[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)C(C)(C)C ZINC000897994605 1047522211 /nfs/dbraw/zinc/52/22/11/1047522211.db2.gz HDRKBSDELGVTOU-FQEVSTJZSA-N 2 0 338.499 4.131 20 0 EIADRP COc1cccc(C[N@@H+]2CCC3(C2)CC[NH+]([C@@H]2CC[C@@H](C)C2)CC3)c1 ZINC001170136348 1047590709 /nfs/dbraw/zinc/59/07/09/1047590709.db2.gz JUMFUVWXXICUSI-UYAOXDASSA-N 2 0 342.527 4.172 20 0 EIADRP COc1cccc(C[N@@H+]2CCC3(C2)CC[NH+]([C@H]2CC[C@H](C)C2)CC3)c1 ZINC001170136346 1047591723 /nfs/dbraw/zinc/59/17/23/1047591723.db2.gz JUMFUVWXXICUSI-ICSRJNTNSA-N 2 0 342.527 4.172 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)[C@]1(C)CCCO1 ZINC000556235957 1047601470 /nfs/dbraw/zinc/60/14/70/1047601470.db2.gz KQPARIKCOFEPCD-LQWHRVPQSA-N 2 0 330.516 4.108 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1F ZINC000130298246 1047674136 /nfs/dbraw/zinc/67/41/36/1047674136.db2.gz RTZOLMFAXMUAAP-HUUCEWRRSA-N 2 0 332.385 4.098 20 0 EIADRP C[NH+](C)C1CCC([NH2+]C(C)(C)c2cccc(Br)c2)CC1 ZINC001168304363 1047745117 /nfs/dbraw/zinc/74/51/17/1047745117.db2.gz YKWFITPXNOODHG-UHFFFAOYSA-N 2 0 339.321 4.147 20 0 EIADRP C[N@H+](CCCN[C@H]1CC[NH+](C)[C@@H](c2ccccc2)C1)C1CCCCC1 ZINC000550608679 1047758641 /nfs/dbraw/zinc/75/86/41/1047758641.db2.gz LGJMVKAZCANWIW-RBBKRZOGSA-N 2 0 343.559 4.066 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H](c2ncccc2C(F)(F)F)C2CC2)CC1 ZINC001168305269 1047763324 /nfs/dbraw/zinc/76/33/24/1047763324.db2.gz GIXQQRGURZYNHS-ZBCRRDGASA-N 2 0 341.421 4.014 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000556590219 1047830660 /nfs/dbraw/zinc/83/06/60/1047830660.db2.gz TWXKLECJMUBYKM-XHIHJMKYSA-N 2 0 344.543 4.289 20 0 EIADRP CC(C)=CCC[C@H](C)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556606339 1047837019 /nfs/dbraw/zinc/83/70/19/1047837019.db2.gz XFTYZYCEPXHFFU-SFHVURJKSA-N 2 0 330.516 4.384 20 0 EIADRP C[C@H]1CCC[C@H](C)C1[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556606276 1047837062 /nfs/dbraw/zinc/83/70/62/1047837062.db2.gz VQTFJENFBVQBLA-IRXDYDNUSA-N 2 0 330.516 4.074 20 0 EIADRP CC(C)=CCC[C@@H](C)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556606338 1047837271 /nfs/dbraw/zinc/83/72/71/1047837271.db2.gz XFTYZYCEPXHFFU-GOSISDBHSA-N 2 0 330.516 4.384 20 0 EIADRP COc1cccc(C[N@H+]([C@@H]2C[C@@H]3[C@H](C2)C3(C)C)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001170735872 1047915916 /nfs/dbraw/zinc/91/59/16/1047915916.db2.gz AODVUVOTIVNVBX-RYBYCUDRSA-N 2 0 342.527 4.202 20 0 EIADRP Clc1cc(Cl)c2c(c1)CC[C@H]([NH2+]CCCC[NH+]1CCCC1)C2 ZINC001171064138 1047918109 /nfs/dbraw/zinc/91/81/09/1047918109.db2.gz RALSFKNCSYUTGM-INIZCTEOSA-N 2 0 341.326 4.316 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C[C@@]2(C)CC2(Cl)Cl)CC1 ZINC000824771242 1047922561 /nfs/dbraw/zinc/92/25/61/1047922561.db2.gz AJLTYERRRZYLLC-FVQBIDKESA-N 2 0 333.347 4.203 20 0 EIADRP C[C@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000824775076 1047930605 /nfs/dbraw/zinc/93/06/05/1047930605.db2.gz YFVHBNRDGSHPJV-BHYGNILZSA-N 2 0 341.326 4.071 20 0 EIADRP CC1(C)[C@@H]2C[C@H]([N@H+](Cc3ccccc3F)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170741017 1047962965 /nfs/dbraw/zinc/96/29/65/1047962965.db2.gz XCQZCKOUSVONKL-YCEIQTCASA-N 2 0 330.491 4.332 20 0 EIADRP Cc1ccc2c(C[N@H+](C)C[C@@H]3CC[NH+](Cc4ccccc4)C3)c[nH]c2c1 ZINC001136974635 1048006530 /nfs/dbraw/zinc/00/65/30/1048006530.db2.gz GYPYLKYHJZLMED-FQEVSTJZSA-N 2 0 347.506 4.430 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2scnc2C)ccc1OC ZINC000775387356 1048025438 /nfs/dbraw/zinc/02/54/38/1048025438.db2.gz XIBLFNOSFNYBPZ-AWEZNQCLSA-N 2 0 347.528 4.153 20 0 EIADRP C[NH+](C)[C@H]1CC[C@@H]([NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171073503 1048027471 /nfs/dbraw/zinc/02/74/71/1048027471.db2.gz GCPPFZDAVBWWOB-OAGGEKHMSA-N 2 0 341.326 4.313 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)C1 ZINC000556857535 1048076442 /nfs/dbraw/zinc/07/64/42/1048076442.db2.gz CKSDQMAWLNNSAC-QWFCFKBJSA-N 2 0 346.563 4.379 20 0 EIADRP C[NH+](C)CC1CC[NH+]([C@@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171084062 1048078240 /nfs/dbraw/zinc/07/82/40/1048078240.db2.gz XDFZGTWQGMEMPL-MRXNPFEDSA-N 2 0 341.326 4.124 20 0 EIADRP CCOc1c(F)cc(C[N@H+](C(C)C)C2CCN(C)CC2)cc1Cl ZINC001143746719 1048181333 /nfs/dbraw/zinc/18/13/33/1048181333.db2.gz UDWVFDGLXWBJQO-UHFFFAOYSA-N 2 0 342.886 4.182 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@@H]2CCc3cc(Cl)ccc3C2)CC1(C)C ZINC001171103393 1048186416 /nfs/dbraw/zinc/18/64/16/1048186416.db2.gz ALGJGDUSYWJVIG-QGZVFWFLSA-N 2 0 334.935 4.438 20 0 EIADRP Clc1ccc2c(c1)CC[C@H]([NH2+]C1CC[NH+](C3CCCC3)CC1)C2 ZINC001171105368 1048198440 /nfs/dbraw/zinc/19/84/40/1048198440.db2.gz SWFIDBONIJLUNA-IBGZPJMESA-N 2 0 332.919 4.194 20 0 EIADRP Cc1ccsc1CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499166236 1048361604 /nfs/dbraw/zinc/36/16/04/1048361604.db2.gz DRHTZUUWQKVBLA-ACDBMABISA-N 2 0 340.536 4.384 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@@H]2CCc4ccccc4C2)C3)cc1 ZINC000499164510 1048372279 /nfs/dbraw/zinc/37/22/79/1048372279.db2.gz OFZVSRHICCXJAA-YCAMKHIRSA-N 2 0 346.518 4.329 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+]([C@@H]1CCc3cc(Cl)ccc3C1)CC2 ZINC001171135977 1048407237 /nfs/dbraw/zinc/40/72/37/1048407237.db2.gz QHTFMEDZCGSSHO-LJQANCHMSA-N 2 0 332.919 4.005 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171145344 1048468673 /nfs/dbraw/zinc/46/86/73/1048468673.db2.gz SZLKRACOFTVNKC-PCKAHOCUSA-N 2 0 341.326 4.313 20 0 EIADRP C[NH+](C)[C@H]1CC[C@H]([NH2+][C@@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171148943 1048493335 /nfs/dbraw/zinc/49/33/35/1048493335.db2.gz SZLKRACOFTVNKC-BZUAXINKSA-N 2 0 341.326 4.313 20 0 EIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cnc(Cl)c(C)c1 ZINC000809739338 1048511281 /nfs/dbraw/zinc/51/12/81/1048511281.db2.gz HNLVLTKEQWUIJF-UHFFFAOYSA-N 2 0 331.891 4.127 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)C/C=C/c2ccc(F)c(F)c2)cc1 ZINC000809738810 1048513640 /nfs/dbraw/zinc/51/36/40/1048513640.db2.gz KTNCHWGXUACSFM-SNAWJCMRSA-N 2 0 330.422 4.172 20 0 EIADRP C[NH+](C)CC1CC[NH+]([C@@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171162197 1048597870 /nfs/dbraw/zinc/59/78/70/1048597870.db2.gz IDZGOZOKZQHYFJ-MRXNPFEDSA-N 2 0 341.326 4.124 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2ccc(SC(F)(F)F)cc2)CC1 ZINC000817415957 1048966752 /nfs/dbraw/zinc/96/67/52/1048966752.db2.gz BXKVPONGTVCWPM-UHFFFAOYSA-N 2 0 332.435 4.261 20 0 EIADRP Cc1cc2cc(N(CC[NH3+])C34CC5CC(CC(C5)C3)C4)ccc2c[nH+]1 ZINC001170630959 1049029227 /nfs/dbraw/zinc/02/92/27/1049029227.db2.gz RVZARVOQTCPVII-UHFFFAOYSA-N 2 0 335.495 4.277 20 0 EIADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+][C@@H](c1ccccc1)C1CCOCC1 ZINC000817893270 1049053208 /nfs/dbraw/zinc/05/32/08/1049053208.db2.gz DENAWHDATNESNL-UIFIKXQLSA-N 2 0 330.516 4.055 20 0 EIADRP COc1c(C)cc([C@@H](C)[NH2+]Cc2ccc(CC[NH3+])cc2)cc1Cl ZINC000817948805 1049064201 /nfs/dbraw/zinc/06/42/01/1049064201.db2.gz LNYQRFVBFVOJRG-CQSZACIVSA-N 2 0 332.875 4.009 20 0 EIADRP COc1cc([C@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)ccc1SC(F)F ZINC000817957711 1049067226 /nfs/dbraw/zinc/06/72/26/1049067226.db2.gz OLHJUNIMQRUFIG-STQMWFEESA-N 2 0 344.471 4.050 20 0 EIADRP Cc1c([C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cnn1-c1ccccc1 ZINC000817962512 1049069586 /nfs/dbraw/zinc/06/95/86/1049069586.db2.gz JGSODUYDVFNHTA-HZPDHXFCSA-N 2 0 334.467 4.051 20 0 EIADRP COc1cc([C@H](C)[NH2+]C[C@]2(C)CCC[NH2+]C2)ccc1SC(F)F ZINC000817965862 1049070260 /nfs/dbraw/zinc/07/02/60/1049070260.db2.gz DNZHSFSSORFSCE-YVEFUNNKSA-N 2 0 344.471 4.050 20 0 EIADRP CC(C)C1=NCCc2ccc(-n3c(CC[NH3+])cc4ccccc43)cc21 ZINC001171304785 1049151326 /nfs/dbraw/zinc/15/13/26/1049151326.db2.gz YDNIMRQZTNQQEJ-UHFFFAOYSA-N 2 0 331.463 4.133 20 0 EIADRP Clc1cccc2c1C[C@H]([NH2+]CC1CC[NH+](C3CCC3)CC1)CC2 ZINC001170910584 1049182413 /nfs/dbraw/zinc/18/24/13/1049182413.db2.gz KZVVZWLXIKZNAA-QGZVFWFLSA-N 2 0 332.919 4.051 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170918104 1049232696 /nfs/dbraw/zinc/23/26/96/1049232696.db2.gz SVGFFPWVVAYPCK-OKZBNKHCSA-N 2 0 334.935 4.440 20 0 EIADRP Cc1cc([C@H](C)[NH2+]CCOCC[NH2+][C@@H](C)c2cc(C)oc2C)c(C)o1 ZINC000348098006 1049418049 /nfs/dbraw/zinc/41/80/49/1049418049.db2.gz XXUGYFGNHLZWOH-HOTGVXAUSA-N 2 0 348.487 4.124 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@@H]2CCc3cc(F)cc(F)c3C2)CC1 ZINC001170679990 1049510750 /nfs/dbraw/zinc/51/07/50/1049510750.db2.gz FLRMGJBJUPAUKA-BHIYHBOVSA-N 2 0 348.481 4.337 20 0 EIADRP Cc1cnccc1O[C@H]1CC[N@@H+]([C@@H]2CCc3cccc(Cl)c3C2)C1 ZINC001170948042 1049514833 /nfs/dbraw/zinc/51/48/33/1049514833.db2.gz ZWBPCKOXDXKJEE-SJORKVTESA-N 2 0 342.870 4.054 20 0 EIADRP C[C@@H]([NH2+]CCc1cccc2cccnc21)c1cccc(C[NH+](C)C)c1 ZINC000820806494 1049551885 /nfs/dbraw/zinc/55/18/85/1049551885.db2.gz JLEXLLKKHVIKIR-QGZVFWFLSA-N 2 0 333.479 4.190 20 0 EIADRP CC[C@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1CCCO1 ZINC000820829451 1049564298 /nfs/dbraw/zinc/56/42/98/1049564298.db2.gz JLOLZGTZHBMGKF-GLHNNUHNSA-N 2 0 342.527 4.119 20 0 EIADRP CCCC[NH+]1CCC([N@H+](C)[C@H]2CCc3c(F)cc(F)cc3C2)CC1 ZINC001171382823 1049580872 /nfs/dbraw/zinc/58/08/72/1049580872.db2.gz NCBIFYMSGSSTNA-SFHVURJKSA-N 2 0 336.470 4.018 20 0 EIADRP CC(C)(C)C[NH+]1CCC(C[NH2+][C@@H]2CCc3c(F)cccc3C2)CC1 ZINC001171412038 1049647162 /nfs/dbraw/zinc/64/71/62/1049647162.db2.gz RHRPLFPMZYBGQQ-GOSISDBHSA-N 2 0 332.507 4.031 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)[C@@H]2CCc3cccc(F)c3C2)CC1 ZINC001170968047 1049659646 /nfs/dbraw/zinc/65/96/46/1049659646.db2.gz BDNSHDTWTGEAAV-VAMGGRTRSA-N 2 0 344.518 4.445 20 0 EIADRP FC1(F)CCC([NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)CC1 ZINC000716716090 1049703332 /nfs/dbraw/zinc/70/33/32/1049703332.db2.gz ZNVYCAGQONXAJS-WDSOQIARSA-N 2 0 334.454 4.207 20 0 EIADRP CC(F)(F)C(C)(C)C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716715763 1049704195 /nfs/dbraw/zinc/70/41/95/1049704195.db2.gz DNQATEGATDXOIW-KSZLIROESA-N 2 0 336.470 4.311 20 0 EIADRP CCCC[NH+]1CCC([N@H+](C)[C@@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171496519 1049723525 /nfs/dbraw/zinc/72/35/25/1049723525.db2.gz CWNPFIVRHUUGST-GOSISDBHSA-N 2 0 336.470 4.018 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171467495 1049725068 /nfs/dbraw/zinc/72/50/68/1049725068.db2.gz WMENWROHLKUGRM-LXPRWKDFSA-N 2 0 336.470 4.065 20 0 EIADRP CC(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cc(F)c(F)cc2C1 ZINC001171471823 1049727873 /nfs/dbraw/zinc/72/78/73/1049727873.db2.gz KPPKIBYUZYRJCC-BZSNNMDCSA-N 2 0 336.470 4.050 20 0 EIADRP Cc1cccc2c1CC[C@@H]([N@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171558896 1049755501 /nfs/dbraw/zinc/75/55/01/1049755501.db2.gz PYKAJMZQSLHPFR-CEMLEFRQSA-N 2 0 349.522 4.019 20 0 EIADRP c1csc(CC[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000813371259 1049760733 /nfs/dbraw/zinc/76/07/33/1049760733.db2.gz SWAPRLHCRHJQJV-UHFFFAOYSA-N 2 0 340.536 4.279 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]Cc2cccc(N3CCCCC3)c2)CC1(C)C ZINC001171619831 1049767248 /nfs/dbraw/zinc/76/72/48/1049767248.db2.gz RTKMECLWSJPTCK-UHFFFAOYSA-N 2 0 343.559 4.418 20 0 EIADRP COCCC1([NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)CCC(F)(F)CC1 ZINC001171626903 1049769496 /nfs/dbraw/zinc/76/94/96/1049769496.db2.gz GPNUDIGZDDJCRW-UHFFFAOYSA-N 2 0 346.506 4.212 20 0 EIADRP CCC(CC)[NH+]1CCC(C[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)CC1 ZINC001171627677 1049770003 /nfs/dbraw/zinc/77/00/03/1049770003.db2.gz ZVEXKHFHTMFNDU-UHFFFAOYSA-N 3 0 337.596 4.128 20 0 EIADRP Cc1ccc(CC[C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC001171658626 1049771924 /nfs/dbraw/zinc/77/19/24/1049771924.db2.gz TXNNNIOJXHZJKC-OFNKIYASSA-N 2 0 336.523 4.428 20 0 EIADRP COc1cccc(CCC[N@H+](C)C2CC(C)(C)[NH+](C)C(C)(C)C2)c1 ZINC001171641420 1049779255 /nfs/dbraw/zinc/77/92/55/1049779255.db2.gz GVVDOJYMPNRXCG-UHFFFAOYSA-N 2 0 332.532 4.211 20 0 EIADRP COc1ccc(C2=CC[N@@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)CC2)cc1 ZINC001171641630 1049779515 /nfs/dbraw/zinc/77/95/15/1049779515.db2.gz RGOKBETWMDNECK-UHFFFAOYSA-N 2 0 342.527 4.436 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2[C@@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171731436 1049786800 /nfs/dbraw/zinc/78/68/00/1049786800.db2.gz BCAYVCOJERKCFZ-CZTZKLFOSA-N 2 0 349.522 4.258 20 0 EIADRP C[C@@H]1C[C@H](n2c3ccccc3c3c2CC[NH2+]C3)C[N@@H+]1Cc1ccccc1 ZINC001171758561 1049790019 /nfs/dbraw/zinc/79/00/19/1049790019.db2.gz YFEPCTJRVFZIBL-MJGOQNOKSA-N 2 0 345.490 4.123 20 0 EIADRP C[NH2+]CCc1cn([C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171760336 1049792038 /nfs/dbraw/zinc/79/20/38/1049792038.db2.gz UDOQZCXTVGNIOX-WIYYLYMNSA-N 2 0 347.506 4.239 20 0 EIADRP CCO[C@@H](CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)C ZINC000245652582 1049812635 /nfs/dbraw/zinc/81/26/35/1049812635.db2.gz CWXFAGRQCRRPFQ-KJJMTIBFSA-N 2 0 344.543 4.223 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1CCc2cccc(F)c2C1 ZINC001171005855 1049819936 /nfs/dbraw/zinc/81/99/36/1049819936.db2.gz RMTJOBAMWPCHOP-IPMKNSEASA-N 2 0 330.491 4.022 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H]([NH2+][C@H](C)Cc2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC001171961720 1049825307 /nfs/dbraw/zinc/82/53/07/1049825307.db2.gz BGGPRKUOGFDREG-IIDMSEBBSA-N 2 0 342.449 4.345 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[C@@H]([NH+](C)C)CC1 ZINC001171962590 1049825749 /nfs/dbraw/zinc/82/57/49/1049825749.db2.gz GDGQLTDPUXAMAP-RRQGHBQHSA-N 2 0 328.422 4.099 20 0 EIADRP CC1(C)C[C@@H](N2CC[C@](C)(F)[C@@H](F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171976021 1049837536 /nfs/dbraw/zinc/83/75/36/1049837536.db2.gz HQLDSDPMRPKLFW-BJLQDIEVSA-N 2 0 336.470 4.202 20 0 EIADRP CCN(Cc1ccncc1)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171977618 1049837692 /nfs/dbraw/zinc/83/76/92/1049837692.db2.gz SHISKEFPNWJLNH-NRFANRHFSA-N 2 0 337.511 4.347 20 0 EIADRP CCSCC[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245737358 1049842320 /nfs/dbraw/zinc/84/23/20/1049842320.db2.gz QZQGFFKAEDZWGR-FRYIKTPZSA-N 2 0 332.557 4.303 20 0 EIADRP CCOC1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172073846 1049845120 /nfs/dbraw/zinc/84/51/20/1049845120.db2.gz DACGTFIMTHEKFR-AERCQKQUSA-N 2 0 342.527 4.073 20 0 EIADRP FCC1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172075688 1049845273 /nfs/dbraw/zinc/84/52/73/1049845273.db2.gz SCYLYTZUTRNJBI-AERCQKQUSA-N 2 0 330.491 4.254 20 0 EIADRP C[N@H+](C[C@H]1CCCCO1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076440 1049845304 /nfs/dbraw/zinc/84/53/04/1049845304.db2.gz YOKNTWVFPLFCQJ-CLAROIROSA-N 2 0 342.527 4.073 20 0 EIADRP CCO[C@H]1CCC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172075204 1049845469 /nfs/dbraw/zinc/84/54/69/1049845469.db2.gz OROAGRMQZDFVLN-CBPXPLCBSA-N 2 0 342.527 4.073 20 0 EIADRP CCO[C@H]1CCC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172075210 1049845587 /nfs/dbraw/zinc/84/55/87/1049845587.db2.gz OROAGRMQZDFVLN-LRSLUSHPSA-N 2 0 342.527 4.073 20 0 EIADRP COC1(C)CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172080417 1049846193 /nfs/dbraw/zinc/84/61/93/1049846193.db2.gz VRSPCTSQFLTMJW-AERCQKQUSA-N 2 0 342.527 4.073 20 0 EIADRP Cc1ncccc1CN[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172062004 1049849789 /nfs/dbraw/zinc/84/97/89/1049849789.db2.gz KQSLYPZDXVNEIY-DKUWSORSSA-N 2 0 335.495 4.065 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCCC[C@H]1OCc1ccccc1)C2 ZINC001172098207 1049850407 /nfs/dbraw/zinc/85/04/07/1049850407.db2.gz BUXLJIZEAMZAEU-QMCAAQAGSA-N 2 0 342.527 4.119 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@@]3(CCc4c3cccc4F)C1)C2 ZINC001172133606 1049855073 /nfs/dbraw/zinc/85/50/73/1049855073.db2.gz UACFFLSCCOQYKS-BZDHPDOMSA-N 2 0 342.502 4.121 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCc1cccc(Cl)c1Cl)C2 ZINC001172103982 1049856511 /nfs/dbraw/zinc/85/65/11/1049856511.db2.gz YJBWADCSVWNWMH-QKDCVEJESA-N 2 0 327.299 4.141 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]Cc1ccccc1N1CCCCCC1)C2 ZINC001172103759 1049857650 /nfs/dbraw/zinc/85/76/50/1049857650.db2.gz XLTCMMHIEIBZKG-WKCHPHFGSA-N 2 0 341.543 4.172 20 0 EIADRP C[N@H+](Cc1ccc(Cl)c(Cl)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172118213 1049858068 /nfs/dbraw/zinc/85/80/68/1049858068.db2.gz OJLDNISDHUYWKT-FICVDOATSA-N 2 0 327.299 4.441 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC1(Cc3cccc(F)c3)CCC1)C2 ZINC001172112555 1049858198 /nfs/dbraw/zinc/85/81/98/1049858198.db2.gz XPGPDJCLJZHIFH-ACDBMABISA-N 2 0 330.491 4.143 20 0 EIADRP CC(C)(C)[PH+](CCC[NH2+][C@@H]1CCN2C(=O)CC[C@@H]2C1)C(C)(C)C ZINC001172176191 1049863352 /nfs/dbraw/zinc/86/33/52/1049863352.db2.gz UHPDFYPUZUDUPX-HZPDHXFCSA-N 2 0 340.492 4.198 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)[C@@H]2CSc3ccccc3C2)CC1 ZINC001172203524 1049863409 /nfs/dbraw/zinc/86/34/09/1049863409.db2.gz XMQPAJKMAFMGFM-UFYCRDLUSA-N 2 0 344.568 4.466 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+]C3C[C@H]4CC[C@@H](C3)O4)[C@H](C)C2)CC[C@@H]1[NH3+] ZINC001172224580 1049867836 /nfs/dbraw/zinc/86/78/36/1049867836.db2.gz UJKCPLPHUNDJIV-JZRHJFRBSA-N 2 0 348.575 4.244 20 0 EIADRP c1ccc2c(c1)C[C@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CS2 ZINC001172200150 1049869805 /nfs/dbraw/zinc/86/98/05/1049869805.db2.gz IBVXGHQXVJWWPK-SFHVURJKSA-N 2 0 330.541 4.090 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC001172319420 1049877415 /nfs/dbraw/zinc/87/74/15/1049877415.db2.gz QUNPRFHXWOVOBT-BGJPATFMSA-N 2 0 344.543 4.080 20 0 EIADRP CCOCC[C@@H](C)[N@H+](Cc1ccc(Cl)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172420247 1049900872 /nfs/dbraw/zinc/90/08/72/1049900872.db2.gz LIPGYAVJXIBKLB-ATZDWAIDSA-N 2 0 338.923 4.227 20 0 EIADRP CC(C)COCC[C@H](C)[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001172475938 1049908256 /nfs/dbraw/zinc/90/82/56/1049908256.db2.gz NQPXAQNTCOGMRU-UNMCSNQZSA-N 2 0 344.543 4.036 20 0 EIADRP CC(C)OCC[C@@H](C)[N@H+](Cc1ccccc1F)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172437569 1049912697 /nfs/dbraw/zinc/91/26/97/1049912697.db2.gz RKIXQVPGDRDMJT-BHIYHBOVSA-N 2 0 336.495 4.101 20 0 EIADRP Cc1ccc(C[N@@H+]([C@H](C)CCOC(C)C)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001172445527 1049915105 /nfs/dbraw/zinc/91/51/05/1049915105.db2.gz RINDMENROHRHFC-HMXCVIKNSA-N 2 0 332.532 4.271 20 0 EIADRP CCCCCC[C@@H](CCCC)[NH2+]CC1(N(C)C)CC[NH+](C)CC1 ZINC001172518007 1049928187 /nfs/dbraw/zinc/92/81/87/1049928187.db2.gz VSXKYGFPADIJOU-LJQANCHMSA-N 2 0 325.585 4.131 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2cccnc2)[C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172554711 1049930124 /nfs/dbraw/zinc/93/01/24/1049930124.db2.gz BSWMPTLOXXKZTC-ODAXIHTASA-N 2 0 349.522 4.490 20 0 EIADRP c1ccc([C@@H]2CC[C@H]([NH2+]CC3CC[NH+](Cc4cccnc4)CC3)C2)cc1 ZINC001172558562 1049932703 /nfs/dbraw/zinc/93/27/03/1049932703.db2.gz VLGVPSAGBYHZPB-PKTZIBPZSA-N 2 0 349.522 4.220 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC001172568176 1049938276 /nfs/dbraw/zinc/93/82/76/1049938276.db2.gz OXUPDLNJZHBXJM-TZMCWYRMSA-N 2 0 330.850 4.013 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC12CC[NH+](CC1)CC2 ZINC001172579441 1049951885 /nfs/dbraw/zinc/95/18/85/1049951885.db2.gz WDTBGHMUWXAEIF-CYBMUJFWSA-N 2 0 342.861 4.015 20 0 EIADRP CC1(C)CC([NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)CC(C)(C)O1 ZINC001172644816 1049954988 /nfs/dbraw/zinc/95/49/88/1049954988.db2.gz ZSGCMJYCJZNEPP-LJQANCHMSA-N 2 0 344.543 4.224 20 0 EIADRP CC1(C)CC([NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CC(C)(C)O1 ZINC001172644814 1049955044 /nfs/dbraw/zinc/95/50/44/1049955044.db2.gz ZSGCMJYCJZNEPP-IBGZPJMESA-N 2 0 344.543 4.224 20 0 EIADRP Clc1ccc2c(c1)C[C@H]([NH2+]CC1CC[NH+](CC3CCCC3)CC1)C2 ZINC001172717179 1049963657 /nfs/dbraw/zinc/96/36/57/1049963657.db2.gz RAQKFMWIIQTCMY-OAQYLSRUSA-N 2 0 346.946 4.299 20 0 EIADRP Clc1ccc2c(c1)C[C@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001172716989 1049963758 /nfs/dbraw/zinc/96/37/58/1049963758.db2.gz CQOYCAKNRKWRDN-VQTJNVASSA-N 2 0 332.919 4.148 20 0 EIADRP Cc1nccn1CCCC[N@@H+](Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 ZINC000246381272 1049965138 /nfs/dbraw/zinc/96/51/38/1049965138.db2.gz ZPMBSVJLYIKFJS-BEFAXECRSA-N 2 0 327.472 4.353 20 0 EIADRP CC(C)OC(=O)CC[C@@H](C)[N@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172750809 1049971283 /nfs/dbraw/zinc/97/12/83/1049971283.db2.gz GFCIBTMYAMZHNG-ZHALLVOQSA-N 2 0 338.536 4.011 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1)c1cccs1 ZINC000247073213 1050012475 /nfs/dbraw/zinc/01/24/75/1050012475.db2.gz OJMWLTDNDWHDNS-BRWVUGGUSA-N 2 0 344.524 4.208 20 0 EIADRP CCC[C@H]([NH2+][C@@H]1CC[N@H+](CCCOCC)C[C@H]1C)c1ccsc1 ZINC000249080965 1050090213 /nfs/dbraw/zinc/09/02/13/1050090213.db2.gz LOPPMPMVMMUCGZ-QRQLOZEOSA-N 2 0 338.561 4.316 20 0 EIADRP CCc1ccc([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)s1 ZINC000089214975 1050111711 /nfs/dbraw/zinc/11/17/11/1050111711.db2.gz DDPDUTJRLXTDNM-HNNXBMFYSA-N 2 0 329.513 4.273 20 0 EIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cc2ccccc2o1 ZINC000089215208 1050111835 /nfs/dbraw/zinc/11/18/35/1050111835.db2.gz WYRQKURFOQENSY-INIZCTEOSA-N 2 0 335.451 4.395 20 0 EIADRP Clc1cc2c(c(Cl)c1)CC[C@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000089696001 1050128509 /nfs/dbraw/zinc/12/85/09/1050128509.db2.gz PRPLALUPGOEJQE-PIGZYNQJSA-N 2 0 325.283 4.055 20 0 EIADRP COc1ccc(C[NH2+]CCC[NH+]2C[C@H](C)C[C@@H](C)C2)c2ccccc12 ZINC001177293860 1050178355 /nfs/dbraw/zinc/17/83/55/1050178355.db2.gz AHEPMIMUVXBDGW-QZTJIDSGSA-N 2 0 340.511 4.306 20 0 EIADRP COCc1c(C)cc(C)c(C[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)c1C ZINC001177299368 1050179823 /nfs/dbraw/zinc/17/98/23/1050179823.db2.gz PIYJOGSJLHIXSD-QGZVFWFLSA-N 2 0 346.559 4.360 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[NH2+]CCc1ccc(C[NH+](C)C)cc1 ZINC001172856788 1050195050 /nfs/dbraw/zinc/19/50/50/1050195050.db2.gz OFGZXGIDLLOFMA-OAHLLOKOSA-N 2 0 348.893 4.304 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)n1cc(CC[NH3+])c2c[nH+]ccc21 ZINC001172860303 1050197919 /nfs/dbraw/zinc/19/79/19/1050197919.db2.gz ZRJMFSSAIDFQAN-LBPRGKRZSA-N 2 0 331.822 4.134 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H](C)C[NH+]1CCCCC1 ZINC001177416613 1050211025 /nfs/dbraw/zinc/21/10/25/1050211025.db2.gz UDMOZXQARRXAQD-CQSZACIVSA-N 2 0 328.422 4.225 20 0 EIADRP C(C[NH+]1CCCC1)[C@@H]1CCCC[N@@H+]1C1CCC2(CCOCC2)CC1 ZINC001173049142 1050273225 /nfs/dbraw/zinc/27/32/25/1050273225.db2.gz AZEVRWNKAXDBFZ-IBGZPJMESA-N 2 0 334.548 4.066 20 0 EIADRP CC(C)c1nc(C[NH2+]CCCCC[NH+]2CCCCC2)c2ccccn21 ZINC001177679626 1050276969 /nfs/dbraw/zinc/27/69/69/1050276969.db2.gz WZUFIZHYOMMBHW-UHFFFAOYSA-N 2 0 342.531 4.204 20 0 EIADRP CCCOC1CCC([NH+]2CCC3(CCC[N@@H+]3CC3CC3)CC2)CC1 ZINC001173097671 1050288252 /nfs/dbraw/zinc/28/82/52/1050288252.db2.gz IIJZWOJIBFBKAL-UHFFFAOYSA-N 2 0 334.548 4.065 20 0 EIADRP CC[C@H](C)CN(C)c1ccc(F)cc1C[NH2+]CC1CC[NH+](CC)CC1 ZINC001177737097 1050288944 /nfs/dbraw/zinc/28/89/44/1050288944.db2.gz KNBHLHGWGWOVMJ-KRWDZBQOSA-N 2 0 349.538 4.130 20 0 EIADRP CCC[NH+]1CCC(C[NH2+]Cc2cccc3c(OC)cccc23)CC1 ZINC001177736906 1050289483 /nfs/dbraw/zinc/28/94/83/1050289483.db2.gz FRFUKFWXMUHCJK-UHFFFAOYSA-N 2 0 326.484 4.060 20 0 EIADRP CCC[NH+]1CCC(C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)CC1 ZINC001177737859 1050290520 /nfs/dbraw/zinc/29/05/20/1050290520.db2.gz WKLYQKPAFPHBTN-UHFFFAOYSA-N 2 0 348.437 4.436 20 0 EIADRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)CCO1 ZINC001177742993 1050292001 /nfs/dbraw/zinc/29/20/01/1050292001.db2.gz KBIJZEMOHDVQPY-VXKWHMMOSA-N 2 0 344.543 4.212 20 0 EIADRP CCCC1CCC([NH2+]CCc2ccc(OCC[NH+](C)C)cc2)CC1 ZINC001177785506 1050300957 /nfs/dbraw/zinc/30/09/57/1050300957.db2.gz YJQMOTDGWSSCFV-UHFFFAOYSA-N 2 0 332.532 4.118 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](c2ccccc2)c2ccccn2)CC1 ZINC001173103487 1050305705 /nfs/dbraw/zinc/30/57/05/1050305705.db2.gz JMZAIMFMBCYIHS-AOMIVXANSA-N 2 0 337.511 4.414 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001173103385 1050306087 /nfs/dbraw/zinc/30/60/87/1050306087.db2.gz AOMALRFKPKVRPC-UHFFFAOYSA-N 2 0 328.422 4.448 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](C)c2c(OC)cccc2OC)CC1 ZINC001173106701 1050307169 /nfs/dbraw/zinc/30/71/69/1050307169.db2.gz BQTAZUIAZBXYKR-GTPINHCMSA-N 2 0 334.504 4.007 20 0 EIADRP CCC(CC)[N@@H+](C1CCC([NH+](CC)CC)CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173106396 1050307952 /nfs/dbraw/zinc/30/79/52/1050307952.db2.gz NMYMFHFQRDKHQY-QEZSOMHNSA-N 3 0 337.596 4.400 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CC2CC[NH+](CC3CCCC3)CC2)CC1 ZINC001173107500 1050308459 /nfs/dbraw/zinc/30/84/59/1050308459.db2.gz UUDJUHUHJOIFHP-UHFFFAOYSA-N 3 0 349.607 4.131 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC3(COc4ccccc43)CC2)CC1 ZINC001173112920 1050309164 /nfs/dbraw/zinc/30/91/64/1050309164.db2.gz DXSJPFHOUSGLBE-UHFFFAOYSA-N 2 0 342.527 4.066 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC3(CC(OCC4CC4)C3)CC2)CC1 ZINC001173112700 1050309675 /nfs/dbraw/zinc/30/96/75/1050309675.db2.gz ZTQJXNITMYERMO-UHFFFAOYSA-N 2 0 348.575 4.311 20 0 EIADRP c1ccc(CC2CC[NH+](CCCC[NH2+]C[C@@H]3CCC=CO3)CC2)cc1 ZINC000775032929 1050364221 /nfs/dbraw/zinc/36/42/21/1050364221.db2.gz YBXGJBFMKSWZHU-QFIPXVFZSA-N 2 0 342.527 4.004 20 0 EIADRP CCc1ccc(C[C@@H](C)[NH2+]CC2CC[NH+](CC3CCC3)CC2)cc1 ZINC001173242515 1050396587 /nfs/dbraw/zinc/39/65/87/1050396587.db2.gz VKCHYBXZISGNBS-GOSISDBHSA-N 2 0 328.544 4.282 20 0 EIADRP CCc1ccc(C[C@@H](C)[NH+]2CCC([NH+]3CCC(F)CC3)CC2)cc1 ZINC001173242590 1050397337 /nfs/dbraw/zinc/39/73/37/1050397337.db2.gz GWUXQOGCTVJICR-QGZVFWFLSA-N 2 0 332.507 4.078 20 0 EIADRP CCc1ccc(C[C@@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1 ZINC001173241981 1050397704 /nfs/dbraw/zinc/39/77/04/1050397704.db2.gz RKUATEABQQHWAA-GOSISDBHSA-N 2 0 328.544 4.424 20 0 EIADRP CCSC[C@H](C)[NH+]1CCC([NH3+])(c2ccc(C(F)(F)F)cc2)CC1 ZINC001173295282 1050398267 /nfs/dbraw/zinc/39/82/67/1050398267.db2.gz KQTVUTSQDDMCFE-ZDUSSCGKSA-N 2 0 346.462 4.097 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3nc4c(s3)CCCC4)CC2)CC1 ZINC001178280672 1050425491 /nfs/dbraw/zinc/42/54/91/1050425491.db2.gz NTIVPBTYLMEIMX-UHFFFAOYSA-N 2 0 347.572 4.155 20 0 EIADRP Fc1cc2c(cc1F)CC([NH2+]CC1CC[NH+](C3CCCCC3)CC1)C2 ZINC001173474581 1050456483 /nfs/dbraw/zinc/45/64/83/1050456483.db2.gz XNLLTFUYYSZYSD-UHFFFAOYSA-N 2 0 348.481 4.066 20 0 EIADRP c1cc(C[N@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc(-c2ccncc2)c1 ZINC000093683662 1050657971 /nfs/dbraw/zinc/65/79/71/1050657971.db2.gz KLKKOXVKRUQHQL-FQEVSTJZSA-N 2 0 335.495 4.056 20 0 EIADRP c1ccc(-c2cccc(C[N@H+]3CC[C@H](C[NH+]4CCCCC4)C3)c2)nc1 ZINC000093683704 1050659136 /nfs/dbraw/zinc/65/91/36/1050659136.db2.gz MDZOXWHVWOZCOR-HXUWFJFHSA-N 2 0 335.495 4.056 20 0 EIADRP Clc1cc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)c(Cl)s1 ZINC001179254345 1050659958 /nfs/dbraw/zinc/65/99/58/1050659958.db2.gz ZBJBTEXCMZQXJS-UHFFFAOYSA-N 2 0 333.328 4.267 20 0 EIADRP c1ccc(OC2CCCC2)c(C[NH2+]CC2CC[NH+](CC3CC3)CC2)c1 ZINC001179253948 1050660166 /nfs/dbraw/zinc/66/01/66/1050660166.db2.gz VDJGYQITISOUSV-UHFFFAOYSA-N 2 0 342.527 4.220 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]C1CCc2ccccc2CC1 ZINC001179338365 1050680292 /nfs/dbraw/zinc/68/02/92/1050680292.db2.gz GKMNTOZAAUPNIX-XXBNENTESA-N 2 0 348.534 4.292 20 0 EIADRP C[NH+]1CCC(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)(c2ccccc2)CC1 ZINC001179369860 1050684909 /nfs/dbraw/zinc/68/49/09/1050684909.db2.gz MKEFEJSQCQHYCS-UNMCSNQZSA-N 2 0 334.507 4.043 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CC2(c3ccccc3)CC[NH+](C)CC2)CC(C)(C)C1 ZINC001179369578 1050684938 /nfs/dbraw/zinc/68/49/38/1050684938.db2.gz JTWAWCDWAVAKPH-AZUAARDMSA-N 2 0 328.544 4.454 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+]Cc2csc3ccccc23)c1 ZINC000069711623 1050773298 /nfs/dbraw/zinc/77/32/98/1050773298.db2.gz JXNAQIXPPUVLGP-UHFFFAOYSA-N 2 0 340.492 4.132 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]C[C@@H]2CCCS2)ccc1OC ZINC000183107338 1050979816 /nfs/dbraw/zinc/97/98/16/1050979816.db2.gz OSGZIQKRHAFHDR-QAPCUYQASA-N 2 0 336.545 4.083 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@@H]2CCCS2)ccc1OC ZINC000183107355 1050980325 /nfs/dbraw/zinc/98/03/25/1050980325.db2.gz OSGZIQKRHAFHDR-YJBOKZPZSA-N 2 0 336.545 4.083 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]C[C@H]2CCCS2)ccc1OC ZINC000183107372 1050981522 /nfs/dbraw/zinc/98/15/22/1050981522.db2.gz OSGZIQKRHAFHDR-CRAIPNDOSA-N 2 0 336.545 4.083 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]CC1(C[NH+](C)C)CCCC1)CC3 ZINC001180673276 1051051978 /nfs/dbraw/zinc/05/19/78/1051051978.db2.gz MJLHOQAOVAFUIL-KRWDZBQOSA-N 2 0 339.527 4.045 20 0 EIADRP CCOCOc1ccc(C[NH2+]C(C)(C)CC[NH+]2CCCCCC2)cc1 ZINC000775362454 1051129317 /nfs/dbraw/zinc/12/93/17/1051129317.db2.gz HDGZFMAKEMUSRL-UHFFFAOYSA-N 2 0 348.531 4.194 20 0 EIADRP CC(C)(C)[C@@]1(C[NH2+][C@H]2CSC2(C)C)CC[N@H+](Cc2ccccc2)C1 ZINC001181204819 1051180467 /nfs/dbraw/zinc/18/04/67/1051180467.db2.gz IMBBSNPNWGJUDA-GHTZIAJQSA-N 2 0 346.584 4.408 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@H](OC)C(C)C)cc1C[NH+]1CCCCC1 ZINC000775396033 1051217667 /nfs/dbraw/zinc/21/76/67/1051217667.db2.gz OWYVVHMMDCBTCK-UWJYYQICSA-N 2 0 348.531 4.003 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@H]2CCCSC2)ccc1OC ZINC000775397548 1051218086 /nfs/dbraw/zinc/21/80/86/1051218086.db2.gz WDDAHFHITGUISV-QAPCUYQASA-N 2 0 336.545 4.083 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@@H]2CCC[C@H]2OC)ccc1OC ZINC000775416051 1051290753 /nfs/dbraw/zinc/29/07/53/1051290753.db2.gz CWDTYNUTRUWUJF-XKGZKEIXSA-N 2 0 348.531 4.003 20 0 EIADRP Cc1ccc(CC[N@@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)cc1C ZINC001181698599 1051291017 /nfs/dbraw/zinc/29/10/17/1051291017.db2.gz SYIQSSFCRDRLBB-DEOSSOPVSA-N 2 0 348.534 4.444 20 0 EIADRP C[C@H](O)C[N@H+](Cc1cccc(C[NH+]2CCCCC2)c1)C1CCCCC1 ZINC001190855562 1051291629 /nfs/dbraw/zinc/29/16/29/1051291629.db2.gz SYKMPHFJZNERDW-IBGZPJMESA-N 2 0 344.543 4.188 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CC2(C)CCOCC2)ccc1OC ZINC000775416679 1051292564 /nfs/dbraw/zinc/29/25/64/1051292564.db2.gz WREPXEPLDLFCGF-QGZVFWFLSA-N 2 0 348.531 4.004 20 0 EIADRP [NH3+]C[C@]1(F)CCC[N@H+](CCCc2ccc(Cl)c(Cl)c2)CC1 ZINC001205546419 1051319454 /nfs/dbraw/zinc/31/94/54/1051319454.db2.gz VDLCWKLLDXLGEG-INIZCTEOSA-N 2 0 333.278 4.079 20 0 EIADRP [NH3+]C[C@@]1(F)CCC[N@H+](Cc2cccc(C(F)(F)F)c2Cl)CC1 ZINC001205546380 1051320127 /nfs/dbraw/zinc/32/01/27/1051320127.db2.gz UOSBIZJMDCXUFL-CQSZACIVSA-N 2 0 338.776 4.012 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@@H]3CCCCC3(F)F)CC2)C1 ZINC001182054104 1051386467 /nfs/dbraw/zinc/38/64/67/1051386467.db2.gz SDNQLPCNFSABMC-SOLBZPMBSA-N 2 0 328.491 4.445 20 0 EIADRP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC001182248659 1051441099 /nfs/dbraw/zinc/44/10/99/1051441099.db2.gz BKFSMQIURFCSLK-QGZVFWFLSA-N 2 0 347.384 4.464 20 0 EIADRP CCCOc1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000310872750 1051442049 /nfs/dbraw/zinc/44/20/49/1051442049.db2.gz GDZBVCWGXQJSPF-OAQYLSRUSA-N 2 0 338.495 4.087 20 0 EIADRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2ccc(C(F)(F)F)cc2Cl)CC1 ZINC001205571450 1051553475 /nfs/dbraw/zinc/55/34/75/1051553475.db2.gz URGBZBWBMSRQIE-AWEZNQCLSA-N 2 0 338.776 4.012 20 0 EIADRP CC[NH+](CC)CCC[NH2+]C(C)(C)c1ccc(Br)cc1 ZINC001192081266 1051622573 /nfs/dbraw/zinc/62/25/73/1051622573.db2.gz VNALLQIALGHXAI-UHFFFAOYSA-N 2 0 327.310 4.006 20 0 EIADRP C[C@@H]1SCC[C@@H]1[NH2+]C[C@@]1(C(C)(C)C)CC[N@H+](Cc2ccccc2)C1 ZINC001182726492 1051689267 /nfs/dbraw/zinc/68/92/67/1051689267.db2.gz UBWVZDNFWOZPGK-CUWPLCDZSA-N 2 0 346.584 4.408 20 0 EIADRP CCCC[C@@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC001182783851 1051712140 /nfs/dbraw/zinc/71/21/40/1051712140.db2.gz YNGAHHOHLUMWKK-RTWAWAEBSA-N 2 0 329.532 4.242 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]C2CCN(c3ccccc3)CC2)C1 ZINC000158582637 1051760656 /nfs/dbraw/zinc/76/06/56/1051760656.db2.gz RJRZWPSACDTMKH-WOJBJXKFSA-N 2 0 343.559 4.003 20 0 EIADRP Cc1nc2c(s1)[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)C[C@H](C)C1)CCC2 ZINC000158591659 1051763325 /nfs/dbraw/zinc/76/33/25/1051763325.db2.gz XVXAWIHLAXMMKM-YQQAZPJKSA-N 2 0 335.561 4.177 20 0 EIADRP C[C@@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]CC[C@H](C)[NH+](C)C ZINC001183105098 1051791807 /nfs/dbraw/zinc/79/18/07/1051791807.db2.gz YHHIGUYBXBWQEK-RYUDHWBXSA-N 2 0 336.829 4.220 20 0 EIADRP C[C@@H]1CC[N@H+](CCCc2ccc(Cl)c(Cl)c2)CC[C@H]1C[NH3+] ZINC001205604867 1051791972 /nfs/dbraw/zinc/79/19/72/1051791972.db2.gz YIORDIYVIJNARP-HIFRSBDPSA-N 2 0 329.315 4.233 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCOC23CCCCC3)CC1 ZINC001184067501 1051941853 /nfs/dbraw/zinc/94/18/53/1051941853.db2.gz RRXJRILXVFAMII-RLLQIKCJSA-N 2 0 334.548 4.111 20 0 EIADRP Cc1cc(C[N@H+]2C[C@@H]3CC[C@H]([NH+](C)C)C[C@@H]3C2)ccc1C(F)(F)F ZINC001184301166 1051982300 /nfs/dbraw/zinc/98/23/00/1051982300.db2.gz GARQDWZFRRPWTE-BBWFWOEESA-N 2 0 340.433 4.176 20 0 EIADRP C[N@@H+](Cc1cccc(F)c1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001203785616 1052034780 /nfs/dbraw/zinc/03/47/80/1052034780.db2.gz JFGZPPWOEAPYHC-UHFFFAOYSA-N 2 0 326.459 4.170 20 0 EIADRP Cc1ccsc1[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000165309565 1052056407 /nfs/dbraw/zinc/05/64/07/1052056407.db2.gz DLVLXDIJMLATDM-MJGOQNOKSA-N 2 0 328.525 4.272 20 0 EIADRP Cc1ccsc1[C@H](C)[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000165309953 1052058222 /nfs/dbraw/zinc/05/82/22/1052058222.db2.gz DLVLXDIJMLATDM-PKOBYXMFSA-N 2 0 328.525 4.272 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000166070686 1052081797 /nfs/dbraw/zinc/08/17/97/1052081797.db2.gz VWBXYYKZJJVMQK-RBBKRZOGSA-N 2 0 338.495 4.006 20 0 EIADRP FC(F)(F)c1ccc(C2([NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@H]4C3)CCC2)cc1 ZINC000622043783 1052083214 /nfs/dbraw/zinc/08/32/14/1052083214.db2.gz LRZPEMSXJWATQO-CKEIUWERSA-N 2 0 338.417 4.062 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccc(C(C)(C)O)cc2)cc1 ZINC000296663324 1052091834 /nfs/dbraw/zinc/09/18/34/1052091834.db2.gz FSPUASCBVYVCTM-UHFFFAOYSA-N 2 0 340.511 4.046 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCCc2ccc(O)cc21 ZINC000336890330 1052107047 /nfs/dbraw/zinc/10/70/47/1052107047.db2.gz NNXMLDJSVYXAMH-QFIPXVFZSA-N 2 0 338.495 4.401 20 0 EIADRP c1csc(CC[NH+]2CCC(c3ccccc3)([NH+]3CCCC3)CC2)c1 ZINC001176567271 1052132842 /nfs/dbraw/zinc/13/28/42/1052132842.db2.gz JRHPQOHNYFHANU-UHFFFAOYSA-N 2 0 340.536 4.378 20 0 EIADRP c1cc(C[N@@H+]2CCCSC[C@@H]2C2CC2)ccc1C[NH+]1CCCCC1 ZINC001176650356 1052168201 /nfs/dbraw/zinc/16/82/01/1052168201.db2.gz REURFYBCNBMUDD-OAQYLSRUSA-N 2 0 344.568 4.390 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccccc1OC(F)F ZINC000171128303 1052395995 /nfs/dbraw/zinc/39/59/95/1052395995.db2.gz BEBACTXEFLIWKC-AWEZNQCLSA-N 2 0 334.410 4.200 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000339066075 1052551937 /nfs/dbraw/zinc/55/19/37/1052551937.db2.gz FCEQNTHQKQVAJG-RZUBCFFCSA-N 2 0 344.543 4.399 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CN[C@@H]1CC[NH+](C)C(C)(C)C1 ZINC000623357836 1052631907 /nfs/dbraw/zinc/63/19/07/1052631907.db2.gz CAZRBZRLHWWQQM-GHTZIAJQSA-N 2 0 343.559 4.023 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cc(Cl)ccc1O ZINC000185634315 1052663407 /nfs/dbraw/zinc/66/34/07/1052663407.db2.gz HLMXEGZDLMRZMU-AWEZNQCLSA-N 2 0 336.907 4.493 20 0 EIADRP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623487708 1052663901 /nfs/dbraw/zinc/66/39/01/1052663901.db2.gz NVIMUUGRBODESG-DZGCQCFKSA-N 2 0 328.422 4.099 20 0 EIADRP C[C@@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(Oc2cccnc2)cc1 ZINC000623526032 1052672785 /nfs/dbraw/zinc/67/27/85/1052672785.db2.gz HTSDRMDCLTWKJB-AEFFLSMTSA-N 2 0 339.483 4.397 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@H](C)[C@@H](C)c2nc3ccccc3s2)CC1 ZINC000177836378 1052691676 /nfs/dbraw/zinc/69/16/76/1052691676.db2.gz MDUOHUVGOKYRQE-HZPDHXFCSA-N 2 0 345.556 4.498 20 0 EIADRP C[C@H](NC1CC[NH+](CC2CC2)CC1)c1ccc(F)cc1C(F)(F)F ZINC000623868152 1052830231 /nfs/dbraw/zinc/83/02/31/1052830231.db2.gz URPAZBMHSDOUTG-LBPRGKRZSA-N 2 0 344.396 4.370 20 0 EIADRP Cc1csc([C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)n1 ZINC000623924198 1052838831 /nfs/dbraw/zinc/83/88/31/1052838831.db2.gz VLRCZIRXESRYOW-ZIFCJYIRSA-N 2 0 343.540 4.403 20 0 EIADRP CCC(F)(F)C(C)(C)C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000624155005 1052870030 /nfs/dbraw/zinc/87/00/30/1052870030.db2.gz CGQZICDWOJJTQJ-OAHLLOKOSA-N 2 0 342.474 4.349 20 0 EIADRP C[C@@H]([NH2+]Cc1cnc2c(F)cccc2c1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000865523484 1053534954 /nfs/dbraw/zinc/53/49/54/1053534954.db2.gz CFQLRQRFCUOGFV-QAPCUYQASA-N 2 0 341.474 4.117 20 0 EIADRP C[C@H](Cc1ccc(F)cc1)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000385671923 1053541832 /nfs/dbraw/zinc/54/18/32/1053541832.db2.gz DXSHQXWENFQPIQ-LQWHRVPQSA-N 2 0 340.486 4.257 20 0 EIADRP CC(C)c1cnc(C[NH2+]CC2(c3ccccc3)CC[NH+](C)CC2)s1 ZINC000865774080 1053589309 /nfs/dbraw/zinc/58/93/09/1053589309.db2.gz OTFXYAQCQFJSLZ-UHFFFAOYSA-N 2 0 343.540 4.020 20 0 EIADRP CC(C)[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C(C)C)c1ccccn1 ZINC000866231824 1053659156 /nfs/dbraw/zinc/65/91/56/1053659156.db2.gz AQJMBHBIRKOZEW-NRFANRHFSA-N 2 0 325.500 4.409 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2cc3c(ccnc3Cl)o2)CC1 ZINC000866258802 1053666515 /nfs/dbraw/zinc/66/65/15/1053666515.db2.gz BDXDDARHLUFTJY-CYBMUJFWSA-N 2 0 335.879 4.254 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2cc3c(ccnc3Cl)o2)CC1 ZINC000866273677 1053673594 /nfs/dbraw/zinc/67/35/94/1053673594.db2.gz RKWGJCWUHOIMBA-CYBMUJFWSA-N 2 0 335.879 4.254 20 0 EIADRP C[C@H]([NH2+]CCC1CC[NH+](Cc2ccccc2)CC1)c1nccs1 ZINC000866468464 1053739840 /nfs/dbraw/zinc/73/98/40/1053739840.db2.gz AOASNMIRYUVFKK-INIZCTEOSA-N 2 0 329.513 4.096 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)CCS2 ZINC000866518376 1053764486 /nfs/dbraw/zinc/76/44/86/1053764486.db2.gz YKROSWWIUWPTJA-KGYZHSKHSA-N 2 0 334.529 4.085 20 0 EIADRP [NH3+]CC[C@@H]1CN(c2ccc3c(c2)[nH]c2cc[nH+]cc23)c2ccccc21 ZINC001168549778 1053827715 /nfs/dbraw/zinc/82/77/15/1053827715.db2.gz VPLFBVZNSZYWGS-CQSZACIVSA-N 2 0 328.419 4.300 20 0 EIADRP Cc1cccc(Cl)c1C[NH2+][C@H](Cn1ccnc1)c1ccccc1 ZINC001197264774 1053865157 /nfs/dbraw/zinc/86/51/57/1053865157.db2.gz NMCZFEHGMPSJPD-LJQANCHMSA-N 2 0 325.843 4.376 20 0 EIADRP COC1CCC(CC[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)CC1 ZINC000542665990 1054031031 /nfs/dbraw/zinc/03/10/31/1054031031.db2.gz TXPRUQQTVLPDKM-QUWFBVPJSA-N 2 0 336.564 4.214 20 0 EIADRP CC[C@@H](CCC(F)(F)F)[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000872032508 1054350241 /nfs/dbraw/zinc/35/02/41/1054350241.db2.gz VICIDGYXKIORFS-MSOLQXFVSA-N 2 0 342.449 4.262 20 0 EIADRP CC(C)[C@H](C[NH2+][C@H]1CCCc2ccccc2C1)[NH+]1CCCCCC1 ZINC001199161235 1054355904 /nfs/dbraw/zinc/35/59/04/1054355904.db2.gz IQAZKFGQPGSSJO-VXKWHMMOSA-N 2 0 328.544 4.424 20 0 EIADRP Clc1ccc2c(n1)[C@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CC2 ZINC000857900978 1054378967 /nfs/dbraw/zinc/37/89/67/1054378967.db2.gz GRAPDYRFSHKVTC-GOSISDBHSA-N 2 0 341.886 4.108 20 0 EIADRP CC[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@H+]2C[C@H](C)C[C@H](C)C2)CCO1 ZINC001199310373 1054385891 /nfs/dbraw/zinc/38/58/91/1054385891.db2.gz TZUJWHJDPWKWHF-GMQQQROESA-N 2 0 344.543 4.212 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@@H]2CCCc3ccccc3C2)C1 ZINC001199319975 1054390894 /nfs/dbraw/zinc/39/08/94/1054390894.db2.gz GJAGRXXJGCVLFZ-WOIUINJBSA-N 2 0 328.544 4.282 20 0 EIADRP CC1(C)CCC[C@@H]([NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)C1 ZINC001199403213 1054406728 /nfs/dbraw/zinc/40/67/28/1054406728.db2.gz LOVMAUVBJCYCLL-HXUWFJFHSA-N 2 0 343.559 4.147 20 0 EIADRP C=Cc1ccc(CNc2ccc(C[NH+]3CCC(C[NH3+])CC3)cc2)cc1 ZINC001168578933 1054429642 /nfs/dbraw/zinc/42/96/42/1054429642.db2.gz WYZQORJKEOAQIB-UHFFFAOYSA-N 2 0 335.495 4.112 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1Cc1c[nH]c2c1cccc2F ZINC001137059307 1054442494 /nfs/dbraw/zinc/44/24/94/1054442494.db2.gz WGYKMZXCPJAWTJ-DLBZAZTESA-N 2 0 329.463 4.146 20 0 EIADRP CCC1([NH+](C)C)CC[NH+](Cn2ccc(=S)c3ccccc32)CC1 ZINC000872670920 1054457435 /nfs/dbraw/zinc/45/74/35/1054457435.db2.gz KGCUEONFVTZLQJ-UHFFFAOYSA-N 2 0 329.513 4.134 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(-n2ccnc2C)nc1)c1cc(C)ccc1C ZINC000858353468 1054470999 /nfs/dbraw/zinc/47/09/99/1054470999.db2.gz HZVYDEYRZXOEHO-FQEVSTJZSA-N 2 0 334.467 4.433 20 0 EIADRP Fc1cccc(/C=C/C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c1 ZINC001199883570 1054490649 /nfs/dbraw/zinc/49/06/49/1054490649.db2.gz KIFZVSBFFZIEFS-GORDUTHDSA-N 2 0 344.499 4.402 20 0 EIADRP C[C@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC001199963327 1054504728 /nfs/dbraw/zinc/50/47/28/1054504728.db2.gz WJORURSJCVQHEV-IUODEOHRSA-N 2 0 329.315 4.387 20 0 EIADRP Clc1cccc(C2([NH2+]Cc3cc4c(s3)CC[NH2+]C4)CCC2)c1 ZINC000873213497 1054509268 /nfs/dbraw/zinc/50/92/68/1054509268.db2.gz FTQCENZCWDAFNA-UHFFFAOYSA-N 2 0 332.900 4.216 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+][C@H](C)C3CC[NH2+]CC3)cs2)cs1 ZINC000873267293 1054516812 /nfs/dbraw/zinc/51/68/12/1054516812.db2.gz BJBWMVSZTQTLST-VXGBXAGGSA-N 2 0 335.542 4.219 20 0 EIADRP CC(C)[NH+](CCC[NH2+]Cc1cccc(-c2ccccn2)c1)C(C)C ZINC001200921112 1054574666 /nfs/dbraw/zinc/57/46/66/1054574666.db2.gz CPKMYOMPUVFPIT-UHFFFAOYSA-N 2 0 325.500 4.347 20 0 EIADRP C[N@H+](Cc1ccco1)[C@H]1CCC12CC[NH+](C[C@@H]1CC=CCC1)CC2 ZINC001201408956 1054789235 /nfs/dbraw/zinc/78/92/35/1054789235.db2.gz MXIJBXUSFNRJPA-QUCCMNQESA-N 2 0 328.500 4.312 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(C(F)(F)F)cc2)C1 ZINC001201559506 1054848451 /nfs/dbraw/zinc/84/84/51/1054848451.db2.gz ZEHIOMAJVAETLB-INIZCTEOSA-N 2 0 328.422 4.163 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccccc2CC(F)(F)F)C1 ZINC001201566936 1054852355 /nfs/dbraw/zinc/85/23/55/1054852355.db2.gz QJBLCRULSRMEAL-INIZCTEOSA-N 2 0 342.449 4.249 20 0 EIADRP c1ccc(CCC[N@@H+]2CC[C@H]3C[NH+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001201681704 1054875241 /nfs/dbraw/zinc/87/52/41/1054875241.db2.gz CIZQLBIMNVMSIZ-ZEQRLZLVSA-N 2 0 348.534 4.463 20 0 EIADRP CCCCCC[N@@H+]1CC[C@@]2(C[NH+](CC3CC3)C[C@@H]2COCC2CC2)C1 ZINC001201751397 1054896363 /nfs/dbraw/zinc/89/63/63/1054896363.db2.gz TVSDQUVIXNUKTE-YADHBBJMSA-N 2 0 348.575 4.027 20 0 EIADRP c1ccc(N2CCC([NH2+]CCCCCCC[NH+]3CCCC3)CC2)cc1 ZINC000765773913 1054920106 /nfs/dbraw/zinc/92/01/06/1054920106.db2.gz BMRARQQOVXTSQL-UHFFFAOYSA-N 2 0 343.559 4.291 20 0 EIADRP Cc1ccncc1[C@H](C)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000671750914 1054978428 /nfs/dbraw/zinc/97/84/28/1054978428.db2.gz CJCNDNLGKPFXNE-PELRDEGISA-N 2 0 337.511 4.484 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2CCCCS2)CC1 ZINC000671760237 1055044555 /nfs/dbraw/zinc/04/45/55/1055044555.db2.gz MHQUVAODBFZCTQ-MHJFOBGBSA-N 2 0 332.557 4.305 20 0 EIADRP Cc1c(C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)ccnc1F ZINC000862274929 1055045640 /nfs/dbraw/zinc/04/56/40/1055045640.db2.gz XQKQRVIIQIFMND-UHFFFAOYSA-N 2 0 341.474 4.195 20 0 EIADRP FC(F)C1(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000671762704 1055053787 /nfs/dbraw/zinc/05/37/87/1055053787.db2.gz GYPRWQFEIDKXDS-GBESFXJTSA-N 2 0 348.481 4.312 20 0 EIADRP CCO[P@](C)(=O)CC[C@@H](C)[NH2+]C[C@@H]1CCC[N@@H+]1C1CCCCC1 ZINC000877495656 1055065002 /nfs/dbraw/zinc/06/50/02/1055065002.db2.gz GQOIFDCLTZLKMR-QSAZIKIQSA-N 2 0 344.480 4.096 20 0 EIADRP Cc1cc([NH+]2CCCCCC2)ccc1N[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000671766315 1055071742 /nfs/dbraw/zinc/07/17/42/1055071742.db2.gz CWVSLAHOOGJBMC-MOPGFXCFSA-N 2 0 327.516 4.414 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cc3c(ccnc3Cl)o2)cc1 ZINC000877525197 1055071965 /nfs/dbraw/zinc/07/19/65/1055071965.db2.gz UTUAJCCPYDEEQA-UHFFFAOYSA-N 2 0 343.858 4.175 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CS1 ZINC000877546914 1055076977 /nfs/dbraw/zinc/07/69/77/1055076977.db2.gz NPUPSUNBSGIMEB-MFPFXBIISA-N 2 0 330.541 4.056 20 0 EIADRP CCC(CC)(C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)C(F)(F)F ZINC000877707757 1055109963 /nfs/dbraw/zinc/10/99/63/1055109963.db2.gz GABPRINOLLZAQS-UHFFFAOYSA-N 2 0 329.410 4.009 20 0 EIADRP CCO[C@H]1CCC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)C1 ZINC001202288319 1055125409 /nfs/dbraw/zinc/12/54/09/1055125409.db2.gz AZEBTNZZKJDQHO-VXKWHMMOSA-N 2 0 344.543 4.356 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)C1CCCC1 ZINC001202388581 1055145960 /nfs/dbraw/zinc/14/59/60/1055145960.db2.gz TWQDLAHSYUFRAJ-NRFANRHFSA-N 2 0 330.516 4.220 20 0 EIADRP CSCc1ccc(C[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1 ZINC000921743939 1056387663 /nfs/dbraw/zinc/38/76/63/1056387663.db2.gz ASOIDXSKTWUUJM-UHFFFAOYSA-N 2 0 332.488 4.040 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)cc1F ZINC000766511907 1060481049 /nfs/dbraw/zinc/48/10/49/1060481049.db2.gz GIMJSJPVKSPKQR-ZLPCBKJTSA-N 2 0 334.479 4.282 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)c(F)c1 ZINC000766511981 1060483494 /nfs/dbraw/zinc/48/34/94/1060483494.db2.gz UZJQDXMGSATUDR-KLAILNCOSA-N 2 0 334.479 4.282 20 0 EIADRP Cc1ncn([C@H](Cc2ccccc2)CC(C)C)c1CSCC[NH3+] ZINC001169058747 1060617390 /nfs/dbraw/zinc/61/73/90/1060617390.db2.gz KNDJPBRDCRURAZ-SFHVURJKSA-N 2 0 331.529 4.213 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1(Cc3ccccc3)CCC(F)(F)CC1)C2 ZINC001169117140 1060646343 /nfs/dbraw/zinc/64/63/43/1060646343.db2.gz WKNUQGUQEBLWMZ-REPLKXPHSA-N 2 0 348.481 4.392 20 0 EIADRP CCCC[C@@H]([NH3+])Cc1cn([C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc12 ZINC001169109484 1060658176 /nfs/dbraw/zinc/65/81/76/1060658176.db2.gz JDNYHUBZMNHQQG-ZRNYENFQSA-N 2 0 339.527 4.499 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CC[C@@H](c3cccc(C(F)(F)F)c3)C1)C2 ZINC001169141062 1060661285 /nfs/dbraw/zinc/66/12/85/1060661285.db2.gz OMLXCFHNMAOCEV-BGTYHANMSA-N 2 0 338.417 4.120 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1c1ccc(N[C@@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)nc1 ZINC001169141807 1060662307 /nfs/dbraw/zinc/66/23/07/1060662307.db2.gz KWSLKQMCLDDPLD-OPYAIIAOSA-N 2 0 344.547 4.194 20 0 EIADRP CC1(C)C[NH+](Cc2ccc(C[NH+]3CCCCC3)cc2)CC(C)(C)O1 ZINC001169342979 1060777267 /nfs/dbraw/zinc/77/72/67/1060777267.db2.gz QSJLAXGEUDYKQV-UHFFFAOYSA-N 2 0 330.516 4.062 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)C1CCOCC1 ZINC000532192760 1032081598 /nfs/dbraw/zinc/08/15/98/1032081598.db2.gz KTJZSDOJBXNXNT-XMSQKQJNSA-N 2 0 344.543 4.356 20 0 EIADRP CN(c1ccccc1)c1ccc(C[NH2+]C(C)(C)CCC[NH+](C)C)cn1 ZINC000449524756 1031822401 /nfs/dbraw/zinc/82/24/01/1031822401.db2.gz AALFIAFPYMGXAE-UHFFFAOYSA-N 2 0 340.515 4.060 20 0 EIADRP Cc1cc(C)c(C[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)c(C)c1 ZINC000532222176 1032100722 /nfs/dbraw/zinc/10/07/22/1032100722.db2.gz WYMHFBZMOKHNTF-LJQANCHMSA-N 2 0 340.511 4.403 20 0 EIADRP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000532225969 1032104358 /nfs/dbraw/zinc/10/43/58/1032104358.db2.gz GIPOACTXIFXJGR-FPOVZHCZSA-N 2 0 344.543 4.284 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc2c(c1)CC(C)(C)O2 ZINC000729678861 1032127973 /nfs/dbraw/zinc/12/79/73/1032127973.db2.gz UFNRBILCZJXEEV-KRWDZBQOSA-N 2 0 330.516 4.144 20 0 EIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]Cc1cccc2cc[nH]c21 ZINC000532374317 1032214895 /nfs/dbraw/zinc/21/48/95/1032214895.db2.gz FPAPDCFIMMKZTG-QZTJIDSGSA-N 2 0 347.506 4.414 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccc(C)c(OC)c2)c1 ZINC000194229555 1032242375 /nfs/dbraw/zinc/24/23/75/1032242375.db2.gz FSMPYUPAKIJDKG-UHFFFAOYSA-N 2 0 326.484 4.135 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCNCc1ccc(Sc2ccccn2)o1 ZINC000509672645 1032258553 /nfs/dbraw/zinc/25/85/53/1032258553.db2.gz KXBOBEIZUUTGKE-MRXNPFEDSA-N 2 0 345.512 4.180 20 0 EIADRP C[C@H]([NH2+]C1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)[C@@H]1CCCC[NH2+]1 ZINC000643458720 1032269192 /nfs/dbraw/zinc/26/91/92/1032269192.db2.gz UBOYWIVSKMTJHF-WGBDABJCSA-N 2 0 346.359 4.016 20 0 EIADRP CC[C@H]1C[C@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)CCO1 ZINC000648438667 1032307969 /nfs/dbraw/zinc/30/79/69/1032307969.db2.gz YRVYQQCHBGBGSC-RTWAWAEBSA-N 2 0 330.516 4.110 20 0 EIADRP CC[C@@H]1C[C@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)CCO1 ZINC000648438666 1032308578 /nfs/dbraw/zinc/30/85/78/1032308578.db2.gz YRVYQQCHBGBGSC-NHCUHLMSSA-N 2 0 330.516 4.110 20 0 EIADRP Cc1nc(C)c([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)s1 ZINC000178424713 1032537612 /nfs/dbraw/zinc/53/76/12/1032537612.db2.gz KKTWNBOEGKVOLG-AWEZNQCLSA-N 2 0 329.513 4.207 20 0 EIADRP Cc1cc(C)cc([C@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c1 ZINC000500568463 1032660101 /nfs/dbraw/zinc/66/01/01/1032660101.db2.gz WBSNMRRZJIYVAC-IBGZPJMESA-N 2 0 340.511 4.485 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)[C@H](C)c1nc2ccccc2s1 ZINC000643546131 1018897220 /nfs/dbraw/zinc/89/72/20/1018897220.db2.gz JEGOLFQUIZYMDL-KKUMJFAQSA-N 2 0 329.513 4.053 20 0 EIADRP C/C=C/COc1ccc(CC[C@H](C)[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000643546201 1018899732 /nfs/dbraw/zinc/89/97/32/1018899732.db2.gz KGDPICLPQGNFBP-XCJDPYLSSA-N 2 0 342.527 4.227 20 0 EIADRP Cc1cccc([C@@H](N[C@@H]2CC[NH2+]C3(CCC3)C2)c2cccc(F)c2)c1 ZINC000643547868 1018930072 /nfs/dbraw/zinc/93/00/72/1018930072.db2.gz KAQYGXRDKYOTQC-NHCUHLMSSA-N 2 0 338.470 4.488 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C(F)F)nc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000631108894 1019975152 /nfs/dbraw/zinc/97/51/52/1019975152.db2.gz IBFWDCZZCOPVOM-CRAIPNDOSA-N 2 0 345.437 4.019 20 0 EIADRP COC1CCC(C)(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000530522685 1020047502 /nfs/dbraw/zinc/04/75/02/1020047502.db2.gz QCRUQZHTKDGISV-JSFXGIFRSA-N 2 0 344.543 4.082 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccc3cnccc3c2)cc1 ZINC000327714271 1020165066 /nfs/dbraw/zinc/16/50/66/1020165066.db2.gz CLIJOENQRAZFJG-UHFFFAOYSA-N 2 0 333.479 4.366 20 0 EIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c(C)o1 ZINC000340172969 1020548583 /nfs/dbraw/zinc/54/85/83/1020548583.db2.gz JXIROOSFKCSABP-INIZCTEOSA-N 2 0 330.472 4.078 20 0 EIADRP CC1CC[NH+](C[C@@H]2CCCN(CC[C@H]3CC3(Cl)Cl)C2)CC1 ZINC001167255605 1020678088 /nfs/dbraw/zinc/67/80/88/1020678088.db2.gz JSZUAJWRNLHXIF-CVEARBPZSA-N 2 0 333.347 4.014 20 0 EIADRP CC(C)[C@@H]1CC[C@@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000579939188 1020904760 /nfs/dbraw/zinc/90/47/60/1020904760.db2.gz ORECVWPARJEOEJ-VXKWHMMOSA-N 2 0 344.543 4.082 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000655805436 1020972115 /nfs/dbraw/zinc/97/21/15/1020972115.db2.gz OBVYUNFJRJXSLM-HNONPPJISA-N 2 0 340.433 4.271 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](c2ccc(F)cc2)c2ccccc2Cl)C1 ZINC000655805515 1020972741 /nfs/dbraw/zinc/97/27/41/1020972741.db2.gz OTRTYFXBVFRADQ-CFLQYTFWSA-N 2 0 346.877 4.498 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)C1 ZINC000655804316 1020975117 /nfs/dbraw/zinc/97/51/17/1020975117.db2.gz UEZSNSDLUWALIT-WMQCIHAUSA-N 2 0 326.459 4.039 20 0 EIADRP Cc1cccc([C@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c2cccc(F)c2)c1 ZINC000655803944 1020976404 /nfs/dbraw/zinc/97/64/04/1020976404.db2.gz JKSIZLTUBOIEPE-DQLDELGASA-N 2 0 326.459 4.153 20 0 EIADRP Cc1ccc(F)cc1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000397548894 1020993991 /nfs/dbraw/zinc/99/39/91/1020993991.db2.gz QMKREWHBTMIQKG-UHFFFAOYSA-N 2 0 326.459 4.136 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc3ccc(Cl)cc3n2)CC1 ZINC001167321967 1021091557 /nfs/dbraw/zinc/09/15/57/1021091557.db2.gz MRXWCJQKAPENRO-UHFFFAOYSA-N 2 0 345.918 4.440 20 0 EIADRP CC1CC[NH+](CCC[C@H]([NH2+][C@@H]2CCCOC2)c2ccc(F)cc2)CC1 ZINC000340502103 1021156273 /nfs/dbraw/zinc/15/62/73/1021156273.db2.gz WRTYVDHZJVGGSB-RTWAWAEBSA-N 2 0 348.506 4.148 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3c(O)cccc32)c1 ZINC000340519546 1021187182 /nfs/dbraw/zinc/18/71/82/1021187182.db2.gz MPXVEPCQBHKTHE-NRFANRHFSA-N 2 0 338.495 4.400 20 0 EIADRP Cc1nc(-c2ccc([C@@H](C)[NH2+]CC3CC[NH+](C)CC3)cc2)cs1 ZINC000892507292 1021205666 /nfs/dbraw/zinc/20/56/66/1021205666.db2.gz WXMBQZNOZOXGHA-CQSZACIVSA-N 2 0 329.513 4.111 20 0 EIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]C(C3CCC3)C3CCC3)cc2)CC1 ZINC000340534161 1021261912 /nfs/dbraw/zinc/26/19/12/1021261912.db2.gz YWXOJURIJSVAJC-UHFFFAOYSA-N 2 0 342.527 4.218 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](c1cccc(F)c1)C(C)(C)C ZINC000422841875 1021650017 /nfs/dbraw/zinc/65/00/17/1021650017.db2.gz XAHGTZMFMGYEHR-AUUYWEPGSA-N 2 0 329.463 4.426 20 0 EIADRP C[N@@H+](Cc1ccc2cnccc2c1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000683830922 1021749074 /nfs/dbraw/zinc/74/90/74/1021749074.db2.gz ZNVJAAIGYURHSZ-NRFANRHFSA-N 2 0 345.490 4.189 20 0 EIADRP c1cc2cc(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)ccc2cn1 ZINC000683832301 1021750953 /nfs/dbraw/zinc/75/09/53/1021750953.db2.gz CJBKRCDAQVOQDD-UHFFFAOYSA-N 2 0 337.511 4.323 20 0 EIADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1csc(-c2ccccc2)n1 ZINC000414106244 1021859971 /nfs/dbraw/zinc/85/99/71/1021859971.db2.gz IFZPMMGQCPZIHU-OAHLLOKOSA-N 2 0 329.513 4.193 20 0 EIADRP c1[nH+]cn2cc(C[NH2+][C@H]3CCCOc4cc5c(cc43)CCCC5)ccc12 ZINC000414162972 1022003255 /nfs/dbraw/zinc/00/32/55/1022003255.db2.gz FIFYHLODOMPJLO-NRFANRHFSA-N 2 0 347.462 4.217 20 0 EIADRP C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](C)CCCc1cncn1C ZINC000584537607 1022011901 /nfs/dbraw/zinc/01/19/01/1022011901.db2.gz NNNJCZVGHXJZKO-ZDUSSCGKSA-N 2 0 325.378 4.065 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCc2nc[nH]c2C1)c1cc(F)c(Cl)cc1Cl ZINC000377799697 1022012709 /nfs/dbraw/zinc/01/27/09/1022012709.db2.gz YFXZWOGTRIJNDI-DTWKUNHWSA-N 2 0 328.218 4.064 20 0 EIADRP CC[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccc(OC(F)F)cc1 ZINC000414168506 1022015001 /nfs/dbraw/zinc/01/50/01/1022015001.db2.gz AFEPZGYBROJFMW-RHSMWYFYSA-N 2 0 326.431 4.061 20 0 EIADRP COc1ccc2oc([C@@H](C)[NH2+]CC[C@H]3CCC[N@H+](C)C3)c(C)c2c1 ZINC000414169290 1022018542 /nfs/dbraw/zinc/01/85/42/1022018542.db2.gz BAVQPIYAIUVMGJ-HZPDHXFCSA-N 2 0 330.472 4.132 20 0 EIADRP COc1ccc2oc([C@H](C)[NH2+]CC[C@@H]3CCC[N@H+](C)C3)c(C)c2c1 ZINC000414169289 1022018814 /nfs/dbraw/zinc/01/88/14/1022018814.db2.gz BAVQPIYAIUVMGJ-HOTGVXAUSA-N 2 0 330.472 4.132 20 0 EIADRP COc1ccc2cc([C@H](C)[NH2+]CC[C@H]3CCC[N@H+](C)C3)ccc2c1 ZINC000414171310 1022024986 /nfs/dbraw/zinc/02/49/86/1022024986.db2.gz DFFQWXZJZKMYHY-DLBZAZTESA-N 2 0 326.484 4.231 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CC[C@H]2CCC[N@H+](C)C2)c2ccccc12 ZINC000414173961 1022032271 /nfs/dbraw/zinc/03/22/71/1022032271.db2.gz HEMSHFWOHXDMIF-IAGOWNOFSA-N 2 0 326.484 4.231 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccccc1 ZINC000414219530 1022191409 /nfs/dbraw/zinc/19/14/09/1022191409.db2.gz HQBRQJILMDJNJI-UWJYYQICSA-N 2 0 326.484 4.429 20 0 EIADRP Cc1cc(OCCC[C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)ccc1Cl ZINC000549041202 1022249565 /nfs/dbraw/zinc/24/95/65/1022249565.db2.gz FVLSDSUTFTYVOX-DLBZAZTESA-N 2 0 338.923 4.127 20 0 EIADRP CCc1onc(C)c1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000892574365 1022260321 /nfs/dbraw/zinc/26/03/21/1022260321.db2.gz ZKHCEEVNHVJEJN-INIZCTEOSA-N 2 0 341.499 4.210 20 0 EIADRP FC(F)(F)c1cccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000047971627 1022306753 /nfs/dbraw/zinc/30/67/53/1022306753.db2.gz IBOOEZWKTWIYJF-UHFFFAOYSA-N 2 0 326.406 4.013 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCc2ccc(Cl)cc2)C1 ZINC001167424317 1022314293 /nfs/dbraw/zinc/31/42/93/1022314293.db2.gz HDRVFCXYGZVGRE-MJGOQNOKSA-N 2 0 334.935 4.469 20 0 EIADRP CCc1ccc([C@@H]([NH2+]CC2(SC)CC[NH+](C)CC2)C(C)C)cc1 ZINC000564434059 1022333426 /nfs/dbraw/zinc/33/34/26/1022333426.db2.gz MGKPLKLHHVCNQS-IBGZPJMESA-N 2 0 334.573 4.363 20 0 EIADRP C[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)CC(F)(F)F ZINC000414279003 1022390128 /nfs/dbraw/zinc/39/01/28/1022390128.db2.gz IPGHZFJQVORJMU-OWLYRPNTSA-N 2 0 340.433 4.360 20 0 EIADRP FC1(F)CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)C1 ZINC000651300803 1022399654 /nfs/dbraw/zinc/39/96/54/1022399654.db2.gz GENWZPIAOBJHOG-OKYOBFRVSA-N 2 0 334.454 4.207 20 0 EIADRP C[C@H](Cc1ccc(F)cc1)[NH2+][C@H]1CCN(Cc2ccccc2)C[C@@H]1C ZINC000398165581 1022410339 /nfs/dbraw/zinc/41/03/39/1022410339.db2.gz GSYBSAHFRJSWIH-SVMVAKDDSA-N 2 0 340.486 4.257 20 0 EIADRP C[C@@H](CCc1ccco1)[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000310846190 1022645794 /nfs/dbraw/zinc/64/57/94/1022645794.db2.gz IKTMIQOSVWWJRU-PZJWPPBQSA-N 2 0 340.511 4.493 20 0 EIADRP C[C@H](CCc1ccco1)[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000310846186 1022648309 /nfs/dbraw/zinc/64/83/09/1022648309.db2.gz IKTMIQOSVWWJRU-CTNGQTDRSA-N 2 0 340.511 4.493 20 0 EIADRP COc1cccc2cc([C@H](C)[NH2+]Cc3cccc(C[NH+](C)C)c3)oc21 ZINC000181439294 1022654006 /nfs/dbraw/zinc/65/40/06/1022654006.db2.gz QHDCRTHKFHMYMN-HNNXBMFYSA-N 2 0 338.451 4.354 20 0 EIADRP COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000310891195 1022681675 /nfs/dbraw/zinc/68/16/75/1022681675.db2.gz KPYVCGHXNWWOMP-QUCCMNQESA-N 2 0 338.495 4.258 20 0 EIADRP C[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCOC1)c1ccc(-n2ccnc2)cc1 ZINC000378389939 1022784219 /nfs/dbraw/zinc/78/42/19/1022784219.db2.gz BFWWKEGMRKPNMR-RBDMOPTHSA-N 2 0 347.462 4.301 20 0 EIADRP c1sc(-c2ccccc2)nc1C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647543409 1022794819 /nfs/dbraw/zinc/79/48/19/1022794819.db2.gz MXXAHMSQWSYYQT-MSOLQXFVSA-N 2 0 341.524 4.022 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(Cl)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000382069718 1022870783 /nfs/dbraw/zinc/87/07/83/1022870783.db2.gz RWYAIVIHTITHSO-LPHOPBHVSA-N 2 0 328.887 4.340 20 0 EIADRP CC[C@@H](C)c1ccc([C@H](C)[NH2+]CCCC[NH+]2CCN(CC)CC2)cc1 ZINC000623861780 1022876601 /nfs/dbraw/zinc/87/66/01/1022876601.db2.gz CHJIOPAQVVMQSB-UXHICEINSA-N 2 0 345.575 4.268 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(Cl)nc2)c1 ZINC000181399687 1023040555 /nfs/dbraw/zinc/04/05/55/1023040555.db2.gz OKPAPOVVOXVWKK-OAHLLOKOSA-N 2 0 331.891 4.426 20 0 EIADRP C[C@@]1(C[NH2+]Cc2ccnc3ccccc23)CC[N@H+](Cc2ccccc2)C1 ZINC000382250757 1023088713 /nfs/dbraw/zinc/08/87/13/1023088713.db2.gz AKOMJIKXVJULDO-QHCPKHFHSA-N 2 0 345.490 4.237 20 0 EIADRP CCC[C@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000473307875 1033107327 /nfs/dbraw/zinc/10/73/27/1033107327.db2.gz DVVWSWSNVBESKL-XLIONFOSSA-N 2 0 345.531 4.024 20 0 EIADRP COc1ccc2ccccc2c1C[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000589836475 1023223268 /nfs/dbraw/zinc/22/32/68/1023223268.db2.gz KHPYUXUNQULSPJ-UHFFFAOYSA-N 2 0 340.511 4.450 20 0 EIADRP COc1ccc2ccccc2c1C[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000589836698 1023223290 /nfs/dbraw/zinc/22/32/90/1023223290.db2.gz QYEQHBHPIRFFLB-GOSISDBHSA-N 2 0 340.511 4.450 20 0 EIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1C[C@H]1c1cccs1 ZINC000417306298 1023254247 /nfs/dbraw/zinc/25/42/47/1023254247.db2.gz FZHGRGQPEUVKJJ-ZYSHUDEJSA-N 2 0 341.524 4.141 20 0 EIADRP Cc1c(Cl)c(C[NH+]2CCC([C@H]3CCC[NH2+]3)CC2)nc2ccccc12 ZINC000261746389 1023315700 /nfs/dbraw/zinc/31/57/00/1023315700.db2.gz UEAOVRQOPQKMSM-QGZVFWFLSA-N 2 0 343.902 4.161 20 0 EIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@H](C)CCC[NH3+] ZINC000415019690 1023393691 /nfs/dbraw/zinc/39/36/91/1023393691.db2.gz IJHVBNGHJBBQGR-GOSISDBHSA-N 2 0 348.494 4.065 20 0 EIADRP CC(C)Sc1cc(Br)ccc1C[NH2+][C@H](C)CCC[NH3+] ZINC000415024342 1023395122 /nfs/dbraw/zinc/39/51/22/1023395122.db2.gz OTQJTZBNXWDPNA-GFCCVEGCSA-N 2 0 345.350 4.167 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H](CCC[NH3+])c2ccccc2)CC1 ZINC000415052863 1023409634 /nfs/dbraw/zinc/40/96/34/1023409634.db2.gz LVQOOQNRRYKSRT-COPCDDAFSA-N 3 0 343.559 4.099 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1cccc(OC(F)(F)F)c1)c1ccccc1 ZINC000415049572 1023409845 /nfs/dbraw/zinc/40/98/45/1023409845.db2.gz HVKHTNVHOLVLRO-KRWDZBQOSA-N 2 0 338.373 4.155 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1ccc(F)c(C(F)(F)F)c1)c1ccccc1 ZINC000415051933 1023410095 /nfs/dbraw/zinc/41/00/95/1023410095.db2.gz KAMDGTOEIAUECW-KRWDZBQOSA-N 2 0 340.364 4.414 20 0 EIADRP C[N@H+](CCCc1cc(-c2ccccc2)no1)CC[C@H]1CCCC[NH+]1C ZINC000472687125 1023412477 /nfs/dbraw/zinc/41/24/77/1023412477.db2.gz YSMGVDZOYJTRKC-LJQANCHMSA-N 2 0 341.499 4.080 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H](CCC[NH3+])c3ccccc3)CC2)C1 ZINC000415061583 1023416071 /nfs/dbraw/zinc/41/60/71/1023416071.db2.gz YRSAXICYQKMCBS-QIJUGHKUSA-N 3 0 343.559 4.099 20 0 EIADRP C[C@@H](C[C@H]1CCC[NH2+]1)[NH2+]Cc1ccccc1COCc1ccccc1 ZINC000415076806 1023421957 /nfs/dbraw/zinc/42/19/57/1023421957.db2.gz GQXOJWLFUVRHGI-PGRDOPGGSA-N 2 0 338.495 4.024 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C1CCC([NH3+])CC1 ZINC000415082709 1023432598 /nfs/dbraw/zinc/43/25/98/1023432598.db2.gz OPAAKGIDWHYTTB-IGEOTXOUSA-N 2 0 329.513 4.347 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccc1Cl ZINC000656682575 1023433538 /nfs/dbraw/zinc/43/35/38/1023433538.db2.gz DKOPWYWXZPEKCS-MRXNPFEDSA-N 2 0 343.902 4.298 20 0 EIADRP Brc1ccc([C@H]([NH2+][C@H]2CCC[NH2+]CC2)C2CCC2)cc1 ZINC000415090349 1023435255 /nfs/dbraw/zinc/43/52/55/1023435255.db2.gz ZBMXOSARXIWCHD-DLBZAZTESA-N 2 0 337.305 4.022 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(Cl)s1 ZINC000656684943 1023439455 /nfs/dbraw/zinc/43/94/55/1023439455.db2.gz ZANPIYMCSDORHJ-CQSZACIVSA-N 2 0 349.931 4.359 20 0 EIADRP c1ccc2c(c1)C1C[C@@H](C[NH2+][C@@H]3CCC[NH2+]CC3)C2c2ccccc21 ZINC000415110154 1023448236 /nfs/dbraw/zinc/44/82/36/1023448236.db2.gz QDUXIUBJNUNLBT-IYXGRNATSA-N 2 0 332.491 4.015 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1)c1ccc(C(F)(F)F)cc1 ZINC000415114457 1023449064 /nfs/dbraw/zinc/44/90/64/1023449064.db2.gz XTPASHBJPWWOON-XFKAJCMBSA-N 2 0 340.433 4.319 20 0 EIADRP Cc1nn(C(C)C)c(C)c1C[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000893327166 1023462019 /nfs/dbraw/zinc/46/20/19/1023462019.db2.gz HTNHXBLVCFDMFR-UHFFFAOYSA-N 2 0 342.531 4.211 20 0 EIADRP Cc1cccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c1C ZINC000341276807 1023496230 /nfs/dbraw/zinc/49/62/30/1023496230.db2.gz RTSRSZKHKJKWGA-UHFFFAOYSA-N 2 0 338.495 4.066 20 0 EIADRP CO[C@@H]1CCC[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)C1 ZINC000684374287 1023567052 /nfs/dbraw/zinc/56/70/52/1023567052.db2.gz NLOFBTMYSMEBLK-NHCUHLMSSA-N 2 0 330.516 4.110 20 0 EIADRP CC[C@@H]([NH2+][C@H]1CC[NH2+]C(C)(C)C1)c1ccc(Br)cc1 ZINC000709357896 1023573238 /nfs/dbraw/zinc/57/32/38/1023573238.db2.gz WAINSYMLZKICNH-LSDHHAIUSA-N 2 0 325.294 4.020 20 0 EIADRP C[C@@H]1OCC[C@@H]1[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549261838 1023583813 /nfs/dbraw/zinc/58/38/13/1023583813.db2.gz PKNWWFYWKOILJI-YVBJXDOVSA-N 2 0 348.918 4.021 20 0 EIADRP C[C@@H]1CCCC[NH+]1Cc1ccc(NCCC[N@H+]2CCCC[C@@H]2C)nc1 ZINC001167750759 1023617296 /nfs/dbraw/zinc/61/72/96/1023617296.db2.gz BHEUNUPTUGBTLM-RBUKOAKNSA-N 2 0 344.547 4.132 20 0 EIADRP c1cncc([C@@H]2CCC[C@H]([NH2+]C[C@@H]3CCC[N@@H+]3C3CCCCC3)C2)c1 ZINC000500377306 1023766089 /nfs/dbraw/zinc/76/60/89/1023766089.db2.gz NZERMFBRINYJGQ-CBQOVEMMSA-N 2 0 341.543 4.495 20 0 EIADRP CC[N@@H+]1CCC[C@@H](C[NH2+]C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000500420899 1023814784 /nfs/dbraw/zinc/81/47/84/1023814784.db2.gz LYNUFAJNEXCBOS-QZFKAFNDSA-N 2 0 340.433 4.430 20 0 EIADRP CC[C@@H](CC(F)F)C[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(C)s2)C1 ZINC000660496238 1023869024 /nfs/dbraw/zinc/86/90/24/1023869024.db2.gz FSTHSQXEIAAZCJ-JKSUJKDBSA-N 2 0 344.515 4.492 20 0 EIADRP CC[C@@H]1CC[C@H](C)C[C@@H]1[NH2+]CCc1nccn1Cc1ccccc1 ZINC000430696966 1023901065 /nfs/dbraw/zinc/90/10/65/1023901065.db2.gz KQCSGIXHEKMVNN-SXLOBPIMSA-N 2 0 325.500 4.278 20 0 EIADRP CC(C)c1ccc(-c2nc(C[NH+]3CCC([C@H](C)[NH3+])CC3)cs2)cc1 ZINC000430965796 1024305325 /nfs/dbraw/zinc/30/53/25/1024305325.db2.gz MHQZPPUULBTLGH-HNNXBMFYSA-N 2 0 343.540 4.493 20 0 EIADRP C[C@H](c1cccc2ccccc21)[N@@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1 ZINC000652347472 1024699940 /nfs/dbraw/zinc/69/99/40/1024699940.db2.gz BLQMXDKCZYWXMM-ITBLURSFSA-N 2 0 338.495 4.119 20 0 EIADRP Cc1ccc(C[C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000548483354 1024829829 /nfs/dbraw/zinc/82/98/29/1024829829.db2.gz NPJZKVMHVJGIBO-QRFRQXIXSA-N 2 0 342.552 4.488 20 0 EIADRP CCC[C@@H]([NH2+][C@H](Cn1ccnc1)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000326661144 1024999993 /nfs/dbraw/zinc/99/99/93/1024999993.db2.gz JBASGJMEORUEGF-QZTJIDSGSA-N 2 0 344.459 4.337 20 0 EIADRP Cc1nccn1CCC[NH2+][C@H](CCc1ccccc1)Cc1ccccc1 ZINC000510990857 1025025139 /nfs/dbraw/zinc/02/51/39/1025025139.db2.gz FNPWIYQCKLCMMQ-HSZRJFAPSA-N 2 0 347.506 4.415 20 0 EIADRP Cc1oc(-c2cccs2)nc1C[N@H+]1CCC[C@@H](C)[C@H]1CCC[NH3+] ZINC000662315184 1025068684 /nfs/dbraw/zinc/06/86/84/1025068684.db2.gz RVFWFGMYWRZEFU-CZUORRHYSA-N 2 0 333.501 4.051 20 0 EIADRP CC[NH+](CC)CCOC1CC[NH+]([C@@H](C)c2cccc(Cl)c2)CC1 ZINC000342105001 1025259248 /nfs/dbraw/zinc/25/92/48/1025259248.db2.gz XZYSKNFIVMDDGL-INIZCTEOSA-N 2 0 338.923 4.224 20 0 EIADRP CC(C)[NH2+]C1CCN(c2cc[nH+]c3cc(C(F)(F)F)ccc32)CC1 ZINC000124519015 1025379191 /nfs/dbraw/zinc/37/91/91/1025379191.db2.gz WTBRZTGFMXOYDI-UHFFFAOYSA-N 2 0 337.389 4.220 20 0 EIADRP COCCC[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1ccc(F)cc1 ZINC000663465254 1025389763 /nfs/dbraw/zinc/38/97/63/1025389763.db2.gz IUTILJYPQAACOD-WIYYLYMNSA-N 2 0 348.506 4.005 20 0 EIADRP c1ccc2c(c1)[nH]c1c2CCC[C@H]1[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663466121 1025392707 /nfs/dbraw/zinc/39/27/07/1025392707.db2.gz OGPKONRAAXYPMH-LAUBAEHRSA-N 2 0 337.511 4.257 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cc1Cl ZINC000663467360 1025397897 /nfs/dbraw/zinc/39/78/97/1025397897.db2.gz DZNBDXODMCLFLT-ZBFHGGJFSA-N 2 0 336.907 4.121 20 0 EIADRP CSc1ccccc1C[C@H](C)[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663467333 1025398448 /nfs/dbraw/zinc/39/84/48/1025398448.db2.gz DWCAFYHQDXYNPX-FUHWJXTLSA-N 2 0 332.557 4.051 20 0 EIADRP CC(C)CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2)cc1 ZINC000563154207 1025439159 /nfs/dbraw/zinc/43/91/59/1025439159.db2.gz SEJKHVMGSHMSJD-QGZVFWFLSA-N 2 0 326.484 4.421 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccccc2F)CC1 ZINC000303204497 1025476577 /nfs/dbraw/zinc/47/65/77/1025476577.db2.gz PBZBXCMYFIKOHV-UHFFFAOYSA-N 2 0 326.459 4.170 20 0 EIADRP C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)o1 ZINC000066973465 1025626157 /nfs/dbraw/zinc/62/61/57/1025626157.db2.gz YNZCPCWBIXTZNS-UZLBHIALSA-N 2 0 342.483 4.023 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@@H](Oc2ccccc2OC)C1 ZINC001167827185 1025633988 /nfs/dbraw/zinc/63/39/88/1025633988.db2.gz UMYFNHCHSMEUCU-RBUKOAKNSA-N 2 0 348.531 4.049 20 0 EIADRP C[N@H+](CCCOc1cccc2ccccc21)CC[C@@H]1CCCC[NH+]1C ZINC001167508276 1025746635 /nfs/dbraw/zinc/74/66/35/1025746635.db2.gz FRTSUYTVKFESNC-FQEVSTJZSA-N 2 0 340.511 4.415 20 0 EIADRP CCCOc1ccc(C[NH2+]Cc2cccc(C[NH+](C)C)c2)c(C)c1 ZINC000657300582 1025819945 /nfs/dbraw/zinc/81/99/45/1025819945.db2.gz PZVFGINJZVQOTB-UHFFFAOYSA-N 2 0 326.484 4.135 20 0 EIADRP Clc1ccc2c(c1)CC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167966700 1025836548 /nfs/dbraw/zinc/83/65/48/1025836548.db2.gz ZYOPGBDRJNYJLV-AQDPXUSMSA-N 2 0 330.903 4.322 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@@H]1c1ccc(C(=O)OC)cc1 ZINC001167836398 1025846760 /nfs/dbraw/zinc/84/67/60/1025846760.db2.gz ZHBCKCYUTFODNU-YLJYHZDGSA-N 2 0 346.515 4.121 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(Sc2ccncc2)CC1 ZINC001167838109 1025850803 /nfs/dbraw/zinc/85/08/03/1025850803.db2.gz QGOGTUDXXMGQBQ-QGZVFWFLSA-N 2 0 335.561 4.149 20 0 EIADRP Cc1cc([C@H](C)[NH2+]CCCC[N@H+](C)C2CC2)sc1Br ZINC000453393799 1025873773 /nfs/dbraw/zinc/87/37/73/1025873773.db2.gz GKTRQBAVQALMPH-LBPRGKRZSA-N 2 0 345.350 4.344 20 0 EIADRP CC(C)[C@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000432412233 1025883937 /nfs/dbraw/zinc/88/39/37/1025883937.db2.gz FSAQSRXSGVXEEL-LPHOPBHVSA-N 2 0 338.923 4.128 20 0 EIADRP CCC[C@H]([NH2+][C@@H]1CC[N@H+](CCCOCC)C[C@@H]1C)c1ccsc1 ZINC000187722501 1025887161 /nfs/dbraw/zinc/88/71/61/1025887161.db2.gz LOPPMPMVMMUCGZ-UHOSZYNNSA-N 2 0 338.561 4.316 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2cc3ccncc3s2)C1 ZINC000657313476 1025976120 /nfs/dbraw/zinc/97/61/20/1025976120.db2.gz SEXQQMPDWLDHMV-HZPDHXFCSA-N 2 0 331.529 4.144 20 0 EIADRP CC[N@H+](Cc1c(C)nn(C(C)C)c1C)Cc1ccc(C[NH+](C)C)cc1 ZINC000894455737 1025991942 /nfs/dbraw/zinc/99/19/42/1025991942.db2.gz JFCUYRLYJIYLQG-UHFFFAOYSA-N 2 0 342.531 4.165 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1csc2ccccc12 ZINC000344133578 1026048859 /nfs/dbraw/zinc/04/88/59/1026048859.db2.gz QHAXECYCNCBNEJ-UHFFFAOYSA-N 2 0 334.448 4.080 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H](c2ccccc2)c2ccc(F)cc2)CC1 ZINC000324684480 1026069614 /nfs/dbraw/zinc/06/96/14/1026069614.db2.gz KOKGGOQWNXHBRC-OAQYLSRUSA-N 2 0 326.459 4.237 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCCOc3c(C)cc(Cl)cc32)C1 ZINC000431347651 1026083616 /nfs/dbraw/zinc/08/36/16/1026083616.db2.gz GGIVQORIIKOZFS-YJBOKZPZSA-N 2 0 336.907 4.184 20 0 EIADRP CCc1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)nc1 ZINC000550121667 1026177809 /nfs/dbraw/zinc/17/78/09/1026177809.db2.gz AANRQQLCOSXXHG-UHFFFAOYSA-N 2 0 349.522 4.132 20 0 EIADRP [NH3+]C[C@H]1CC[C@H](C[NH2+]Cc2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000582110008 1026195434 /nfs/dbraw/zinc/19/54/34/1026195434.db2.gz RWSIGBPTJQIBIC-HDJSIYSDSA-N 2 0 349.931 4.318 20 0 EIADRP CCN(CC)[C@@H](C[NH2+]Cc1ccnc2ccccc12)c1ccccc1 ZINC000327564061 1026205061 /nfs/dbraw/zinc/20/50/61/1026205061.db2.gz UZESBDJPKOZYBK-QFIPXVFZSA-N 2 0 333.479 4.408 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1 ZINC000582122904 1026208758 /nfs/dbraw/zinc/20/87/58/1026208758.db2.gz OAVLPNBFANOILI-GOSISDBHSA-N 2 0 334.385 4.405 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1)C1CC[NH+](C)CC1 ZINC000684773694 1026246642 /nfs/dbraw/zinc/24/66/42/1026246642.db2.gz CRTUOFKUVGVXJA-MZMPZRCHSA-N 2 0 340.433 4.271 20 0 EIADRP c1cc2cc(C[NH2+]Cc3ccc(C[NH+]4CCCCC4)cc3)ccc2[nH]1 ZINC000582191747 1026317356 /nfs/dbraw/zinc/31/73/56/1026317356.db2.gz KHLCTGIISYOCTO-UHFFFAOYSA-N 2 0 333.479 4.444 20 0 EIADRP CC(C)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)Cc1cccc(F)c1 ZINC001167978564 1026345503 /nfs/dbraw/zinc/34/55/03/1026345503.db2.gz PDGFRZQVLMGNNO-SEJPIABJSA-N 2 0 344.518 4.389 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(C)nc3ccccc23)CC1 ZINC000506858816 1026428053 /nfs/dbraw/zinc/42/80/53/1026428053.db2.gz CCYNYVLDZHEHLI-UHFFFAOYSA-N 2 0 339.527 4.487 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)cc1F ZINC000337265670 1026450835 /nfs/dbraw/zinc/45/08/35/1026450835.db2.gz ULCOMCYCBHQPDA-YLJYHZDGSA-N 2 0 341.474 4.098 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cccc(-c3ccccn3)c2)CC1 ZINC000506877920 1026482104 /nfs/dbraw/zinc/48/21/04/1026482104.db2.gz XADKAJYYBIAJJJ-UHFFFAOYSA-N 2 0 337.511 4.302 20 0 EIADRP FC(F)(F)c1cccc([C@H]2CCC[N@H+](CCCn3ccnc3)C2)c1 ZINC000511105792 1026512299 /nfs/dbraw/zinc/51/22/99/1026512299.db2.gz KFKPLTIUCAMGEE-INIZCTEOSA-N 2 0 337.389 4.172 20 0 EIADRP C[C@@H]1CCC[C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000344727615 1026563747 /nfs/dbraw/zinc/56/37/47/1026563747.db2.gz TXNPLRQIFYMZTI-CTNGQTDRSA-N 2 0 344.543 4.226 20 0 EIADRP C[C@@H]([NH2+]Cc1cc2ccncc2s1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000657430594 1026645011 /nfs/dbraw/zinc/64/50/11/1026645011.db2.gz RSQZTABUPRTFDR-ZBFHGGJFSA-N 2 0 329.513 4.039 20 0 EIADRP COCc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(-n3ccnc3)cs2)o1 ZINC000344898919 1026700358 /nfs/dbraw/zinc/70/03/58/1026700358.db2.gz VPUWFVKTQFFFOT-KRWDZBQOSA-N 2 0 343.452 4.010 20 0 EIADRP Cc1ccccc1C[N@H+](Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000432673081 1026711219 /nfs/dbraw/zinc/71/12/19/1026711219.db2.gz VRSVDMOTHNCYRX-LJQANCHMSA-N 2 0 326.509 4.201 20 0 EIADRP c1cc(C[NH2+][C@@H]2CCC[C@H](c3ccccc3)C2)n(-c2cc[nH+]cc2)n1 ZINC000657448442 1026742390 /nfs/dbraw/zinc/74/23/90/1026742390.db2.gz ZIYBFXYUBXVLHR-RBUKOAKNSA-N 2 0 332.451 4.083 20 0 EIADRP Cc1cccc2[nH]c(C[NH2+]C[C@H]3CC[N@H+](Cc4ccccc4)C3)cc21 ZINC000657452429 1026760478 /nfs/dbraw/zinc/76/04/78/1026760478.db2.gz FJARTXOLDIOFFB-LJQANCHMSA-N 2 0 333.479 4.088 20 0 EIADRP COc1cccc([C@@H](CNc2cc[nH+]c3cc(F)ccc23)[NH+](C)C)c1 ZINC000500474300 1026777915 /nfs/dbraw/zinc/77/79/15/1026777915.db2.gz SFPKNXUPBJIGBF-HXUWFJFHSA-N 2 0 339.414 4.097 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2cccc(Br)c2)CC1 ZINC000467872919 1026787445 /nfs/dbraw/zinc/78/74/45/1026787445.db2.gz FRLMMJQBEMCMOF-AWEZNQCLSA-N 2 0 339.321 4.222 20 0 EIADRP COc1ccc2oc([C@H](C)[NH2+]CC3(C)CC[NH+](C)CC3)c(C)c2c1 ZINC000507444022 1026795553 /nfs/dbraw/zinc/79/55/53/1026795553.db2.gz SNPFVKJJBJFPKU-HNNXBMFYSA-N 2 0 330.472 4.132 20 0 EIADRP COc1ccc2oc([C@@H](C)[NH2+]CC3(C)CC[NH+](C)CC3)c(C)c2c1 ZINC000507444028 1026795608 /nfs/dbraw/zinc/79/56/08/1026795608.db2.gz SNPFVKJJBJFPKU-OAHLLOKOSA-N 2 0 330.472 4.132 20 0 EIADRP CCc1cccnc1[C@H](C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000507511098 1026821465 /nfs/dbraw/zinc/82/14/65/1026821465.db2.gz NRTCBSYXNIAIMR-INIZCTEOSA-N 2 0 343.540 4.268 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)[C@H]1CCCOC1 ZINC000507511131 1026822672 /nfs/dbraw/zinc/82/26/72/1026822672.db2.gz NXBRGJSJWCKNGF-NQIIRXRSSA-N 2 0 344.543 4.356 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(Br)ccc2C)C[C@H]1C ZINC001167586226 1026827627 /nfs/dbraw/zinc/82/76/27/1026827627.db2.gz JEHPJOCQVQDRPH-PBHICJAKSA-N 2 0 339.321 4.062 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(Br)ccc2C)C[C@@H]1C ZINC001167586228 1026827705 /nfs/dbraw/zinc/82/77/05/1026827705.db2.gz JEHPJOCQVQDRPH-WMLDXEAASA-N 2 0 339.321 4.062 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(Br)ccc2C)C[C@@H]1C ZINC001167586230 1026828358 /nfs/dbraw/zinc/82/83/58/1026828358.db2.gz JEHPJOCQVQDRPH-YOEHRIQHSA-N 2 0 339.321 4.062 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1nc2ccccc2n1C ZINC000091368215 1026905996 /nfs/dbraw/zinc/90/59/96/1026905996.db2.gz NYCQJMQNMIRROT-WWDZGPRUSA-N 2 0 340.515 4.021 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000474477196 1027109642 /nfs/dbraw/zinc/10/96/42/1027109642.db2.gz RCBBSSSKCCLRQH-GUDVDZBRSA-N 2 0 332.532 4.431 20 0 EIADRP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000474477232 1027110633 /nfs/dbraw/zinc/11/06/33/1027110633.db2.gz RGPKSSGINSTXSZ-QLFBSQMISA-N 2 0 326.937 4.359 20 0 EIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000474481252 1027116959 /nfs/dbraw/zinc/11/69/59/1027116959.db2.gz VZASRZINIPMTEZ-OALUTQOASA-N 2 0 332.532 4.289 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCOC(C)(C)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168036123 1027144787 /nfs/dbraw/zinc/14/47/87/1027144787.db2.gz UBGWQLGWIYNOKQ-KOUHRCEDSA-N 2 0 344.543 4.223 20 0 EIADRP COc1ccc([C@@H](CNc2cc[nH+]c(C)c2)[NH+]2CCCCC2)cc1 ZINC000302213342 1027265140 /nfs/dbraw/zinc/26/51/40/1027265140.db2.gz FMLCNCMDYUMFQA-HXUWFJFHSA-N 2 0 325.456 4.038 20 0 EIADRP C[C@@H]1CC([NH2+]CCCOC(C)(C)C)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168037720 1027269817 /nfs/dbraw/zinc/26/98/17/1027269817.db2.gz ZUQOWVGLFCCXOS-QZTJIDSGSA-N 2 0 332.532 4.223 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H]2CCCSc3ccc(OC)cc32)CC1 ZINC000582764883 1027284814 /nfs/dbraw/zinc/28/48/14/1027284814.db2.gz LYYDCSGDGPRDHI-LJQANCHMSA-N 2 0 348.556 4.334 20 0 EIADRP CC(C)[C@@H]1CCC[C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C1 ZINC000657613479 1027289046 /nfs/dbraw/zinc/28/90/46/1027289046.db2.gz KZVIHCPSZJLCAF-NHCUHLMSSA-N 2 0 329.532 4.098 20 0 EIADRP CC(C)c1ccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000657613294 1027290154 /nfs/dbraw/zinc/29/01/54/1027290154.db2.gz XGXZYNVSVLYUAX-UHFFFAOYSA-N 2 0 337.511 4.207 20 0 EIADRP CC[C@H](C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccc1 ZINC000657613235 1027290273 /nfs/dbraw/zinc/29/02/73/1027290273.db2.gz JKDZIKBDWFVJCZ-OAQYLSRUSA-N 2 0 337.511 4.077 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]CC1=Cc2ccccc2OC1 ZINC000102422251 1027441223 /nfs/dbraw/zinc/44/12/23/1027441223.db2.gz BVPRQFIBQGASLA-UHFFFAOYSA-N 2 0 336.479 4.092 20 0 EIADRP C[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)C1CCCC1 ZINC000474809254 1027516063 /nfs/dbraw/zinc/51/60/63/1027516063.db2.gz MMWCEALAXGBHKZ-LJQANCHMSA-N 2 0 344.543 4.226 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CCCCc2cccc(C(F)(F)F)c2)CC[N@@H+]1C ZINC000474818037 1027542025 /nfs/dbraw/zinc/54/20/25/1027542025.db2.gz RJOIYUWTFAWKDB-YOEHRIQHSA-N 2 0 328.422 4.100 20 0 EIADRP c1ccc(CC[C@@H]2CCC[C@H]2[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000475548677 1027582064 /nfs/dbraw/zinc/58/20/64/1027582064.db2.gz NHTDLEWMVKHETP-ZGJBTBESSA-N 2 0 326.528 4.394 20 0 EIADRP CC(C)OC1CCC([NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)CC1 ZINC000090771724 1027591905 /nfs/dbraw/zinc/59/19/05/1027591905.db2.gz UNLLUJATOTVFOP-KKXNLOMOSA-N 2 0 348.531 4.014 20 0 EIADRP C[C@@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000154107153 1027719855 /nfs/dbraw/zinc/71/98/55/1027719855.db2.gz JRGNRMXETCOHGW-ZIAGYGMSSA-N 2 0 344.421 4.009 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1)C1CC[NH+](C)CC1 ZINC000154107047 1027729327 /nfs/dbraw/zinc/72/93/27/1027729327.db2.gz JRGNRMXETCOHGW-UONOGXRCSA-N 2 0 344.421 4.009 20 0 EIADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000582952354 1027754165 /nfs/dbraw/zinc/75/41/65/1027754165.db2.gz WFOMHDCJYMNBRT-DOMZBBRYSA-N 2 0 335.904 4.071 20 0 EIADRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000582952357 1027754863 /nfs/dbraw/zinc/75/48/63/1027754863.db2.gz WFOMHDCJYMNBRT-WFASDCNBSA-N 2 0 335.904 4.071 20 0 EIADRP COc1ccccc1[C@@H]1CCC[N@@H+]1C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995604 1027786775 /nfs/dbraw/zinc/78/67/75/1027786775.db2.gz KONNVLVUFMAMAI-VHRCFOOQSA-N 2 0 340.511 4.238 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CC[C@@H](C)[NH+]2CCCCC2)cc1OC ZINC000474941547 1027810540 /nfs/dbraw/zinc/81/05/40/1027810540.db2.gz JLHHRLRTIZVMQR-KURKYZTESA-N 2 0 348.531 4.050 20 0 EIADRP c1ccc(C[NH+]2CCC[C@@H]3C[N@H+](CCCc4cccnc4)CC[C@@H]32)cc1 ZINC001167646334 1027828477 /nfs/dbraw/zinc/82/84/77/1027828477.db2.gz AUFPPRKHFPYAQU-PKTZIBPZSA-N 2 0 349.522 4.001 20 0 EIADRP COc1ccc([C@@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)cc1Cl ZINC000522546631 1028008236 /nfs/dbraw/zinc/00/82/36/1028008236.db2.gz XDWMPKPMAMJBFI-DYVFJYSZSA-N 2 0 326.912 4.366 20 0 EIADRP Cc1ccc2cc(C[NH2+]CCCC[N@H+]3CCC[C@H](C)C3)ccc2n1 ZINC000189256289 1028111631 /nfs/dbraw/zinc/11/16/31/1028111631.db2.gz WOFLPISZFPWNLP-KRWDZBQOSA-N 2 0 325.500 4.145 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](C1CC1)[C@H]1CCc2ccccc21 ZINC000346174948 1028304366 /nfs/dbraw/zinc/30/43/66/1028304366.db2.gz NDGDSKISBYBQGQ-QFIPXVFZSA-N 2 0 344.462 4.228 20 0 EIADRP Cc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)C[C@H]3CCC(F)(F)C3)C2)s1 ZINC000583325119 1028519699 /nfs/dbraw/zinc/51/96/99/1028519699.db2.gz APPVRYBLUIIIQQ-HOTGVXAUSA-N 2 0 342.499 4.246 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2coc(-c3cccc(F)c3)n2)CC1 ZINC000524156214 1028723747 /nfs/dbraw/zinc/72/37/47/1028723747.db2.gz VBQJLPBENJPDKZ-UHFFFAOYSA-N 2 0 345.462 4.033 20 0 EIADRP C(=C/C[N@@H+]1CCC[C@@H]1c1cccnc1)\C[NH+]1CCC[C@@H]1c1cccnc1 ZINC000346978598 1028831805 /nfs/dbraw/zinc/83/18/05/1028831805.db2.gz UEZABGVONGZQNQ-HSMZSTHASA-N 2 0 348.494 4.007 20 0 EIADRP Cc1cc([C@@H](C)Nc2ccc(N3CC[C@H]([NH+](C)C)C3)cn2)c(C)s1 ZINC000346975223 1028835202 /nfs/dbraw/zinc/83/52/02/1028835202.db2.gz VOYIGIIHAWTFJO-PBHICJAKSA-N 2 0 344.528 4.073 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1cc(Cl)cc(Cl)c1OC ZINC000650718479 1028878463 /nfs/dbraw/zinc/87/84/63/1028878463.db2.gz OKWRCYRFQXXOJR-UHFFFAOYSA-N 2 0 339.266 4.011 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1nccc2ccccc21 ZINC000583686089 1029039592 /nfs/dbraw/zinc/03/95/92/1029039592.db2.gz MLCNGRUKQIIWEU-SFHVURJKSA-N 2 0 325.500 4.398 20 0 EIADRP Cc1nc(C(C)C)oc1CN[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000428430027 1029126311 /nfs/dbraw/zinc/12/63/11/1029126311.db2.gz GUEYEGXSAWATCT-LPHOPBHVSA-N 2 0 341.499 4.107 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cccc(-c2ccncc2)c1 ZINC000278406739 1029131890 /nfs/dbraw/zinc/13/18/90/1029131890.db2.gz HGXHHTZEGILWAJ-KRWDZBQOSA-N 2 0 335.495 4.274 20 0 EIADRP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650754850 1029179146 /nfs/dbraw/zinc/17/91/46/1029179146.db2.gz SVXGOKRZCPJFQC-SFHVURJKSA-N 2 0 348.849 4.250 20 0 EIADRP C[NH2+]Cc1ccc(N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001168055389 1029198886 /nfs/dbraw/zinc/19/88/86/1029198886.db2.gz VOZZBDGHKIJRMF-OPMZPASUSA-N 2 0 337.511 4.260 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1ccc(Br)cc1 ZINC000650760141 1029235046 /nfs/dbraw/zinc/23/50/46/1029235046.db2.gz XKNKQAJMZIUKAA-CYBMUJFWSA-N 2 0 333.273 4.019 20 0 EIADRP C[C@@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CCC1CC[NH2+]CC1 ZINC000650764342 1029279263 /nfs/dbraw/zinc/27/92/63/1029279263.db2.gz WLQKPKXCUXGRFR-AWEZNQCLSA-N 2 0 328.422 4.006 20 0 EIADRP C[C@@H](c1ccco1)[N@H+](C)Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC000131095826 1029279541 /nfs/dbraw/zinc/27/95/41/1029279541.db2.gz CKFGYVCFIARRFR-KRWDZBQOSA-N 2 0 341.499 4.003 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(-n2ccnc2)cc1 ZINC000157936114 1029287582 /nfs/dbraw/zinc/28/75/82/1029287582.db2.gz WIKYXDQVCGRQDY-OALUTQOASA-N 3 0 340.515 4.035 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]C2CCC(OC)CC2)ccc1OC ZINC000840793212 1029342816 /nfs/dbraw/zinc/34/28/16/1029342816.db2.gz QOYDNONKRIBIAX-PBPGXSGUSA-N 2 0 348.531 4.145 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CCCc3occc32)cc1 ZINC000192682796 1029362605 /nfs/dbraw/zinc/36/26/05/1029362605.db2.gz UEBSSHDGUJJDTJ-FQEVSTJZSA-N 2 0 342.483 4.167 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@@]3(CC3(F)F)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168058837 1029375813 /nfs/dbraw/zinc/37/58/13/1029375813.db2.gz CPEDYAHEHKEJCY-UKBAYJJMSA-N 2 0 334.454 4.159 20 0 EIADRP c1csc(-c2ncc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)s2)c1 ZINC000657813606 1029456128 /nfs/dbraw/zinc/45/61/28/1029456128.db2.gz UDLFHNBKMBMTTN-UHFFFAOYSA-N 2 0 347.553 4.083 20 0 EIADRP C[C@@H](CCc1ccsc1)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475265286 1029474598 /nfs/dbraw/zinc/47/45/98/1029474598.db2.gz IAKYENKSBAKLTK-PXNSSMCTSA-N 2 0 328.525 4.181 20 0 EIADRP COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cccc(Cn2ccnc2)c1 ZINC000151329750 1029482800 /nfs/dbraw/zinc/48/28/00/1029482800.db2.gz AWDQZKLPCINCIG-QGZVFWFLSA-N 2 0 335.451 4.099 20 0 EIADRP C[C@H](CCc1ccccc1F)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475279235 1029487113 /nfs/dbraw/zinc/48/71/13/1029487113.db2.gz XQWNNSPMYHPYEI-UYAOXDASSA-N 2 0 340.486 4.259 20 0 EIADRP Cc1cc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc2cccnc12 ZINC000475282812 1029496656 /nfs/dbraw/zinc/49/66/56/1029496656.db2.gz HCVUGGKCSCYXAX-FQEVSTJZSA-N 2 0 345.490 4.155 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@H](C(F)(F)F)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168061389 1029540844 /nfs/dbraw/zinc/54/08/44/1029540844.db2.gz IFESMEYCIUAQKE-MVJTYMMSSA-N 2 0 340.433 4.312 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(OC(F)(F)F)cc1 ZINC000623348125 1029545906 /nfs/dbraw/zinc/54/59/06/1029545906.db2.gz SIAIYKUISMMJOZ-TZMCWYRMSA-N 2 0 330.394 4.109 20 0 EIADRP C[NH+](C)C[C@@H]1CCN(Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000446766407 1029565493 /nfs/dbraw/zinc/56/54/93/1029565493.db2.gz HVRKHPVEAOKCTN-KRWDZBQOSA-N 2 0 328.431 4.002 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cccc(F)c1 ZINC000446820826 1029588801 /nfs/dbraw/zinc/58/88/01/1029588801.db2.gz HXDFEBDSORWXBN-OAQYLSRUSA-N 2 0 344.474 4.397 20 0 EIADRP Cc1ccc([C@H]([NH2+]CCCC[N@@H+]2CCC[C@H]2CO)C2CCCC2)cc1 ZINC000446820465 1029588887 /nfs/dbraw/zinc/58/88/87/1029588887.db2.gz CWETZLZQBMBPDW-FCHUYYIVSA-N 2 0 344.543 4.053 20 0 EIADRP CC1CC[NH+](Cc2ccc(C[NH2+]C3CC(CF)(CF)C3)cc2)CC1 ZINC000657827579 1029607021 /nfs/dbraw/zinc/60/70/21/1029607021.db2.gz NPEIKEDFROGYLJ-UHFFFAOYSA-N 2 0 336.470 4.096 20 0 EIADRP C[C@@H]1CC([N@H+](C)CC2CC(F)(F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168063902 1029617481 /nfs/dbraw/zinc/61/74/81/1029617481.db2.gz NUYPBONUNMUUME-HZPDHXFCSA-N 2 0 336.470 4.405 20 0 EIADRP Fc1cccc(-c2ccc(C[NH2+]CC3CC[NH+](C4CC4)CC3)o2)c1F ZINC000446884947 1029630321 /nfs/dbraw/zinc/63/03/21/1029630321.db2.gz SDWXVLGEDXTVLY-UHFFFAOYSA-N 2 0 346.421 4.189 20 0 EIADRP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000657834017 1029668119 /nfs/dbraw/zinc/66/81/19/1029668119.db2.gz IDFGTPBPGJVEKP-NVXWUHKLSA-N 2 0 340.433 4.100 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C2CC(CF)(CF)C2)cc1 ZINC000657836355 1029684385 /nfs/dbraw/zinc/68/43/85/1029684385.db2.gz KOTZOCDZRNHMSB-MRXNPFEDSA-N 2 0 336.470 4.238 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C3CC(CF)(CF)C3)cc2)C1 ZINC000657836812 1029695488 /nfs/dbraw/zinc/69/54/88/1029695488.db2.gz OVRLTQCEVRJHOS-MRXNPFEDSA-N 2 0 336.470 4.096 20 0 EIADRP Fc1cccc(F)c1-c1ccc(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)o1 ZINC000092072187 1029898838 /nfs/dbraw/zinc/89/88/38/1029898838.db2.gz BMAQODBBWQSPEN-CYBMUJFWSA-N 2 0 343.377 4.328 20 0 EIADRP c1cc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc(-c2ccncc2)c1 ZINC000092066687 1029899720 /nfs/dbraw/zinc/89/97/20/1029899720.db2.gz YOXZFEVMKODDEY-FYYLOGMGSA-N 2 0 347.506 4.197 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1ccc(F)cn1 ZINC000092721143 1029933249 /nfs/dbraw/zinc/93/32/49/1029933249.db2.gz UHKFBXZKFLEUAW-KRWDZBQOSA-N 2 0 341.474 4.303 20 0 EIADRP C[C@@H](Cc1ccc(Cl)cc1)[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC001168155797 1029997585 /nfs/dbraw/zinc/99/75/85/1029997585.db2.gz HCOYOLSEKDFDAW-INIZCTEOSA-N 2 0 346.902 4.001 20 0 EIADRP C[C@@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc(-n2ccnc2)cc1 ZINC000392266005 1030078083 /nfs/dbraw/zinc/07/80/83/1030078083.db2.gz OGZVTOQPYLRTEK-GOSISDBHSA-N 2 0 340.515 4.178 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000447569050 1030154070 /nfs/dbraw/zinc/15/40/70/1030154070.db2.gz NNGVQUURUMYXEW-ZDUSSCGKSA-N 2 0 326.406 4.230 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(Cl)ccc1OC ZINC000447559106 1030166844 /nfs/dbraw/zinc/16/68/44/1030166844.db2.gz RQSQZFBIEKUFQI-GOSISDBHSA-N 2 0 336.907 4.264 20 0 EIADRP Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CCCO2 ZINC000447575848 1030202563 /nfs/dbraw/zinc/20/25/63/1030202563.db2.gz ZPGLWJUSGMWRAD-IBGZPJMESA-N 2 0 348.918 4.326 20 0 EIADRP FC1(F)CCC[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000447578776 1030206053 /nfs/dbraw/zinc/20/60/53/1030206053.db2.gz HHPZPIHSPBNQDP-CADBVGFASA-N 2 0 334.454 4.350 20 0 EIADRP C[C@@H](CC(F)(F)F)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447601978 1030219689 /nfs/dbraw/zinc/21/96/89/1030219689.db2.gz RBPKUHFFCRJILV-QSPRXWTASA-N 2 0 326.406 4.113 20 0 EIADRP C[N@@H+](Cc1ccc2occc2c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000685417750 1030294391 /nfs/dbraw/zinc/29/43/91/1030294391.db2.gz TTZRKMDFQSYANT-HXUWFJFHSA-N 2 0 334.463 4.387 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2ncc(C(C)(C)C)s2)CC1 ZINC000447944346 1030431449 /nfs/dbraw/zinc/43/14/49/1030431449.db2.gz RERLSESKSFQZBW-UHFFFAOYSA-N 2 0 337.577 4.288 20 0 EIADRP COC1CCC(C)(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000530522686 1030496681 /nfs/dbraw/zinc/49/66/81/1030496681.db2.gz QCRUQZHTKDGISV-UBHSMVFVSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@@H](C[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(F)cc1 ZINC000527111371 1030501103 /nfs/dbraw/zinc/50/11/03/1030501103.db2.gz UAGPOEQRTIZNDO-AZUAARDMSA-N 2 0 340.486 4.083 20 0 EIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3ccc(F)c(F)c3)CC2)C1 ZINC000527291163 1030614665 /nfs/dbraw/zinc/61/46/65/1030614665.db2.gz RAZJNCDDQSBPLZ-MAUKXSAKSA-N 2 0 336.470 4.140 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3ccc(F)c(F)c3)CC2)C1 ZINC000527291162 1030616517 /nfs/dbraw/zinc/61/65/17/1030616517.db2.gz RAZJNCDDQSBPLZ-CRAIPNDOSA-N 2 0 336.470 4.140 20 0 EIADRP CCC[NH+]1CCC([N@H+](C)CCOc2ccc3ccccc3c2)CC1 ZINC000530666153 1030623761 /nfs/dbraw/zinc/62/37/61/1030623761.db2.gz YKXNANMZZDNFHR-UHFFFAOYSA-N 2 0 326.484 4.025 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+][C@H]2CCCSCC2)C[N@@H+]1Cc1ccccc1 ZINC000657934216 1030633062 /nfs/dbraw/zinc/63/30/62/1030633062.db2.gz ZZRLTWMYIHHYPQ-RLLQIKCJSA-N 2 0 332.557 4.162 20 0 EIADRP C[C@H]([NH2+]CCCCOc1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000527354935 1030662694 /nfs/dbraw/zinc/66/26/94/1030662694.db2.gz OAFPUEYSCGKFCQ-OALUTQOASA-N 2 0 330.516 4.088 20 0 EIADRP c1cn(-c2ccc(C[N@@H+]3CCCCC[C@H]3c3ccncc3)cc2)cn1 ZINC000101544808 1030714068 /nfs/dbraw/zinc/71/40/68/1030714068.db2.gz VMVICNVHJWVSNM-NRFANRHFSA-N 2 0 332.451 4.385 20 0 EIADRP c1csc(CN2CCC[C@@H](C[NH2+]Cc3ccc4cc[nH]c4c3)C2)c1 ZINC000527650539 1030800140 /nfs/dbraw/zinc/80/01/40/1030800140.db2.gz QBZYKCCRALMURZ-KRWDZBQOSA-N 2 0 339.508 4.231 20 0 EIADRP CCC[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)C1CCCCC1 ZINC000658067915 1030813760 /nfs/dbraw/zinc/81/37/60/1030813760.db2.gz SATZKFMHGLPQOW-OAQYLSRUSA-N 2 0 336.564 4.216 20 0 EIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3noc4ccccc43)CC2)C1 ZINC000658067712 1030814278 /nfs/dbraw/zinc/81/42/78/1030814278.db2.gz YCSCMAPOSXRDCT-WMZOPIPTSA-N 2 0 341.499 4.003 20 0 EIADRP CC(C)CC[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)C(C)(C)C ZINC000658071797 1030815319 /nfs/dbraw/zinc/81/53/19/1030815319.db2.gz ZKAQRVVNSDAJSK-HXUWFJFHSA-N 2 0 338.580 4.318 20 0 EIADRP C[C@H]1[C@H](c2ccccc2)C[C@@H]1[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658164473 1030860171 /nfs/dbraw/zinc/86/01/71/1030860171.db2.gz DKGAFRGGTXBZIQ-NMNUPHIUSA-N 2 0 349.522 4.075 20 0 EIADRP Cc1cc(C)cc(C[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)c1 ZINC000658176863 1030868948 /nfs/dbraw/zinc/86/89/48/1030868948.db2.gz NSASRGXDJMNYHQ-GOSISDBHSA-N 2 0 326.484 4.095 20 0 EIADRP CC[C@@H]1C[C@@H]([NH2+]CC2(CC)CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC000648488624 1030879551 /nfs/dbraw/zinc/87/95/51/1030879551.db2.gz CMDPIAILMDHQSK-LEWJYISDSA-N 2 0 344.543 4.226 20 0 EIADRP CC[C@@H]1C[C@H]([NH2+]CC2(CC)CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC000648488625 1030880049 /nfs/dbraw/zinc/88/00/49/1030880049.db2.gz CMDPIAILMDHQSK-NHCUHLMSSA-N 2 0 344.543 4.226 20 0 EIADRP Cc1cccc([C@H]([NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)C(C)C)c1 ZINC000527874635 1030889429 /nfs/dbraw/zinc/88/94/29/1030889429.db2.gz XIKGNLLSGSCFIK-FDFHNCONSA-N 2 0 344.543 4.050 20 0 EIADRP CC(C)c1cccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)c1 ZINC000527872489 1030889736 /nfs/dbraw/zinc/88/97/36/1030889736.db2.gz LZHADIGHMWAEKD-BULFRSBZSA-N 2 0 344.543 4.229 20 0 EIADRP CC(C)c1cccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)c1 ZINC000527872492 1030889946 /nfs/dbraw/zinc/88/99/46/1030889946.db2.gz LZHADIGHMWAEKD-WTOYTKOKSA-N 2 0 344.543 4.229 20 0 EIADRP CC(C)(C)O[C@H]1C[C@@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C12CCC2 ZINC000658255847 1030928564 /nfs/dbraw/zinc/92/85/64/1030928564.db2.gz WOSDQJHISCPTBZ-MOPGFXCFSA-N 2 0 334.548 4.109 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCN1C1CCCCC1)c1cnc2ccsc2c1 ZINC000527949023 1030964999 /nfs/dbraw/zinc/96/49/99/1030964999.db2.gz NQICBPAWJMESSN-YOEHRIQHSA-N 2 0 329.513 4.354 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cccnc1 ZINC000658320508 1030983613 /nfs/dbraw/zinc/98/36/13/1030983613.db2.gz YWLGNKGGFLMZFN-RXVVDRJESA-N 2 0 335.495 4.035 20 0 EIADRP C[C@H](CCc1ccco1)[NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000310066031 1031012990 /nfs/dbraw/zinc/01/29/90/1031012990.db2.gz BLFIVZQJFQKBSH-NQIIRXRSSA-N 2 0 326.484 4.103 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2ccccc2n1)c1cccc(OCC[NH+](C)C)c1 ZINC000532463287 1031130771 /nfs/dbraw/zinc/13/07/71/1031130771.db2.gz MRMFWAKVBVJOAR-QGZVFWFLSA-N 2 0 349.478 4.026 20 0 EIADRP Clc1ccc(C2=CC[C@H]([NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)CC2)cc1 ZINC000449074345 1031426715 /nfs/dbraw/zinc/42/67/15/1031426715.db2.gz KPBATSWRXUUFFB-BEFAXECRSA-N 2 0 330.903 4.350 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2nc3cc(C)ccc3s2)CC1 ZINC000528353584 1031428619 /nfs/dbraw/zinc/42/86/19/1031428619.db2.gz UHCGHVHLPUSJNL-UHFFFAOYSA-N 2 0 331.529 4.159 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC(c2nc3ccccc3s2)CC1 ZINC000531614318 1031431835 /nfs/dbraw/zinc/43/18/35/1031431835.db2.gz BSAZSHKFOBXINT-QGZVFWFLSA-N 2 0 343.540 4.350 20 0 EIADRP COc1ccc2c(c1)C[C@@H]([NH2+]CCCCCCCCCCC[NH3+])C2 ZINC001168242959 1031434959 /nfs/dbraw/zinc/43/49/59/1031434959.db2.gz FRAHMRDKTXKUKL-FQEVSTJZSA-N 2 0 332.532 4.222 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]C2CCC(OC3CCCC3)CC2)C1 ZINC000449081660 1031438798 /nfs/dbraw/zinc/43/87/98/1031438798.db2.gz GYUINPOQOWOMHU-LWEYNCJUSA-N 2 0 336.564 4.359 20 0 EIADRP Clc1ccc([C@@H]2CC[C@@H]([NH2+]C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC000449091541 1031453130 /nfs/dbraw/zinc/45/31/30/1031453130.db2.gz QDBRNJJEHHPFMW-YLJYHZDGSA-N 2 0 332.919 4.440 20 0 EIADRP COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000531689062 1031459979 /nfs/dbraw/zinc/45/99/79/1031459979.db2.gz ISYJIKJXLOKIBH-SFHVURJKSA-N 2 0 338.495 4.450 20 0 EIADRP COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000531689061 1031460661 /nfs/dbraw/zinc/46/06/61/1031460661.db2.gz ISYJIKJXLOKIBH-GOSISDBHSA-N 2 0 338.495 4.450 20 0 EIADRP CCC[C@H](CCO)C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449169905 1031490359 /nfs/dbraw/zinc/49/03/59/1031490359.db2.gz DWXJBEFUYQONMI-QGZVFWFLSA-N 2 0 326.569 4.054 20 0 EIADRP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000531715399 1031500812 /nfs/dbraw/zinc/50/08/12/1031500812.db2.gz ZOOLAGCFLCYWSC-HOCLYGCPSA-N 2 0 326.937 4.142 20 0 EIADRP Cc1nc(CC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)c(C)o1 ZINC000449203878 1031527806 /nfs/dbraw/zinc/52/78/06/1031527806.db2.gz IKJPTQKULLEKHF-UHFFFAOYSA-N 2 0 335.536 4.103 20 0 EIADRP C[C@H]1CC[C@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c2sccc21 ZINC000453069632 1031536064 /nfs/dbraw/zinc/53/60/64/1031536064.db2.gz UCNYCIYMNYWZKH-KXBFYZLASA-N 2 0 344.524 4.417 20 0 EIADRP CC(C)COc1ccccc1C[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000449219058 1031551311 /nfs/dbraw/zinc/55/13/11/1031551311.db2.gz MIXVOFVEBNZDHE-UHFFFAOYSA-N 2 0 326.484 4.073 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@H]2Cc3cccc(O)c3C2)CC1 ZINC000449282786 1031596509 /nfs/dbraw/zinc/59/65/09/1031596509.db2.gz IVSQZKCJAGPBRZ-SFHVURJKSA-N 2 0 344.543 4.128 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H](C)c1cccc(C2CC2)c1 ZINC000449349091 1031645492 /nfs/dbraw/zinc/64/54/92/1031645492.db2.gz ILWSVQXIZRHVBP-HNNXBMFYSA-N 2 0 332.451 4.304 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccsc1 ZINC000453211168 1031727408 /nfs/dbraw/zinc/72/74/08/1031727408.db2.gz NDDSJBDKXUPHAK-HXUWFJFHSA-N 2 0 344.524 4.462 20 0 EIADRP CC(C)[C@H]1C[C@H](C[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)CCO1 ZINC000449494499 1031784897 /nfs/dbraw/zinc/78/48/97/1031784897.db2.gz NIUDHAQZSWKYAZ-RMVXJAJNSA-N 2 0 336.564 4.070 20 0 EIADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1cnc(CCc2ccccc2)s1 ZINC000449528774 1031823672 /nfs/dbraw/zinc/82/36/72/1031823672.db2.gz RWFXKMJMFTYNBM-UHFFFAOYSA-N 2 0 345.556 4.138 20 0 EIADRP C/C(=C/c1ccccc1OC(F)F)C[NH2+]C(C)(C)CCC[NH+](C)C ZINC000449525565 1031823712 /nfs/dbraw/zinc/82/37/12/1031823712.db2.gz BTPGBYDJRODJNS-SQFISAMPSA-N 2 0 340.458 4.401 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+][C@H]3CCc4ccccc43)CC2)c1 ZINC000531950208 1031864759 /nfs/dbraw/zinc/86/47/59/1031864759.db2.gz IBQIRCZLMZMMSE-FQEVSTJZSA-N 2 0 326.509 4.237 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccccc2C(F)(F)F)C1 ZINC000531958969 1031878017 /nfs/dbraw/zinc/87/80/17/1031878017.db2.gz HCMKGAVIKAHKPO-CABCVRRESA-N 2 0 328.422 4.476 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1OC ZINC000453370688 1031916067 /nfs/dbraw/zinc/91/60/67/1031916067.db2.gz VTVKOZWXAGBSGS-BPIHKTFHSA-N 2 0 346.515 4.150 20 0 EIADRP CCOc1cccc2cc([C@@H](C)[NH2+]CCCC[N@H+](C)C3CC3)oc21 ZINC000453417539 1031952572 /nfs/dbraw/zinc/95/25/72/1031952572.db2.gz XUGYKEQVGUAKCT-OAHLLOKOSA-N 2 0 330.472 4.357 20 0 EIADRP C[C@H](CCN[C@@H](C)c1ccc(Cl)nc1)[N@H+](C)Cc1ccccc1 ZINC000179135355 1032015668 /nfs/dbraw/zinc/01/56/68/1032015668.db2.gz ZMHJBOORUBZAJO-CVEARBPZSA-N 2 0 331.891 4.296 20 0 EIADRP CC(C)(C)c1cccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC001168264684 1032028192 /nfs/dbraw/zinc/02/81/92/1032028192.db2.gz LTKYTYDHUCOSQM-GHTZIAJQSA-N 2 0 326.528 4.433 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(-c3ccccc3)no2)CC1 ZINC000052209083 1034476945 /nfs/dbraw/zinc/47/69/45/1034476945.db2.gz VPATXYTWXUYPMV-UHFFFAOYSA-N 2 0 341.499 4.286 20 0 EIADRP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000647794938 1034551639 /nfs/dbraw/zinc/55/16/39/1034551639.db2.gz GJNAFHMFWFIEIB-CEXWTWQISA-N 2 0 338.495 4.105 20 0 EIADRP FC(F)(F)c1ccccc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000261762091 1034561134 /nfs/dbraw/zinc/56/11/34/1034561134.db2.gz PWKBOIFZSGLQFI-HYVNUMGLSA-N 2 0 326.406 4.106 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)CC1 ZINC000333269976 1034572081 /nfs/dbraw/zinc/57/20/81/1034572081.db2.gz KIAVKEYFGOHKKC-SEEARECTSA-N 2 0 345.487 4.186 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)CC1 ZINC000333269977 1034573114 /nfs/dbraw/zinc/57/31/14/1034573114.db2.gz KIAVKEYFGOHKKC-ZUEPYMLJSA-N 2 0 345.487 4.186 20 0 EIADRP C[N@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+]([C@@H]3C[C@H]4C[C@H]4C3)C[C@@H]21 ZINC001167934138 1034709215 /nfs/dbraw/zinc/70/92/15/1034709215.db2.gz GVMRSHOMCRAQES-WRPXMVFYSA-N 2 0 330.541 4.079 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000509927399 1035011271 /nfs/dbraw/zinc/01/12/71/1035011271.db2.gz PEMNIHHGUWXXOG-NGYXKBBWSA-N 2 0 344.543 4.338 20 0 EIADRP c1cncc([C@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)C2CCC2)c1 ZINC000280295042 1035224497 /nfs/dbraw/zinc/22/44/97/1035224497.db2.gz NBSVAMHENMDHQJ-JOCHJYFZSA-N 2 0 335.495 4.308 20 0 EIADRP Cc1ccccc1[C@@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)C(C)(C)C ZINC000500985355 1035337992 /nfs/dbraw/zinc/33/79/92/1035337992.db2.gz RREMORLBRPOSRM-OAQYLSRUSA-N 2 0 345.575 4.088 20 0 EIADRP Cc1cccc([C@@H]([NH2+]CCCN2CC[NH+](C(C)C)CC2)C(C)(C)C)c1 ZINC000500988450 1035338721 /nfs/dbraw/zinc/33/87/21/1035338721.db2.gz CPIRTZQSEPCGDH-OAQYLSRUSA-N 2 0 345.575 4.088 20 0 EIADRP C[C@@H](C[NH+]1CCC(C[NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000501116567 1035381449 /nfs/dbraw/zinc/38/14/49/1035381449.db2.gz KMEXOADIORTRBO-AWEZNQCLSA-N 2 0 328.422 4.083 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000501378234 1035433426 /nfs/dbraw/zinc/43/34/26/1035433426.db2.gz PACLTWOMMVQFQZ-CUXKYVRBSA-N 2 0 343.559 4.456 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@H+](C)[C@@H](C)C1 ZINC000501466376 1035449338 /nfs/dbraw/zinc/44/93/38/1035449338.db2.gz JNXGAHNQKXKFCR-AWIOHZCQSA-N 2 0 326.406 4.181 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]CC1CC[NH+](C)CC1 ZINC000501468738 1035449779 /nfs/dbraw/zinc/44/97/79/1035449779.db2.gz SCCZIPVYUMKGEO-KAMYIIQDSA-N 2 0 326.406 4.040 20 0 EIADRP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC([C@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000420389103 1035564000 /nfs/dbraw/zinc/56/40/00/1035564000.db2.gz LXPLISWVTBIJPM-TYCQWZJGSA-N 2 0 344.543 4.263 20 0 EIADRP FC(F)(F)c1cccc([C@@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)C2CC2)c1 ZINC000420402605 1035576627 /nfs/dbraw/zinc/57/66/27/1035576627.db2.gz KBQZNWLYRALYCT-GUYCJALGSA-N 2 0 326.406 4.136 20 0 EIADRP CCS[C@@H]1CCC[C@H]1[NH2+]C/C=C\C[NH2+][C@H]1CCC[C@H]1SCC ZINC000595484639 1035679538 /nfs/dbraw/zinc/67/95/38/1035679538.db2.gz MSXHEYCDOLYHMV-AVXICVFVSA-N 2 0 342.618 4.070 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCc2ccc(F)cc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000485257794 1035801063 /nfs/dbraw/zinc/80/10/63/1035801063.db2.gz HADPKMFKABLZFO-DKZVUGQWSA-N 2 0 338.470 4.313 20 0 EIADRP Fc1cccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c1 ZINC000485469143 1035915919 /nfs/dbraw/zinc/91/59/19/1035915919.db2.gz SVPFSDHYMOJWOG-UHFFFAOYSA-N 2 0 338.470 4.314 20 0 EIADRP Cc1ccc2c(c1)C1(CC2)CC[NH+](C2CC[NH+](CC3CC3)CC2)CC1 ZINC001168380318 1036142564 /nfs/dbraw/zinc/14/25/64/1036142564.db2.gz RECGZCYKGXMFIZ-UHFFFAOYSA-N 2 0 338.539 4.149 20 0 EIADRP C[C@H](N[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1cnn(C2CCCC2)c1 ZINC000502469652 1036246010 /nfs/dbraw/zinc/24/60/10/1036246010.db2.gz CWWZEARNNUJVNN-BZSNNMDCSA-N 2 0 344.547 4.302 20 0 EIADRP CC(C)OCc1ccccc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000571789623 1036252285 /nfs/dbraw/zinc/25/22/85/1036252285.db2.gz VEKHZTXTUAKDDE-NJDAHSKKSA-N 2 0 330.516 4.012 20 0 EIADRP C/C(=C\c1ccccc1)C[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000588177622 1036285550 /nfs/dbraw/zinc/28/55/50/1036285550.db2.gz LFWZCDBUJZOIJS-CZIZESTLSA-N 2 0 334.507 4.387 20 0 EIADRP C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421366648 1036313156 /nfs/dbraw/zinc/31/31/56/1036313156.db2.gz CZEKPCRYGXYGDQ-IGEOTXOUSA-N 2 0 328.422 4.099 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2c(OC(F)F)ccc3ccccc32)CC1 ZINC000421369122 1036319868 /nfs/dbraw/zinc/31/98/68/1036319868.db2.gz HHHNWCPCKUOWBP-UHFFFAOYSA-N 2 0 348.437 4.404 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC12CCSCC2)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000421385524 1036343199 /nfs/dbraw/zinc/34/31/99/1036343199.db2.gz QAJVINTXXXXKEL-YSIASYRMSA-N 2 0 344.568 4.020 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@H]3CC34CCSCC4)CC2)C1 ZINC000421391658 1036356237 /nfs/dbraw/zinc/35/62/37/1036356237.db2.gz WNRBBSBCMWZPIM-LMMKCTJWSA-N 2 0 336.589 4.152 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)c2cc(C)c(C)o2)cc1 ZINC000502700729 1036527614 /nfs/dbraw/zinc/52/76/14/1036527614.db2.gz RIFUQVQELWPWDS-KRWDZBQOSA-N 2 0 344.499 4.468 20 0 EIADRP C[C@H]([NH2+]C/C=C/c1ccc(F)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486472924 1036721302 /nfs/dbraw/zinc/72/13/02/1036721302.db2.gz DPKARZYRVMHYLF-NLOMCHEHSA-N 2 0 338.470 4.339 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccncc2Cl)cc1 ZINC000421820946 1036774658 /nfs/dbraw/zinc/77/46/58/1036774658.db2.gz ONYCXGHWIIJHRV-HNNXBMFYSA-N 2 0 331.891 4.428 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccncc1Cl ZINC000421825258 1036781010 /nfs/dbraw/zinc/78/10/10/1036781010.db2.gz MQHCXRRUIRMLFN-AWEZNQCLSA-N 2 0 349.931 4.359 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccncc2Cl)c1 ZINC000421826866 1036783878 /nfs/dbraw/zinc/78/38/78/1036783878.db2.gz VBFGOHGIJQYWTR-OAHLLOKOSA-N 2 0 331.891 4.426 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H](C)c1ccncc1Cl ZINC000421819196 1036805078 /nfs/dbraw/zinc/80/50/78/1036805078.db2.gz FQUIXCPPFAWWAS-OAHLLOKOSA-N 2 0 331.891 4.426 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(Br)c(F)c1 ZINC000421888621 1036835279 /nfs/dbraw/zinc/83/52/79/1036835279.db2.gz WUJKAOLDQDUBCP-LMWSTFAQSA-N 2 0 343.284 4.112 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@H]2[NH2+]C2CCC([NH+](C)C)CC2)cc1F ZINC000421887435 1036835618 /nfs/dbraw/zinc/83/56/18/1036835618.db2.gz VWQJYOPAKIMJNQ-QQGUTBHFSA-N 2 0 348.506 4.323 20 0 EIADRP COc1cccc([C@H]2CCCC[N@@H+]2C2CC[NH+](CC3CC3)CC2)c1 ZINC001168392661 1036853390 /nfs/dbraw/zinc/85/33/90/1036853390.db2.gz RUDHVKOUMPWGQD-OAQYLSRUSA-N 2 0 328.500 4.097 20 0 EIADRP CC1CC[NH+](Cc2ccc(C[NH2+]Cc3[nH]nc4ccccc43)cc2)CC1 ZINC000589639275 1036855225 /nfs/dbraw/zinc/85/52/25/1036855225.db2.gz TWVCJYYXPKKNIL-UHFFFAOYSA-N 2 0 348.494 4.085 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2[nH]nc3ccccc32)C1 ZINC000589641077 1036857499 /nfs/dbraw/zinc/85/74/99/1036857499.db2.gz DCXROIPUOQRBNE-QGZVFWFLSA-N 2 0 348.494 4.085 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccc4[nH]cnc4c3)cc2)C1 ZINC000589641136 1036857998 /nfs/dbraw/zinc/85/79/98/1036857998.db2.gz UFVIBJFZODGOME-KRWDZBQOSA-N 2 0 348.494 4.085 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(OC(F)(F)F)cc2)C1 ZINC000589836074 1036879996 /nfs/dbraw/zinc/87/99/96/1036879996.db2.gz FYWPEHLTHRBYIA-HNNXBMFYSA-N 2 0 344.421 4.187 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C/C=C\c3ccncc3)cc2)C1 ZINC000486943620 1036897976 /nfs/dbraw/zinc/89/79/76/1036897976.db2.gz OBKWRIRGHWCTDJ-QDVBSOPMSA-N 2 0 335.495 4.117 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]C/C=C/c3ccncc3)cc2)C1 ZINC000486989681 1036938826 /nfs/dbraw/zinc/93/88/26/1036938826.db2.gz UUVHQLXZIUMBGJ-IGVYDEPUSA-N 2 0 349.522 4.363 20 0 EIADRP c1cc2cccc(C[NH2+][C@@H]3CCN(Cc4ccccc4)C4(CC4)C3)c2[nH]1 ZINC000569722679 1037016867 /nfs/dbraw/zinc/01/68/67/1037016867.db2.gz APMKPYLVVWKNNP-OAQYLSRUSA-N 2 0 345.490 4.455 20 0 EIADRP CCOCCC1(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CCC1 ZINC000272711311 1037277329 /nfs/dbraw/zinc/27/73/29/1037277329.db2.gz COBHMDYZFCHCLH-FPOVZHCZSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@@H]([NH2+]CCCCCC[NH2+][C@H](C)c1ccccn1)c1ccccn1 ZINC000272805853 1037297917 /nfs/dbraw/zinc/29/79/17/1037297917.db2.gz FSTMHKPPVDQEPB-QZTJIDSGSA-N 2 0 326.488 4.038 20 0 EIADRP C[C@@H]([NH2+]CCCCCC[NH2+][C@H](C)c1cccnc1)c1cccnc1 ZINC000272828749 1037305465 /nfs/dbraw/zinc/30/54/65/1037305465.db2.gz KNFFZRHBEOOFBJ-QZTJIDSGSA-N 2 0 326.488 4.038 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cc(-c3ccc(C)cc3)no2)CC1 ZINC000488347087 1037536797 /nfs/dbraw/zinc/53/67/97/1037536797.db2.gz TUTWGEADLYCSTC-UHFFFAOYSA-N 2 0 341.499 4.204 20 0 EIADRP CC[N@@H+]1CCC[C@@H](C[NH2+]C/C(C)=C/c2cccc(C(F)(F)F)c2)C1 ZINC000573596135 1037597144 /nfs/dbraw/zinc/59/71/44/1037597144.db2.gz CXUZOHUXCCXLCQ-OBHPCNEJSA-N 2 0 340.433 4.430 20 0 EIADRP CC[C@H](C(=O)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)[NH+](CC)CC ZINC000605425136 1037779759 /nfs/dbraw/zinc/77/97/59/1037779759.db2.gz WFQOCXCEMFBPLS-FXAWDEMLSA-N 2 0 345.531 4.120 20 0 EIADRP C[C@H]([NH2+]C(C)(C)CN[C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)c1ccccc1 ZINC000422733041 1037808332 /nfs/dbraw/zinc/80/83/32/1037808332.db2.gz QLWLXHJNNKYTJB-OYNPSCLESA-N 2 0 343.559 4.016 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1 ZINC000422733086 1037809318 /nfs/dbraw/zinc/80/93/18/1037809318.db2.gz QNSGJKIIMZSKIE-VXGBXAGGSA-N 2 0 337.389 4.279 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000422715157 1037810372 /nfs/dbraw/zinc/81/03/72/1037810372.db2.gz RQVKDPAKMBOTOH-JXFKEZNVSA-N 2 0 342.458 4.197 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCC[NH2+]CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000422715165 1037810437 /nfs/dbraw/zinc/81/04/37/1037810437.db2.gz RQVKDPAKMBOTOH-OXQOHEQNSA-N 2 0 342.458 4.197 20 0 EIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+][C@@H](C)CCCC[NH3+])cc1 ZINC000422714177 1037810943 /nfs/dbraw/zinc/81/09/43/1037810943.db2.gz KTJNLWMAMIYZGC-KKSFZXQISA-N 2 0 344.474 4.225 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCc1cc(Cl)cc(Cl)c1 ZINC000422715730 1037812592 /nfs/dbraw/zinc/81/25/92/1037812592.db2.gz MNRWCIOGHJOVNV-LLVKDONJSA-N 2 0 338.282 4.049 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000422720120 1037813192 /nfs/dbraw/zinc/81/31/92/1037813192.db2.gz ZREYLJSCTYAMJU-VMEOHVCESA-N 2 0 342.458 4.325 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCCCCOC1CCCCC1 ZINC000422718518 1037813757 /nfs/dbraw/zinc/81/37/57/1037813757.db2.gz XLTFYCNPECMYQU-INIZCTEOSA-N 2 0 333.520 4.019 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCCCCOC1CCCCC1 ZINC000422718523 1037814163 /nfs/dbraw/zinc/81/41/63/1037814163.db2.gz XLTFYCNPECMYQU-MRXNPFEDSA-N 2 0 333.520 4.019 20 0 EIADRP COc1cccc([C@@H]([NH2+][C@H](C)CCC[NH3+])c2ccccc2Cl)c1 ZINC000422776013 1037830574 /nfs/dbraw/zinc/83/05/74/1037830574.db2.gz BVQRLMXSYKEFPU-AUUYWEPGSA-N 2 0 332.875 4.155 20 0 EIADRP [NH3+][C@@H]1C[C@@H]([NH2+]CCc2csc(-c3ccccc3)n2)c2ccccc21 ZINC000422776631 1037830990 /nfs/dbraw/zinc/83/09/90/1037830990.db2.gz AQSXDIDIHNCRAT-RTBURBONSA-N 2 0 335.476 4.087 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000422779647 1037833240 /nfs/dbraw/zinc/83/32/40/1037833240.db2.gz GFMBXZDPDNTMBX-AWEZNQCLSA-N 2 0 328.422 4.234 20 0 EIADRP CC1CC[NH+](Cc2ccc(CN[C@H]3C[C@@H]([NH3+])c4ccccc43)cc2)CC1 ZINC000422800323 1037836435 /nfs/dbraw/zinc/83/64/35/1037836435.db2.gz BGIKWOZIMUEWGY-PKTZIBPZSA-N 2 0 349.522 4.153 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1ccc(Br)cc1 ZINC000422789886 1037839996 /nfs/dbraw/zinc/83/99/96/1037839996.db2.gz XCZAVJYORMPLGE-NEPJUHHUSA-N 2 0 348.288 4.023 20 0 EIADRP C[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422828165 1037841355 /nfs/dbraw/zinc/84/13/55/1037841355.db2.gz TVAVFOBSVIOKFU-XBDGOBDMSA-N 2 0 336.479 4.024 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H]1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000422832526 1037843229 /nfs/dbraw/zinc/84/32/29/1037843229.db2.gz XWIRNIXAKIHSIH-KBRIMQKVSA-N 2 0 328.422 4.449 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CN[C@@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000422863318 1037849315 /nfs/dbraw/zinc/84/93/15/1037849315.db2.gz OOGSDHXIGRQNMG-NLSFWIRASA-N 2 0 349.522 4.295 20 0 EIADRP CSCc1cc(F)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000422864247 1037849441 /nfs/dbraw/zinc/84/94/41/1037849441.db2.gz MMYZHNZFQPLRIA-IPMKNSEASA-N 2 0 336.520 4.089 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)CC1 ZINC000422897787 1037860961 /nfs/dbraw/zinc/86/09/61/1037860961.db2.gz CUNRGVWZJGXBEJ-QIMFLAQGSA-N 2 0 329.271 4.067 20 0 EIADRP CC(C)c1ccc(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422874720 1037861603 /nfs/dbraw/zinc/86/16/03/1037861603.db2.gz ASPAXCHLLICOHO-UNMCSNQZSA-N 2 0 336.479 4.156 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422912822 1037866044 /nfs/dbraw/zinc/86/60/44/1037866044.db2.gz OFRSFHSWIRTWQM-SQPSOYEMSA-N 2 0 345.487 4.191 20 0 EIADRP c1ccc2c(c1)cccc2C[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422924190 1037870497 /nfs/dbraw/zinc/87/04/97/1037870497.db2.gz YCVQWZXZVBAFHM-GGAORHGYSA-N 2 0 344.458 4.185 20 0 EIADRP COc1ccc([C@H]([NH2+][C@@H](C)CCCC[NH3+])c2ccc(C)cc2)cc1 ZINC000422936414 1037872817 /nfs/dbraw/zinc/87/28/17/1037872817.db2.gz MIYMLEOQYBFSJV-LAUBAEHRSA-N 2 0 326.484 4.200 20 0 EIADRP CC[C@@H](Cc1ccc(Cl)cc1)[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422982771 1037894776 /nfs/dbraw/zinc/89/47/76/1037894776.db2.gz RGPSCLCPZWDWHV-DYVFJYSZSA-N 2 0 331.891 4.174 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@H]1CCC(C)(C)c2ccccc21 ZINC000423010952 1037898680 /nfs/dbraw/zinc/89/86/80/1037898680.db2.gz AKOCLTYNVPBLKT-DOTOQJQBSA-N 2 0 337.511 4.355 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000423063294 1037929243 /nfs/dbraw/zinc/92/92/43/1037929243.db2.gz OPBKZGOSZIAIAN-GWCFXTLKSA-N 2 0 342.327 4.416 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1C[C@H](c2ccc(Cl)cc2)C1 ZINC000423093518 1037953286 /nfs/dbraw/zinc/95/32/86/1037953286.db2.gz HWBFPTYWWUIVQD-YEWWUXTCSA-N 2 0 329.875 4.099 20 0 EIADRP Clc1ccc(CCCC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)s1 ZINC000423100127 1037958380 /nfs/dbraw/zinc/95/83/80/1037958380.db2.gz GGORHEHPTGXDGH-XHSDSOJGSA-N 2 0 326.937 4.235 20 0 EIADRP FC(F)(F)c1cccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2CCC[NH2+]CC2)c1 ZINC000423103142 1037961328 /nfs/dbraw/zinc/96/13/28/1037961328.db2.gz KSESKEJSJVRLSR-IXDOHACOSA-N 2 0 326.406 4.073 20 0 EIADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+]C[C@H](OCC1CC1)c1ccc(Cl)cc1 ZINC000423107708 1037986130 /nfs/dbraw/zinc/98/61/30/1037986130.db2.gz QBBBNQWTQFSEFG-QRVBRYPASA-N 2 0 336.907 4.057 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]CC1(c2ccc(Br)s2)CCC1 ZINC000423108727 1037988111 /nfs/dbraw/zinc/98/81/11/1037988111.db2.gz ROGFQYUBDDRSHL-GFCCVEGCSA-N 2 0 345.350 4.039 20 0 EIADRP C[C@@]1(C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C[C@H]1c1ccccc1 ZINC000423140660 1038013215 /nfs/dbraw/zinc/01/32/15/1038013215.db2.gz ZAXCJVBHTYSIHL-PABCKOPISA-N 2 0 348.490 4.026 20 0 EIADRP C[C@@]1(C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C[C@H]1c1ccccc1 ZINC000423140659 1038014688 /nfs/dbraw/zinc/01/46/88/1038014688.db2.gz ZAXCJVBHTYSIHL-MQFRRQCYSA-N 2 0 348.490 4.026 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](Cc1ccccc1)c1nc2ccccc2s1 ZINC000423162332 1038020133 /nfs/dbraw/zinc/02/01/33/1038020133.db2.gz PCGKMOONBVANJQ-YJBOKZPZSA-N 2 0 339.508 4.297 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@H](Cc1ccccc1)c1nc2ccccc2s1 ZINC000423162330 1038020323 /nfs/dbraw/zinc/02/03/23/1038020323.db2.gz PCGKMOONBVANJQ-MAUKXSAKSA-N 2 0 339.508 4.297 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC1(Cc2cccc(Cl)c2)CC1 ZINC000423172160 1038028583 /nfs/dbraw/zinc/02/85/83/1038028583.db2.gz RPYDJGQSAUQOPB-CQSZACIVSA-N 2 0 343.902 4.176 20 0 EIADRP Clc1ccc(-c2nc3c(s2)[C@H]([NH2+]C2CC[NH2+]CC2)CCC3)cc1 ZINC000423178453 1038031061 /nfs/dbraw/zinc/03/10/61/1038031061.db2.gz GDDXLGRFGQVJJX-OAHLLOKOSA-N 2 0 347.915 4.183 20 0 EIADRP Clc1ccccc1C[C@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1cccs1 ZINC000423239197 1038057000 /nfs/dbraw/zinc/05/70/00/1038057000.db2.gz AYGGPYARCQLOIK-PBHICJAKSA-N 2 0 334.916 4.275 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccsc1 ZINC000423214530 1038058281 /nfs/dbraw/zinc/05/82/81/1038058281.db2.gz PBOWCSSJHVZKLA-RDTXWAMCSA-N 2 0 334.916 4.275 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1ccc(SCC(F)F)cc1 ZINC000423262849 1038072567 /nfs/dbraw/zinc/07/25/67/1038072567.db2.gz WHSYHDCPENRJCJ-KBPBESRZSA-N 2 0 328.472 4.084 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cc(Br)cs2)cc1 ZINC000423293463 1038095420 /nfs/dbraw/zinc/09/54/20/1038095420.db2.gz RKBDMDIJOQPFMN-QWRGUYRKSA-N 2 0 339.302 4.381 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCCOc3ccc(Cl)cc32)cc1 ZINC000423291260 1038096918 /nfs/dbraw/zinc/09/69/18/1038096918.db2.gz HNJXBVDDVOFYND-UGSOOPFHSA-N 2 0 330.859 4.363 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)CCS2 ZINC000423291668 1038097115 /nfs/dbraw/zinc/09/71/15/1038097115.db2.gz JIERSUAHDIZLHN-SCLBCKFNSA-N 2 0 328.481 4.042 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCc3c2cccc3Br)cc1 ZINC000423293481 1038097375 /nfs/dbraw/zinc/09/73/75/1038097375.db2.gz RMIRBKIBTIKEHS-SGTLLEGYSA-N 2 0 345.284 4.246 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)cc1 ZINC000423290073 1038097448 /nfs/dbraw/zinc/09/74/48/1038097448.db2.gz CHEOENVLQACINH-STQMWFEESA-N 2 0 338.373 4.456 20 0 EIADRP C[C@@H]([NH3+])c1ccc(CNC2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cc1 ZINC000423291471 1038097743 /nfs/dbraw/zinc/09/77/43/1038097743.db2.gz IKOCHZXUNGLNJB-QGZVFWFLSA-N 2 0 345.575 4.475 20 0 EIADRP C[C@@H]([NH2+]C[C@@]1(C)CCC[NH2+]C1)c1ccc(SCC(F)F)cc1 ZINC000423319200 1038114094 /nfs/dbraw/zinc/11/40/94/1038114094.db2.gz DDDQROOXXRIYOK-DYVFJYSZSA-N 2 0 328.472 4.084 20 0 EIADRP [NH3+]CCCC[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423317205 1038114891 /nfs/dbraw/zinc/11/48/91/1038114891.db2.gz AMFDQUFXOJFAEW-AWEZNQCLSA-N 2 0 335.904 4.169 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2ccccc2Br)cc1 ZINC000423293887 1038121514 /nfs/dbraw/zinc/12/15/14/1038121514.db2.gz SKHXCXRRIQLCGV-CHWSQXEVSA-N 2 0 333.273 4.320 20 0 EIADRP Clc1ccc(C2CC([NH2+]CC3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC000658355791 1038128263 /nfs/dbraw/zinc/12/82/63/1038128263.db2.gz KSHYXWRVKRYMJS-UHFFFAOYSA-N 2 0 332.919 4.298 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423327695 1038144837 /nfs/dbraw/zinc/14/48/37/1038144837.db2.gz LPAJFQHBNIZFTF-QRWLVFNGSA-N 2 0 343.540 4.083 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423340184 1038156362 /nfs/dbraw/zinc/15/63/62/1038156362.db2.gz VLPGAOILGKWTMT-ORAYPTAESA-N 2 0 347.503 4.298 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC000423374833 1038156607 /nfs/dbraw/zinc/15/66/07/1038156607.db2.gz KBTFNHLSYHICRN-MKBNYLNASA-N 2 0 333.476 4.049 20 0 EIADRP COc1ccc2cc([C@@H](C)[NH2+]Cc3ccc4c(c3)C[NH2+]C4)ccc2c1 ZINC000423359398 1038170704 /nfs/dbraw/zinc/17/07/04/1038170704.db2.gz PANCSPPQFLMSGD-OAHLLOKOSA-N 2 0 332.447 4.302 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](c1ccc(Br)s1)C1CC1 ZINC000423425093 1038211423 /nfs/dbraw/zinc/21/14/23/1038211423.db2.gz GODIAHARTIIRBH-IINYFYTJSA-N 2 0 331.323 4.069 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1csc(-c2ccccc2F)n1 ZINC000423422545 1038212955 /nfs/dbraw/zinc/21/29/55/1038212955.db2.gz LIJHKJMMIJAWNG-KKUMJFAQSA-N 2 0 347.503 4.365 20 0 EIADRP C[C@@H]1C[NH2+]CC[C@@H]1[NH2+][C@H](Cc1ccccc1Cl)c1ccsc1 ZINC000423407937 1038217071 /nfs/dbraw/zinc/21/70/71/1038217071.db2.gz WPXZFXUVTLLIEK-JEBQAFNWSA-N 2 0 334.916 4.273 20 0 EIADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H](Cc1ccccc1Cl)c1ccsc1 ZINC000423407936 1038218774 /nfs/dbraw/zinc/21/87/74/1038218774.db2.gz WPXZFXUVTLLIEK-FSPWUOQZSA-N 2 0 334.916 4.273 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000423444690 1038225834 /nfs/dbraw/zinc/22/58/34/1038225834.db2.gz LXLOFJCCFZWHPP-PGRDOPGGSA-N 2 0 349.522 4.045 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000423456936 1038240066 /nfs/dbraw/zinc/24/00/66/1038240066.db2.gz HNXHYODJLZNPCH-QRTARXTBSA-N 2 0 329.513 4.287 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H](c2ccc(Br)s2)C2CC2)C1 ZINC000423465285 1038242804 /nfs/dbraw/zinc/24/28/04/1038242804.db2.gz HOQGAPGVQPHXBK-IXPVHAAZSA-N 2 0 343.334 4.069 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000423467492 1038244128 /nfs/dbraw/zinc/24/41/28/1038244128.db2.gz JBSWICPTIYOCIV-PAYONLEZSA-N 2 0 340.433 4.449 20 0 EIADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cc(Cl)ccc1OC(F)F ZINC000423477603 1038249455 /nfs/dbraw/zinc/24/94/55/1038249455.db2.gz KCUWRRWMSVSQCY-YPMHNXCESA-N 2 0 332.822 4.124 20 0 EIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cnn(Cc2ccccc2)c1 ZINC000423498592 1038254702 /nfs/dbraw/zinc/25/47/02/1038254702.db2.gz IHASLSNIJFDTAJ-GCJKJVERSA-N 2 0 348.494 4.062 20 0 EIADRP [NH3+]CCC[C@H]([NH2+][C@@H]1CCSc2ccc(F)cc21)c1ccccc1 ZINC000423499230 1038254999 /nfs/dbraw/zinc/25/49/99/1038254999.db2.gz IZZHRZVFEBWWQT-ZWKOTPCHSA-N 2 0 330.472 4.432 20 0 EIADRP COc1ccc([C@H]([NH2+][C@H]2CC[C@H](C[NH3+])C2)c2ccccc2Cl)cc1 ZINC000423502054 1038256763 /nfs/dbraw/zinc/25/67/63/1038256763.db2.gz JMFRYYKHUKJWOY-UVFQYZLESA-N 2 0 344.886 4.155 20 0 EIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1nc2c(s1)CCCC2 ZINC000423504563 1038257329 /nfs/dbraw/zinc/25/73/29/1038257329.db2.gz NNBTXWXLDBTOBA-GOEBONIOSA-N 2 0 329.513 4.153 20 0 EIADRP C[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(Oc2ccccc2)cn1 ZINC000423490947 1038261163 /nfs/dbraw/zinc/26/11/63/1038261163.db2.gz YEMBKDSVOHJPFG-IRXDYDNUSA-N 2 0 325.456 4.057 20 0 EIADRP c1c2ccccc2oc1[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cccnc1 ZINC000423491002 1038264630 /nfs/dbraw/zinc/26/46/30/1038264630.db2.gz YLLOWEYSGOLUGW-RXVVDRJESA-N 2 0 335.451 4.039 20 0 EIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cc(-c2ccccc2)nn1C ZINC000423521355 1038275737 /nfs/dbraw/zinc/27/57/37/1038275737.db2.gz SSFHYYXITKZPPY-FXAWDEMLSA-N 2 0 348.494 4.218 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000423522053 1038277851 /nfs/dbraw/zinc/27/78/51/1038277851.db2.gz XGKUXKFRJJIAGG-ZNOIYHFQSA-N 2 0 332.850 4.286 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1cc(F)c(Cl)cc1Cl ZINC000423539165 1038285852 /nfs/dbraw/zinc/28/58/52/1038285852.db2.gz HUIBENQUHZHPIH-FIQHERPVSA-N 2 0 331.262 4.171 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1ccc(OC(F)(F)F)cc1 ZINC000423540969 1038286065 /nfs/dbraw/zinc/28/60/65/1038286065.db2.gz KGJGTGLRJWZPAV-DLTWYDFYSA-N 2 0 342.405 4.014 20 0 EIADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(SCC(F)F)cc1 ZINC000423538174 1038286402 /nfs/dbraw/zinc/28/64/02/1038286402.db2.gz MBXPPFKFQBUWNA-ZDUSSCGKSA-N 2 0 326.456 4.004 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]CCC3=CC[NH2+]CC3)cs2)cs1 ZINC000423545056 1038290032 /nfs/dbraw/zinc/29/00/32/1038290032.db2.gz XEWCSAWYQUKDEO-GFCCVEGCSA-N 2 0 333.526 4.140 20 0 EIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423554954 1038294099 /nfs/dbraw/zinc/29/40/99/1038294099.db2.gz XKWCCRROCRRATC-WTGUMLROSA-N 2 0 340.536 4.318 20 0 EIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423554952 1038295477 /nfs/dbraw/zinc/29/54/77/1038295477.db2.gz XKWCCRROCRRATC-NMLBUPMWSA-N 2 0 340.536 4.318 20 0 EIADRP Cc1cc(N2CCC[C@H]([NH2+]C(C)C)C2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000607144395 1038389209 /nfs/dbraw/zinc/38/92/09/1038389209.db2.gz ABSOHUOCWAFDKV-AWEZNQCLSA-N 2 0 349.425 4.111 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@H]2CCCc3ccc(C)cc32)[C@@H](C)C1 ZINC000490269969 1038417112 /nfs/dbraw/zinc/41/71/12/1038417112.db2.gz FJHMJMMQTCHPLV-BWAGFHJFSA-N 2 0 344.543 4.099 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2)CC[NH+](C)CC1 ZINC000577684486 1038456028 /nfs/dbraw/zinc/45/60/28/1038456028.db2.gz HXYREWPVDDZZLE-LBPRGKRZSA-N 2 0 347.355 4.471 20 0 EIADRP CSC1(C[NH2+]Cc2ccc(-c3cccs3)cc2)CC[NH+](C)CC1 ZINC000594944315 1038495411 /nfs/dbraw/zinc/49/54/11/1038495411.db2.gz NKHHOBUOVMBYCY-UHFFFAOYSA-N 2 0 346.565 4.332 20 0 EIADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]C1CC[NH+]([C@H]2CCC[C@H](C)C2)CC1 ZINC000480763878 1038804009 /nfs/dbraw/zinc/80/40/09/1038804009.db2.gz WQDIHPYEQDJFEE-VMXMFDLUSA-N 2 0 336.564 4.213 20 0 EIADRP CCc1ccc([C@H](CC)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000539058431 1038804396 /nfs/dbraw/zinc/80/43/96/1038804396.db2.gz JONIJNGJMLMQFX-FKBYEOEOSA-N 2 0 344.543 4.058 20 0 EIADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]C1CC[NH+]([C@@H]2CCC[C@H](C)C2)CC1 ZINC000480763876 1038804467 /nfs/dbraw/zinc/80/44/67/1038804467.db2.gz WQDIHPYEQDJFEE-NRDMVMEKSA-N 2 0 336.564 4.213 20 0 EIADRP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000480772777 1038810186 /nfs/dbraw/zinc/81/01/86/1038810186.db2.gz GOTWPMAUYRBWQB-GOEBONIOSA-N 2 0 338.948 4.285 20 0 EIADRP CC(C)CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000480775856 1038810652 /nfs/dbraw/zinc/81/06/52/1038810652.db2.gz QPKPYDLFMQXTRH-ROUUACIJSA-N 2 0 330.516 4.246 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccccc1N(C)C ZINC000539043254 1038811223 /nfs/dbraw/zinc/81/12/23/1038811223.db2.gz AESAPYAUWUFKQN-HDYDNRTBSA-N 2 0 343.559 4.446 20 0 EIADRP CC(C)CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000480775850 1038811364 /nfs/dbraw/zinc/81/13/64/1038811364.db2.gz QPKPYDLFMQXTRH-MSOLQXFVSA-N 2 0 330.516 4.246 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+][C@@H](Cc2ccncc2)c2cccs2)CC1 ZINC000424305220 1038813203 /nfs/dbraw/zinc/81/32/03/1038813203.db2.gz RTINEDFXYPUNHI-SFHVURJKSA-N 2 0 343.540 4.279 20 0 EIADRP CCC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)C1CCCCC1 ZINC000539065074 1038818569 /nfs/dbraw/zinc/81/85/69/1038818569.db2.gz KJWIOUIBIRLRCX-PWRODBHTSA-N 2 0 336.564 4.093 20 0 EIADRP Fc1ccc(-c2cccc(C[NH2+]C3CC[NH+](CC4CC4)CC3)c2)cc1 ZINC001168364677 1038843600 /nfs/dbraw/zinc/84/36/00/1038843600.db2.gz GRVZYRDWVPPVTC-UHFFFAOYSA-N 2 0 338.470 4.457 20 0 EIADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000504905724 1038845609 /nfs/dbraw/zinc/84/56/09/1038845609.db2.gz MWZUXDMIQYEOHG-HUUCEWRRSA-N 2 0 328.422 4.273 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2cc(-c3ccc(Cl)cc3)no2)CC1 ZINC000056522125 1038848937 /nfs/dbraw/zinc/84/89/37/1038848937.db2.gz KMNQMCFKLAFNOZ-UHFFFAOYSA-N 2 0 347.890 4.159 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(C)nc2C)CC1)CC(C)C ZINC000480862769 1038851545 /nfs/dbraw/zinc/85/15/45/1038851545.db2.gz AVFMIYJLNIJWRH-UHFFFAOYSA-N 2 0 331.548 4.278 20 0 EIADRP C[NH+](C)C1CCC([NH+]2CCC(c3nc4ccccc4s3)CC2)CC1 ZINC001168322713 1038870149 /nfs/dbraw/zinc/87/01/49/1038870149.db2.gz FRHJZWYCDYNMLP-UHFFFAOYSA-N 2 0 343.540 4.349 20 0 EIADRP CC(C)[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000539204153 1038879275 /nfs/dbraw/zinc/87/92/75/1038879275.db2.gz QWSYLNQOHIBMSZ-QGZVFWFLSA-N 2 0 328.422 4.334 20 0 EIADRP Fc1ccc([C@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C2CC2)cc1 ZINC000539216873 1038885978 /nfs/dbraw/zinc/88/59/78/1038885978.db2.gz KWJSADUTGYFIFB-OAQYLSRUSA-N 2 0 339.458 4.178 20 0 EIADRP CC[N@H+](Cc1cccc(Br)c1)C1CCC([NH+](C)C)CC1 ZINC001168327530 1038915525 /nfs/dbraw/zinc/91/55/25/1038915525.db2.gz NVPNCMRDKAHUDW-UHFFFAOYSA-N 2 0 339.321 4.144 20 0 EIADRP Cc1cc(Br)ccc1C[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414801697 1038982156 /nfs/dbraw/zinc/98/21/56/1038982156.db2.gz ALRXLDODXJCNNH-ZDUSSCGKSA-N 2 0 333.273 4.067 20 0 EIADRP COc1cccc([C@@H](Cc2cc(C)cc(C)c2)[NH2+]CCn2ccnc2)c1 ZINC000539359775 1039019772 /nfs/dbraw/zinc/01/97/72/1039019772.db2.gz HMGVDYUWKIDSEX-JOCHJYFZSA-N 2 0 349.478 4.082 20 0 EIADRP c1csc(-c2cccc(C[NH2+]C3CC[NH+](CC4CC4)CC3)c2)c1 ZINC001168360220 1039038915 /nfs/dbraw/zinc/03/89/15/1039038915.db2.gz LPSZBGARZFIUTL-UHFFFAOYSA-N 2 0 326.509 4.379 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1CCc2ccccc21 ZINC000481185241 1039087716 /nfs/dbraw/zinc/08/77/16/1039087716.db2.gz WNSHJXDLVADSTJ-JZWVFAODSA-N 2 0 334.507 4.217 20 0 EIADRP CC(C)c1nn(-c2ccccc2)cc1C[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000414816083 1039099932 /nfs/dbraw/zinc/09/99/32/1039099932.db2.gz ZFVJLWDJXSDTOV-KRWDZBQOSA-N 2 0 348.494 4.305 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CCCCc2ccc(Cl)s2)[C@@H]2CCC[C@@H]21 ZINC000552052886 1039106430 /nfs/dbraw/zinc/10/64/30/1039106430.db2.gz IUMLOVMOTVXYCR-JYJNAYRXSA-N 2 0 326.937 4.187 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(c2cccc(Cl)c2F)CCCC1 ZINC000477861498 1039143912 /nfs/dbraw/zinc/14/39/12/1039143912.db2.gz NOAWQAHFHZGAKD-PBHICJAKSA-N 2 0 338.898 4.221 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CC2(c3ccccn3)CCC2)CC1 ZINC000552099519 1039158729 /nfs/dbraw/zinc/15/87/29/1039158729.db2.gz LLIRUVLYCGTCOQ-UYAOXDASSA-N 2 0 341.543 4.136 20 0 EIADRP COc1cc([C@H](C)[NH2+]CC(C)(C)C[NH+]2CCCC2)ccc1SC ZINC000477934123 1039223762 /nfs/dbraw/zinc/22/37/62/1039223762.db2.gz UGBZTMIYRVOWFT-HNNXBMFYSA-N 2 0 336.545 4.190 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(C)cc1 ZINC000481310541 1039260523 /nfs/dbraw/zinc/26/05/23/1039260523.db2.gz OJMJQQZMVBKEGM-NRFANRHFSA-N 2 0 326.484 4.176 20 0 EIADRP C[C@H](C[NH2+][C@H](C)c1ccc(OCC(F)(F)F)cc1)C[NH+]1CCCC1 ZINC000481330926 1039306818 /nfs/dbraw/zinc/30/68/18/1039306818.db2.gz FBFBXJPYSBFVSZ-HUUCEWRRSA-N 2 0 344.421 4.010 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2F ZINC000513863839 1039326873 /nfs/dbraw/zinc/32/68/73/1039326873.db2.gz MSJYBGFNYCEWLY-OAQYLSRUSA-N 2 0 326.459 4.443 20 0 EIADRP C[N@H+](CCC[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1)C1CCCCC1 ZINC000534351248 1039338970 /nfs/dbraw/zinc/33/89/70/1039338970.db2.gz TWLFGMAGANENQH-UGKGYDQZSA-N 2 0 344.543 4.399 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)c(C)s1 ZINC000122288356 1039641100 /nfs/dbraw/zinc/64/11/00/1039641100.db2.gz NPYWODNQWKHXPV-OAHLLOKOSA-N 2 0 332.513 4.156 20 0 EIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccc(Cl)c(Cl)c3)C2)CC1 ZINC000555801182 1039642709 /nfs/dbraw/zinc/64/27/09/1039642709.db2.gz LNHNTRLMLQUUQK-HNNXBMFYSA-N 2 0 327.299 4.157 20 0 EIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3ccc(Cl)c4cccnc34)C2)CC1 ZINC000555803552 1039654999 /nfs/dbraw/zinc/65/49/99/1039654999.db2.gz YUMNBEQYILGXJT-MRXNPFEDSA-N 2 0 343.902 4.052 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H](c2cccnc2)C2CCC2)CC1 ZINC000481637197 1039668422 /nfs/dbraw/zinc/66/84/22/1039668422.db2.gz CUENAVGSUBJGBS-NRFANRHFSA-N 2 0 329.532 4.271 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc(C)ccc1OC ZINC000093371653 1039675598 /nfs/dbraw/zinc/67/55/98/1039675598.db2.gz DCPHHIDSZGTJSH-HXUWFJFHSA-N 2 0 326.484 4.306 20 0 EIADRP CCc1ccc([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1 ZINC000481718389 1039773828 /nfs/dbraw/zinc/77/38/28/1039773828.db2.gz AEVPBSOSUSIAEV-QGZVFWFLSA-N 2 0 326.484 4.040 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC000122785774 1039790360 /nfs/dbraw/zinc/79/03/60/1039790360.db2.gz JQWKXCYECGYVQC-AWEZNQCLSA-N 2 0 326.431 4.061 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCc2ccccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000505465510 1039804177 /nfs/dbraw/zinc/80/41/77/1039804177.db2.gz VRNJWMOSSZGMJE-NYVOZVTQSA-N 2 0 334.507 4.217 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1cn2ccccc2n1 ZINC000550886674 1039811777 /nfs/dbraw/zinc/81/17/77/1039811777.db2.gz PYVGPWOGZDNTKS-GOSISDBHSA-N 2 0 348.494 4.171 20 0 EIADRP CCc1ncc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)s1 ZINC000537659944 1039873191 /nfs/dbraw/zinc/87/31/91/1039873191.db2.gz UEOGOVRALHRFQK-MRXNPFEDSA-N 2 0 335.561 4.182 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccccc1-c1ccc(Cl)cc1 ZINC000481923496 1039899065 /nfs/dbraw/zinc/89/90/65/1039899065.db2.gz OQOFGLIBMMFBKR-YWZLYKJASA-N 2 0 328.887 4.437 20 0 EIADRP COc1cc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)ccc1OC(C)C ZINC000535082370 1039920520 /nfs/dbraw/zinc/92/05/20/1039920520.db2.gz XUTWWTLPARDSJW-UHFFFAOYSA-N 2 0 348.531 4.035 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+](C)C)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000481974951 1039925443 /nfs/dbraw/zinc/92/54/43/1039925443.db2.gz QGWIVHRRTXPUQS-CHWSQXEVSA-N 2 0 333.303 4.081 20 0 EIADRP C[C@H](CC[NH+](C)C)N[C@H](C)c1ccc2ccccc2c1OC(F)F ZINC000481962677 1039926965 /nfs/dbraw/zinc/92/69/65/1039926965.db2.gz PXLDXRCXIUKOJG-ZIAGYGMSSA-N 2 0 336.426 4.432 20 0 EIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000481993205 1039934590 /nfs/dbraw/zinc/93/45/90/1039934590.db2.gz NFLREKCARUUOIB-CQSZACIVSA-N 2 0 340.433 4.100 20 0 EIADRP C[C@H](c1ncc(-c2ccccc2)o1)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123216917 1039960376 /nfs/dbraw/zinc/96/03/76/1039960376.db2.gz TYJSXDHCGYHDDS-QGZVFWFLSA-N 2 0 341.499 4.456 20 0 EIADRP CC(C)=CCC[C@@H](C)CC[NH+]1CCN(CC[N@H+]2[C@H](C)CC[C@@H]2C)CC1 ZINC000482141710 1040050459 /nfs/dbraw/zinc/05/04/59/1040050459.db2.gz KXFSMXPDTQZBGV-VSKRKVRLSA-N 2 0 349.607 4.249 20 0 EIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@H]1CCCCC12CCCC2 ZINC000551197210 1040058118 /nfs/dbraw/zinc/05/81/18/1040058118.db2.gz CTXTUSNEXGFWER-FQEVSTJZSA-N 2 0 345.531 4.005 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)[C@@]1(C)CCCO1 ZINC000551268551 1040133618 /nfs/dbraw/zinc/13/36/18/1040133618.db2.gz XYHOSQDLBSAECN-DBXWQHBBSA-N 2 0 330.516 4.108 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2c3cc(F)ccc3C[C@@H]2C)c1 ZINC000482323920 1040166229 /nfs/dbraw/zinc/16/62/29/1040166229.db2.gz UJJGFRKNQMULGQ-BTYIYWSLSA-N 2 0 326.459 4.301 20 0 EIADRP C[NH+]1CCC(CC[NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000482347305 1040191103 /nfs/dbraw/zinc/19/11/03/1040191103.db2.gz CUPYIMDZGQPITP-MRXNPFEDSA-N 2 0 327.299 4.302 20 0 EIADRP COc1ccc([C@H]2CCCC[C@@H]2[NH2+]CCC2CC[NH+](C)CC2)cc1F ZINC000482358709 1040196237 /nfs/dbraw/zinc/19/62/37/1040196237.db2.gz NGKIQFJMPDBBNI-QUCCMNQESA-N 2 0 348.506 4.182 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]CCC2CC[NH+](C)CC2)cc1OC ZINC000482356766 1040196253 /nfs/dbraw/zinc/19/62/53/1040196253.db2.gz WRQORLSMVUYHDB-KRWDZBQOSA-N 2 0 348.531 4.257 20 0 EIADRP CC[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccccc1Br ZINC000482353474 1040202462 /nfs/dbraw/zinc/20/24/62/1040202462.db2.gz QFFKJCWCJWPKPT-QGZVFWFLSA-N 2 0 339.321 4.222 20 0 EIADRP Cc1ccc([C@@H]([NH2+]CCCN2CCC(O)CC2)C2CCCCC2)cc1 ZINC000479277108 1040233030 /nfs/dbraw/zinc/23/30/30/1040233030.db2.gz IXNKTARTAXXCKN-QFIPXVFZSA-N 2 0 344.543 4.053 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C/C(C)=C/c2cccc(C(F)(F)F)c2)C1 ZINC000514812798 1040262237 /nfs/dbraw/zinc/26/22/37/1040262237.db2.gz UEQQHFQKQQGNJF-OBHPCNEJSA-N 2 0 340.433 4.430 20 0 EIADRP Cc1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000482455388 1040264653 /nfs/dbraw/zinc/26/46/53/1040264653.db2.gz YMTMZFLTWBKIGT-REWPJTCUSA-N 2 0 334.507 4.137 20 0 EIADRP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]CC1CC[NH+](C)CC1 ZINC000482552734 1040340317 /nfs/dbraw/zinc/34/03/17/1040340317.db2.gz KAPKFYPMVOKHRR-MRXNPFEDSA-N 2 0 326.937 4.142 20 0 EIADRP FC(F)(F)c1cccc(CCCC[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)c1 ZINC000666993939 1040375633 /nfs/dbraw/zinc/37/56/33/1040375633.db2.gz VGKZWZIJALXOTR-KRWDZBQOSA-N 2 0 340.433 4.292 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995347 1040403485 /nfs/dbraw/zinc/40/34/85/1040403485.db2.gz KPBCCIVWCZSQBF-PBHICJAKSA-N 2 0 340.433 4.291 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C/C(C)=C\c2ccccc2OC(F)F)C1 ZINC000515020054 1040420405 /nfs/dbraw/zinc/42/04/05/1040420405.db2.gz MSXKPCDSPVCMGH-QZFKAFNDSA-N 2 0 338.442 4.013 20 0 EIADRP Fc1ccc(-c2ccc(C[NH2+][C@@H]3CC[NH2+]C4(CCC4)C3)s2)cc1 ZINC000666998516 1040420582 /nfs/dbraw/zinc/42/05/82/1040420582.db2.gz YCORIRMSGPXENZ-MRXNPFEDSA-N 2 0 330.472 4.319 20 0 EIADRP CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551572364 1040420778 /nfs/dbraw/zinc/42/07/78/1040420778.db2.gz IWOWZDWQTVLZHI-NQIIRXRSSA-N 2 0 330.516 4.218 20 0 EIADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccccc1OCc1ccccc1 ZINC000539507424 1040486963 /nfs/dbraw/zinc/48/69/63/1040486963.db2.gz NHGFOPPWVAPIHX-SFHVURJKSA-N 2 0 336.479 4.178 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH+]2CCC(CC[NH+](C)C)CC2)cc1 ZINC000667543995 1040614775 /nfs/dbraw/zinc/61/47/75/1040614775.db2.gz SMZGNJFDINAXHK-UHFFFAOYSA-N 2 0 343.540 4.282 20 0 EIADRP CN(Cc1ccccc1)[C@H](C[NH2+]Cc1cccc2[nH]ccc21)C1CC1 ZINC000479870926 1040731869 /nfs/dbraw/zinc/73/18/69/1040731869.db2.gz CVDJUVIMVBENGI-JOCHJYFZSA-N 2 0 333.479 4.168 20 0 EIADRP Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000504893367 1040733932 /nfs/dbraw/zinc/73/39/32/1040733932.db2.gz DTTBYTDDZPZHRO-UWJYYQICSA-N 2 0 338.495 4.274 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H]2CC(C)(C)c3ccccc32)ccc1F ZINC000483147264 1040734689 /nfs/dbraw/zinc/73/46/89/1040734689.db2.gz RYSKCMWGGQAZTL-HXUWFJFHSA-N 2 0 326.459 4.400 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CSc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000483157365 1040740728 /nfs/dbraw/zinc/74/07/28/1040740728.db2.gz RNYDWRSXSDZQCV-DNVCBOLYSA-N 2 0 342.508 4.125 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCCN(C)[C@H]1c1ccc(C(F)(F)F)cc1)C1CC1 ZINC000483170759 1040755093 /nfs/dbraw/zinc/75/50/93/1040755093.db2.gz ABWYIOOICXBBPA-OWQGQXMQSA-N 2 0 340.433 4.476 20 0 EIADRP Cc1ccc(C[C@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)s1 ZINC000483312903 1040815170 /nfs/dbraw/zinc/81/51/70/1040815170.db2.gz WMHFHLAZUJDAEE-DOTOQJQBSA-N 2 0 346.540 4.279 20 0 EIADRP Cc1ncsc1CN(Cc1ccc(C(C)C)cc1)C[C@@H]1CC[NH2+]C1 ZINC000436056109 1040842310 /nfs/dbraw/zinc/84/23/10/1040842310.db2.gz YMIPFNPGQUBLBO-GOSISDBHSA-N 2 0 343.540 4.187 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c2ccccc21 ZINC000537937141 1040899687 /nfs/dbraw/zinc/89/96/87/1040899687.db2.gz XYRHVBBGZROBQD-OAQYLSRUSA-N 2 0 335.495 4.310 20 0 EIADRP CCN1CCC[C@@H]1C[NH2+][C@@H](C)c1ccc(SCC(F)F)cc1 ZINC000480089327 1040926668 /nfs/dbraw/zinc/92/66/68/1040926668.db2.gz HFZBJLNIILNJHZ-DZGCQCFKSA-N 2 0 328.472 4.179 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000462796986 1040950667 /nfs/dbraw/zinc/95/06/67/1040950667.db2.gz ALEGNUVKWCEITL-YUXAGFNASA-N 2 0 344.543 4.212 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(COc3ccccc3)cc2)[C@@H](C)C1 ZINC000537989798 1040965250 /nfs/dbraw/zinc/96/52/50/1040965250.db2.gz FCLMZIYQTIDAFK-PGRDOPGGSA-N 2 0 338.495 4.086 20 0 EIADRP C[C@@H](C[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1)Cc1cccs1 ZINC000483748820 1040998916 /nfs/dbraw/zinc/99/89/16/1040998916.db2.gz WPWKFRSQHNKBTI-IAGOWNOFSA-N 2 0 346.540 4.218 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)ccc1F ZINC000436255593 1041010488 /nfs/dbraw/zinc/01/04/88/1041010488.db2.gz YAXLLKDGJQGNLH-QUCCMNQESA-N 2 0 326.459 4.313 20 0 EIADRP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000480170118 1041030492 /nfs/dbraw/zinc/03/04/92/1041030492.db2.gz XVXNOWSEXRVFKO-ZHRRBRCNSA-N 2 0 338.470 4.445 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccc(Sc2ccc(F)cc2)cc1 ZINC000538097057 1041044698 /nfs/dbraw/zinc/04/46/98/1041044698.db2.gz OHMYDKFSQMEMBG-MGPUTAFESA-N 2 0 344.499 4.407 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cc3c(cccc3F)[nH]2)cc1 ZINC000436276819 1041048622 /nfs/dbraw/zinc/04/86/22/1041048622.db2.gz VCKFYFADFOOEMJ-UHFFFAOYSA-N 2 0 339.458 4.439 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@@H](C[NH2+][C@@H](c3ccccc3)C3CC3)C2)cc1 ZINC000538103103 1041059272 /nfs/dbraw/zinc/05/92/72/1041059272.db2.gz UCVDGXKNAXNMFA-REWPJTCUSA-N 2 0 334.507 4.292 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1(c2ccccc2)CC1 ZINC000480208930 1041081463 /nfs/dbraw/zinc/08/14/63/1041081463.db2.gz LDRZBTVZHNGRJS-SIKLNZKXSA-N 2 0 334.507 4.218 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1nc2c(s1)CCCC2 ZINC000540083802 1041103794 /nfs/dbraw/zinc/10/37/94/1041103794.db2.gz KBAYEMORCRGJAB-HZPDHXFCSA-N 2 0 335.561 4.327 20 0 EIADRP Cc1ccccc1O[C@@H]1CCCC[C@H]1[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000538193725 1041158886 /nfs/dbraw/zinc/15/88/86/1041158886.db2.gz CDXDNKAIVPTZQF-IFMALSPDSA-N 2 0 342.527 4.149 20 0 EIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)c(F)c1 ZINC000540137281 1041181879 /nfs/dbraw/zinc/18/18/79/1041181879.db2.gz SBOBQVQARUXJFB-AWEZNQCLSA-N 2 0 347.865 4.441 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccc(SCC(F)F)cc1 ZINC000515846162 1041186345 /nfs/dbraw/zinc/18/63/45/1041186345.db2.gz HVIPYWILICWDEB-ZDUSSCGKSA-N 2 0 336.451 4.353 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)c(OC)c1 ZINC000484297505 1041200182 /nfs/dbraw/zinc/20/01/82/1041200182.db2.gz IKJSXBYARDXWKM-QGZVFWFLSA-N 2 0 348.531 4.113 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000540150163 1041200045 /nfs/dbraw/zinc/20/00/45/1041200045.db2.gz CBIUQHJIFFEVLH-HOTGVXAUSA-N 2 0 340.458 4.307 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](CCC(C)C)CC1)CC2 ZINC000484296562 1041200685 /nfs/dbraw/zinc/20/06/85/1041200685.db2.gz QTJXYKAAXCATCV-NRFANRHFSA-N 2 0 330.516 4.030 20 0 EIADRP C[C@H]([NH2+]Cc1cc2c(cccc2F)[nH]1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000436399956 1041203900 /nfs/dbraw/zinc/20/39/00/1041203900.db2.gz GUVWAWGODCBOAG-LSDHHAIUSA-N 2 0 329.463 4.050 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC(C)(C)c1c(F)cccc1Cl ZINC000540188952 1041231071 /nfs/dbraw/zinc/23/10/71/1041231071.db2.gz MXWPAJHLSJZFEN-XJKCOSOUSA-N 2 0 326.887 4.075 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3scnc3C)cc2)[C@H](C)C1 ZINC000667666258 1041238293 /nfs/dbraw/zinc/23/82/93/1041238293.db2.gz HJKDVEFSROVGCN-BEFAXECRSA-N 2 0 343.540 4.281 20 0 EIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCCC(C)(C)C)c1ccccc1O2 ZINC000538295099 1041246588 /nfs/dbraw/zinc/24/65/88/1041246588.db2.gz YIGOWHYRAUUDSO-SFHVURJKSA-N 2 0 330.516 4.391 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccc(Oc2ccc(F)cc2)cc1 ZINC000480445711 1041304964 /nfs/dbraw/zinc/30/49/64/1041304964.db2.gz OMUYKTOXCRVFEZ-QRWLVFNGSA-N 2 0 328.431 4.048 20 0 EIADRP C[N@H+](C[C@@H]1C[C@H]1c1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000463089036 1041326521 /nfs/dbraw/zinc/32/65/21/1041326521.db2.gz PGEYQDXHYOLBLN-PMVMPFDFSA-N 2 0 334.507 4.244 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2cccc(OCC3CCCCC3)c2)CC[N@@H+]1C ZINC000538411214 1041330331 /nfs/dbraw/zinc/33/03/31/1041330331.db2.gz XUYZHNNVBKUPNU-YLJYHZDGSA-N 2 0 330.516 4.218 20 0 EIADRP c1c2ccccc2oc1CC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463129070 1041351571 /nfs/dbraw/zinc/35/15/71/1041351571.db2.gz ITIVYUVQCHGYOY-UHFFFAOYSA-N 2 0 348.490 4.272 20 0 EIADRP CC(C)[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000540302937 1041355551 /nfs/dbraw/zinc/35/55/51/1041355551.db2.gz WMRLMJXLVNKPBE-YOEHRIQHSA-N 2 0 328.422 4.334 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCCOC2CCCCC2)CCN1Cc1ccccc1 ZINC000463140782 1041360198 /nfs/dbraw/zinc/36/01/98/1041360198.db2.gz IILQDPBXVWTRJA-CTNGQTDRSA-N 2 0 344.543 4.369 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000554738726 1041369637 /nfs/dbraw/zinc/36/96/37/1041369637.db2.gz YZJWUCFVBKEBSW-LJQANCHMSA-N 2 0 325.500 4.175 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@H]2CCCc3nn(-c4ccccc4)cc32)cc1 ZINC000643514088 1041425969 /nfs/dbraw/zinc/42/59/69/1041425969.db2.gz VIONZFNEGGVANK-KKSFZXQISA-N 2 0 346.478 4.059 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(OC(F)F)cc1 ZINC000480629485 1041432274 /nfs/dbraw/zinc/43/22/74/1041432274.db2.gz DVGRKGHDZNNMQG-HZPDHXFCSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1cc(F)c(F)c(F)c1 ZINC000480630605 1041433964 /nfs/dbraw/zinc/43/39/64/1041433964.db2.gz KOSYQUUAICONBP-UONOGXRCSA-N 2 0 328.422 4.409 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccccc1OC(F)F ZINC000480618616 1041436299 /nfs/dbraw/zinc/43/62/99/1041436299.db2.gz TZBGZKUIYRRMAZ-HOTGVXAUSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc(OC(F)F)cc1 ZINC000480642875 1041442678 /nfs/dbraw/zinc/44/26/78/1041442678.db2.gz NGWYLMOCFLRDQJ-INIZCTEOSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(-n2cccn2)cc1 ZINC000480631814 1041444681 /nfs/dbraw/zinc/44/46/81/1041444681.db2.gz QXAXBFPIROSAGF-RBUKOAKNSA-N 2 0 340.515 4.178 20 0 EIADRP CSc1cccc([C@H]([NH2+]C2CC(C[NH3+])C2)c2cc(F)ccc2F)c1 ZINC000904362650 1041450321 /nfs/dbraw/zinc/45/03/21/1041450321.db2.gz QKBFXRAMIAWVHK-JBAZFKOSSA-N 2 0 348.462 4.103 20 0 EIADRP Cc1sc([C@H](C)[NH2+]C[C@H]2C[C@@H]([NH3+])C2)nc1-c1ccc(Cl)cc1 ZINC000904364639 1041459495 /nfs/dbraw/zinc/45/94/95/1041459495.db2.gz ZWFQDZZVCQTNKY-ITDIGPHOSA-N 2 0 335.904 4.160 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1F ZINC000480714267 1041494483 /nfs/dbraw/zinc/49/44/83/1041494483.db2.gz YGMDWABIOPVABH-LXZJYRNTSA-N 2 0 346.490 4.077 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1F ZINC000480714269 1041494938 /nfs/dbraw/zinc/49/49/38/1041494938.db2.gz YGMDWABIOPVABH-XSYGEPLQSA-N 2 0 346.490 4.077 20 0 EIADRP CC[C@H](CSc1ccc(Cl)cc1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000480733989 1041496450 /nfs/dbraw/zinc/49/64/50/1041496450.db2.gz BLHRAZKPJLFGAW-ZACQAIPSSA-N 2 0 338.948 4.427 20 0 EIADRP C[C@@H]1C[NH+](CCCCC[N@@H+]2CCC(F)(F)[C@@H](C)C2)CCC1(F)F ZINC000554946420 1041507351 /nfs/dbraw/zinc/50/73/51/1041507351.db2.gz SPUVNLAKEKBEGA-GASCZTMLSA-N 2 0 338.433 4.111 20 0 EIADRP Cc1cccc(COc2ccc(C[NH2+][C@H]3CC[N@@H+](C)C[C@@H]3C)cc2)c1 ZINC000480753973 1041509754 /nfs/dbraw/zinc/50/97/54/1041509754.db2.gz COSKOHGXJMVQEU-AVRDEDQJSA-N 2 0 338.495 4.004 20 0 EIADRP C[N@H+]1CC=C(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)s2)CC1 ZINC000540644250 1041584611 /nfs/dbraw/zinc/58/46/11/1041584611.db2.gz GTEQEIOGLGGPRH-UHFFFAOYSA-N 2 0 332.900 4.420 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000540708627 1041606773 /nfs/dbraw/zinc/60/67/73/1041606773.db2.gz ZMGCHYBLRFFWJO-ROUUACIJSA-N 2 0 338.417 4.193 20 0 EIADRP [NH3+]CC1CCC([NH2+][C@H](Cc2ccc(Cl)cc2)c2ccccn2)CC1 ZINC000516964694 1041829243 /nfs/dbraw/zinc/82/92/43/1041829243.db2.gz ZSPFCDBTZJWZCY-OUNSHVDWSA-N 2 0 343.902 4.126 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCCc3cc(N)ccc32)CC1 ZINC000414910773 1041869748 /nfs/dbraw/zinc/86/97/48/1041869748.db2.gz CSBFVBOVHXPIBX-NPFVIJTESA-N 2 0 341.543 4.279 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccc(OCc2ccccc2)cc1 ZINC000301219594 1041897549 /nfs/dbraw/zinc/89/75/49/1041897549.db2.gz XUHYYTOYZQVADR-SFHVURJKSA-N 2 0 326.484 4.258 20 0 EIADRP Cc1ccc2cc(C[NH2+]C[C@H]3CCC[N@@H+](CC(C)C)C3)ccc2n1 ZINC000437775698 1041906792 /nfs/dbraw/zinc/90/67/92/1041906792.db2.gz OBRQKVGMCCFAQU-LJQANCHMSA-N 2 0 325.500 4.001 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc(C)c3ncccc3c2)CC1 ZINC000541536890 1042000613 /nfs/dbraw/zinc/00/06/13/1042000613.db2.gz BWQGIKHQAAOJNS-UHFFFAOYSA-N 2 0 339.527 4.487 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@H](c2ccco2)c2ccccc2)C1 ZINC000541549252 1042006311 /nfs/dbraw/zinc/00/63/11/1042006311.db2.gz PWOUUFIZYRXYQX-NQIIRXRSSA-N 2 0 326.484 4.471 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C[C@H](C)C[NH+](C)C ZINC000425940903 1042017443 /nfs/dbraw/zinc/01/74/43/1042017443.db2.gz IMTSLCUOQVCUBP-QWHCGFSZSA-N 2 0 335.492 4.106 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCn1c2ccccc2c2ccccc21 ZINC000541571133 1042019406 /nfs/dbraw/zinc/01/94/06/1042019406.db2.gz OSXMEAVDWABZPZ-HLIPFELVSA-N 2 0 335.495 4.113 20 0 EIADRP Cc1ccc2cc(C[NH2+]CCCN3CCc4ccccc4C3)ccc2n1 ZINC000438061448 1042034323 /nfs/dbraw/zinc/03/43/23/1042034323.db2.gz AXJOGHVMRLUGAC-UHFFFAOYSA-N 2 0 345.490 4.081 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21)CC(F)(F)F ZINC000402796797 1042041020 /nfs/dbraw/zinc/04/10/20/1042041020.db2.gz VYJVFJGJJHIOAA-LEUOFYLZSA-N 2 0 340.433 4.075 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12)CC(F)(F)F ZINC000402796795 1042041061 /nfs/dbraw/zinc/04/10/61/1042041061.db2.gz VYJVFJGJJHIOAA-DZOHQFGASA-N 2 0 340.433 4.075 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCCc2nc(-c3ccccc3F)sc21)C[NH+](C)C ZINC000425955490 1042078454 /nfs/dbraw/zinc/07/84/54/1042078454.db2.gz ZYPGDKRCFKQRHJ-CZUORRHYSA-N 2 0 347.503 4.114 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](CSC)c2ccc(C(F)(F)F)cc2)C1 ZINC000541916181 1042179302 /nfs/dbraw/zinc/17/93/02/1042179302.db2.gz DTIGOMLQKZAYKM-XJKSGUPXSA-N 2 0 346.462 4.041 20 0 EIADRP C[C@@H](c1ccc(F)cc1)[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464832144 1042189365 /nfs/dbraw/zinc/18/93/65/1042189365.db2.gz BVJFWQIOWBYLJM-HKUYNNGSSA-N 2 0 326.459 4.341 20 0 EIADRP C[N@@H+](Cc1ccc2c(c1)CCC2)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464845032 1042193506 /nfs/dbraw/zinc/19/35/06/1042193506.db2.gz DBJBIYJEJOWZDS-OAQYLSRUSA-N 2 0 334.507 4.129 20 0 EIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](CCCOc3ccc(F)cc3)C2)CC1 ZINC000302998424 1042231747 /nfs/dbraw/zinc/23/17/47/1042231747.db2.gz HIOGYLUKGIXUTF-IBGZPJMESA-N 2 0 348.506 4.039 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H](c2ccccc2)C2CCCCC2)CC1 ZINC000542086014 1042272892 /nfs/dbraw/zinc/27/28/92/1042272892.db2.gz OZAOYLNYLOMPSX-JOCHJYFZSA-N 2 0 344.543 4.399 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]Cc3cccc4cc[nH]c43)CC2)C1 ZINC000467373545 1042298765 /nfs/dbraw/zinc/29/87/65/1042298765.db2.gz NKAYFJFVANAOGS-OXQOHEQNSA-N 2 0 325.500 4.301 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]C1CC[NH+](CC(C)C)CC1)CC3 ZINC000491342142 1042407692 /nfs/dbraw/zinc/40/76/92/1042407692.db2.gz HVTQLOQXCANIJL-SFHVURJKSA-N 2 0 339.527 4.044 20 0 EIADRP CC(C)[N@H+](C)CCCN[C@@H](c1ccc(Br)s1)C1CC1 ZINC000439142960 1042518184 /nfs/dbraw/zinc/51/81/84/1042518184.db2.gz QWNXBVYHOSVYAX-OAHLLOKOSA-N 2 0 345.350 4.282 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000518763531 1042670922 /nfs/dbraw/zinc/67/09/22/1042670922.db2.gz TYBOLNYKFNIWKA-UHFFFAOYSA-N 2 0 344.421 4.187 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ccc(Cl)c(F)c2)C1 ZINC000518763479 1042673180 /nfs/dbraw/zinc/67/31/80/1042673180.db2.gz OKRCHJVIQMWFRP-GJZGRUSLSA-N 2 0 326.887 4.327 20 0 EIADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000493897354 1042980300 /nfs/dbraw/zinc/98/03/00/1042980300.db2.gz NOUYNRSJRKELIV-XMSQKQJNSA-N 2 0 338.495 4.148 20 0 EIADRP CCc1cccc(Cl)c1C[NH2+]Cc1ccc(C[NH+](C)C)c(F)c1 ZINC000474004390 1042994043 /nfs/dbraw/zinc/99/40/43/1042994043.db2.gz FZRYICACOZUYNR-UHFFFAOYSA-N 2 0 334.866 4.393 20 0 EIADRP C[C@H]1CC([NH2+]CCc2ccccc2F)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168006335 1043000561 /nfs/dbraw/zinc/00/05/61/1043000561.db2.gz NGLQBQVYLWRGFF-ROUUACIJSA-N 2 0 340.486 4.399 20 0 EIADRP C[C@H]1CC(n2c3ccccc3nc2C[NH3+])C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168007390 1043016662 /nfs/dbraw/zinc/01/66/62/1043016662.db2.gz RVXLTIIIXJXPQS-IRXDYDNUSA-N 2 0 348.494 4.109 20 0 EIADRP C[C@H]1CC([NH2+]CCc2cccc(F)c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168007487 1043017878 /nfs/dbraw/zinc/01/78/78/1043017878.db2.gz SHPMFKFOBGFGKX-ROUUACIJSA-N 2 0 340.486 4.399 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1c(Cl)cccc1Cl ZINC000166447540 1043085022 /nfs/dbraw/zinc/08/50/22/1043085022.db2.gz WPZSKDNJVNHWPM-MGPQQGTHSA-N 2 0 327.299 4.313 20 0 EIADRP Cc1ccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1F ZINC000310140054 1043108584 /nfs/dbraw/zinc/10/85/84/1043108584.db2.gz CBUNRBMGOOIFPI-HXUWFJFHSA-N 2 0 326.459 4.136 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(OCC(F)F)c1)c1cccc(C[NH+](C)C)c1 ZINC000925364636 1043185922 /nfs/dbraw/zinc/18/59/22/1043185922.db2.gz PFHDDSQWLRUUAB-OAHLLOKOSA-N 2 0 348.437 4.243 20 0 EIADRP FC(F)(F)C1CCC(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)CC1 ZINC000185522403 1043193129 /nfs/dbraw/zinc/19/31/29/1043193129.db2.gz WIUANNIINMIKRO-CSKOPFHVSA-N 2 0 344.465 4.304 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000507954984 1043203946 /nfs/dbraw/zinc/20/39/46/1043203946.db2.gz YIKBCNMZHLDJDG-UHFFFAOYSA-N 2 0 344.421 4.139 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2[nH]ccc2c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311138181 1043225250 /nfs/dbraw/zinc/22/52/50/1043225250.db2.gz YESBTBOHVFOTRS-UTKZUKDTSA-N 2 0 333.479 4.168 20 0 EIADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000727468176 1043227550 /nfs/dbraw/zinc/22/75/50/1043227550.db2.gz GFTPCDLQTXKCCT-QFIPXVFZSA-N 2 0 338.495 4.103 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2sccc2OC)c1 ZINC000186114442 1043246315 /nfs/dbraw/zinc/24/63/15/1043246315.db2.gz BGKNTSXVYSBXAI-HNNXBMFYSA-N 2 0 332.513 4.449 20 0 EIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]CC1([NH3+])CCCC1 ZINC000665249772 1043261894 /nfs/dbraw/zinc/26/18/94/1043261894.db2.gz YVAJOTAPZUHDQC-NWDGAFQWSA-N 2 0 331.287 4.010 20 0 EIADRP CCCC[N@H+](C)CCCNC1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168012144 1043417250 /nfs/dbraw/zinc/41/72/50/1043417250.db2.gz WWWWPYMMZRNMTK-PMACEKPBSA-N 2 0 345.575 4.140 20 0 EIADRP C[C@@H]1C[C@@H](Nc2ccc(CC[NH3+])cc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168012381 1043424315 /nfs/dbraw/zinc/42/43/15/1043424315.db2.gz ZHGCVKMRMZVSOY-OPMZPASUSA-N 2 0 337.511 4.041 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CCSc3c(F)cccc32)cc1 ZINC000171128893 1043451866 /nfs/dbraw/zinc/45/18/66/1043451866.db2.gz AOZASJUTIPUEDN-GOSISDBHSA-N 2 0 330.472 4.214 20 0 EIADRP COCC(C)(C)C[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000494377676 1043456876 /nfs/dbraw/zinc/45/68/76/1043456876.db2.gz ZINIDKWVCICTGQ-UHFFFAOYSA-N 2 0 340.511 4.177 20 0 EIADRP Cc1cscc1C[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12 ZINC000494465827 1043498752 /nfs/dbraw/zinc/49/87/52/1043498752.db2.gz NYCQACMNNREOKP-YZGWKJHDSA-N 2 0 326.509 4.057 20 0 EIADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1cccc(Oc2ccccn2)c1 ZINC000922160804 1043724731 /nfs/dbraw/zinc/72/47/31/1043724731.db2.gz XJRWDLLXSXWSKU-UHFFFAOYSA-N 2 0 327.472 4.084 20 0 EIADRP CC(C)CC[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccoc1 ZINC000658069243 1043739818 /nfs/dbraw/zinc/73/98/18/1043739818.db2.gz DTDFWYOFADFOIY-OAQYLSRUSA-N 2 0 348.531 4.238 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000191019101 1043764092 /nfs/dbraw/zinc/76/40/92/1043764092.db2.gz ZMTOUURPIPFELT-BJLQDIEVSA-N 2 0 334.548 4.111 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)CCS2 ZINC000191488725 1043820692 /nfs/dbraw/zinc/82/06/92/1043820692.db2.gz WPDAWSOFVYQZCZ-INIZCTEOSA-N 2 0 334.529 4.131 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2Cc3[nH]c4ccccc4c3C2)c1 ZINC000442773798 1043829839 /nfs/dbraw/zinc/82/98/39/1043829839.db2.gz DBJRVCXUTIOIOU-IBGZPJMESA-N 2 0 347.506 4.265 20 0 EIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]Cc2cncc(F)c2)cc1 ZINC000494609064 1043845884 /nfs/dbraw/zinc/84/58/84/1043845884.db2.gz NGNVHSRRFLDSEQ-UHFFFAOYSA-N 2 0 349.453 4.239 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1cccc(O)c1 ZINC000442872453 1043871566 /nfs/dbraw/zinc/87/15/66/1043871566.db2.gz JNRWJFQWJJIIHR-CMKODMSKSA-N 2 0 338.495 4.344 20 0 EIADRP C[N@H+](CCc1cccc(F)c1F)C1CCN(Cc2ccccc2)CC1 ZINC000543140452 1043962310 /nfs/dbraw/zinc/96/23/10/1043962310.db2.gz MFSMEWKPPCOTPD-UHFFFAOYSA-N 2 0 344.449 4.104 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1 ZINC000443008866 1043963680 /nfs/dbraw/zinc/96/36/80/1043963680.db2.gz WBVPYZUVWWHXTF-HNNXBMFYSA-N 2 0 328.422 4.224 20 0 EIADRP C[C@H](CCCC(C)(C)O)[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168015054 1043964687 /nfs/dbraw/zinc/96/46/87/1043964687.db2.gz ONLONCYDDAXERZ-WERVVEIQSA-N 2 0 346.559 4.347 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC000544350628 1044056481 /nfs/dbraw/zinc/05/64/81/1044056481.db2.gz JUKNSHFGNDJSAF-OAQYLSRUSA-N 2 0 332.451 4.085 20 0 EIADRP CS[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)C(C)(C)C ZINC000542499928 1044243829 /nfs/dbraw/zinc/24/38/29/1044243829.db2.gz RTNWSLRFRBTEIY-BHIYHBOVSA-N 2 0 334.573 4.264 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)CCC3CC3)CC2)cc1 ZINC000469774559 1044280909 /nfs/dbraw/zinc/28/09/09/1044280909.db2.gz GRFQXVBDQJBQBA-KRWDZBQOSA-N 2 0 330.516 4.076 20 0 EIADRP C[C@@H]1CC([NH2+][C@H]2CCCc3ncccc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168020345 1044379017 /nfs/dbraw/zinc/37/90/17/1044379017.db2.gz MHNNIWZKHMIXGR-PNCHPQGNSA-N 2 0 349.522 4.490 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)Cc1ccc(Cl)cc1Cl)C1CC[NH+](C)CC1 ZINC000675801090 1044504742 /nfs/dbraw/zinc/50/47/42/1044504742.db2.gz UTSPSUZQINMYEE-QWHCGFSZSA-N 2 0 329.315 4.244 20 0 EIADRP C[C@H]1CC([NH2+]Cc2cccc3ncoc32)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168022568 1044524391 /nfs/dbraw/zinc/52/43/91/1044524391.db2.gz AGTBIRFPCIDJJJ-IRXDYDNUSA-N 2 0 349.478 4.359 20 0 EIADRP C[C@H]([NH2+][C@H](Cc1ccccc1)c1ccccc1F)C1CC[NH+](C)CC1 ZINC000675898222 1044542580 /nfs/dbraw/zinc/54/25/80/1044542580.db2.gz GLNVENRJTNQFMS-HTAPYJJXSA-N 2 0 340.486 4.429 20 0 EIADRP CS[C@H](C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1)C(C)(C)C ZINC000543412103 1044552810 /nfs/dbraw/zinc/55/28/10/1044552810.db2.gz VQRKGHXMMJSPKU-KBAYOESNSA-N 2 0 326.594 4.397 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](C/C=C/c2ccncc2)CC1 ZINC000494984908 1044570619 /nfs/dbraw/zinc/57/06/19/1044570619.db2.gz HQEDPDXVFVUXNP-FHHGHWCOSA-N 2 0 327.516 4.071 20 0 EIADRP CS[C@@H](C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1)C(C)(C)C ZINC000543426730 1044577863 /nfs/dbraw/zinc/57/78/63/1044577863.db2.gz JIEFLLTXSNFHKC-QAPCUYQASA-N 2 0 338.561 4.055 20 0 EIADRP CCC(C)(C)[NH2+][C@@H](C)C(=O)Nc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000543431811 1044592414 /nfs/dbraw/zinc/59/24/14/1044592414.db2.gz WEYWKKVUUWYXQE-KRWDZBQOSA-N 2 0 345.531 4.024 20 0 EIADRP CSCC1CCC([NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000395169775 1044617448 /nfs/dbraw/zinc/61/74/48/1044617448.db2.gz WCQVFJCAZZTGCA-GPJFCIFZSA-N 2 0 332.557 4.020 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2C)[C@H](C)C1 ZINC000443658959 1044648019 /nfs/dbraw/zinc/64/80/19/1044648019.db2.gz OMWAELMAUFEAQA-PBHICJAKSA-N 2 0 328.422 4.176 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H]2CCSc3c(F)cccc32)C1 ZINC000359943102 1044650478 /nfs/dbraw/zinc/65/04/78/1044650478.db2.gz PSPRUQWKDFYUCS-CRAIPNDOSA-N 2 0 336.520 4.464 20 0 EIADRP C[C@H]1CC(n2cc3ccc(C[NH3+])cc3n2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168025351 1044658327 /nfs/dbraw/zinc/65/83/27/1044658327.db2.gz JRGZGOTUOXNCJY-IRXDYDNUSA-N 2 0 348.494 4.109 20 0 EIADRP C[C@@H]([NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C)C1CCSCC1 ZINC000250104777 1044672358 /nfs/dbraw/zinc/67/23/58/1044672358.db2.gz RXKYLTVZANMGKX-KZNAEPCWSA-N 2 0 346.584 4.264 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2nc3ccc(F)cc3s2)C1 ZINC000428878594 1044809760 /nfs/dbraw/zinc/80/97/60/1044809760.db2.gz AMMLCHQRAQRDSW-GJZGRUSLSA-N 2 0 349.519 4.283 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2nc3ccc(F)cc3s2)CC1 ZINC000428879826 1044811227 /nfs/dbraw/zinc/81/12/27/1044811227.db2.gz DRGMPMRNZNZXOW-UHFFFAOYSA-N 2 0 335.492 4.037 20 0 EIADRP COc1cccc([C@H](CNc2cc(C)[nH+]c3ccccc23)[NH+](C)C)c1 ZINC000327289987 1044816386 /nfs/dbraw/zinc/81/63/86/1044816386.db2.gz JPJPYZZRUBOPLJ-NRFANRHFSA-N 2 0 335.451 4.267 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCCN(Cc2cccs2)C1)C(C)(C)C(F)F ZINC000657861475 1044833235 /nfs/dbraw/zinc/83/32/35/1044833235.db2.gz TVGCUDSIDLIMQX-ZIAGYGMSSA-N 2 0 330.488 4.230 20 0 EIADRP Cc1ccc([C@@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)C2CCC2)o1 ZINC000543592893 1044874065 /nfs/dbraw/zinc/87/40/65/1044874065.db2.gz JUYZEFLJLYFCJZ-NRFANRHFSA-N 2 0 342.483 4.159 20 0 EIADRP CCc1cccc(Cl)c1C[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000474350161 1044877768 /nfs/dbraw/zinc/87/77/68/1044877768.db2.gz KOYOPACLIKBWAD-UHFFFAOYSA-N 2 0 346.902 4.133 20 0 EIADRP CCN1CCC([NH2+][C@@H](Cc2ccccc2F)c2ccccc2)CC1 ZINC000429367100 1045022899 /nfs/dbraw/zinc/02/28/99/1045022899.db2.gz AQXULPYJTBGBDZ-NRFANRHFSA-N 2 0 326.459 4.183 20 0 EIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]Cc3ccc(C(C)(C)O)cc3)CC2)C1 ZINC000186605535 1045033918 /nfs/dbraw/zinc/03/39/18/1045033918.db2.gz DJWKGFPYVUETEO-UWJYYQICSA-N 2 0 344.543 4.047 20 0 EIADRP c1csc(C[N@@H+](CC2CCC3(CC3)CC2)[C@H]2CC23CC[NH2+]CC3)n1 ZINC000923347537 1045067506 /nfs/dbraw/zinc/06/75/06/1045067506.db2.gz RXDRPDSJOXGKGD-KRWDZBQOSA-N 2 0 345.556 4.058 20 0 EIADRP FC(F)(F)CC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc2c1CC[NH2+]C2 ZINC000923525604 1045149984 /nfs/dbraw/zinc/14/99/84/1045149984.db2.gz HOEVHEWAFZTYKF-FUCXHRTASA-N 2 0 338.417 4.028 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2Cc3ccccc32)CC1 ZINC000671746654 1045179764 /nfs/dbraw/zinc/17/97/64/1045179764.db2.gz QJQZRYNZIPPSIU-ITAUSPCMSA-N 2 0 334.507 4.359 20 0 EIADRP Clc1cc(C[N@@H+]2CCCC[C@H]2C2CC[NH2+]CC2)c(Cl)s1 ZINC001235152248 1045272458 /nfs/dbraw/zinc/27/24/58/1045272458.db2.gz GDSFPUFJIKAMSY-ZDUSSCGKSA-N 2 0 333.328 4.409 20 0 EIADRP C[C@H](CC[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1 ZINC000237463091 1045385596 /nfs/dbraw/zinc/38/55/96/1045385596.db2.gz REHDFNYQZCUUTD-IRLDBZIGSA-N 2 0 336.523 4.334 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cn1 ZINC000397495601 1045577896 /nfs/dbraw/zinc/57/78/96/1045577896.db2.gz AZRSEWZLSRSHES-HXUWFJFHSA-N 2 0 341.474 4.174 20 0 EIADRP CC[C@@H]([NH2+]C1CC[NH+](C2CCCC2)CC1)c1ccc2c(c1)CCCO2 ZINC000768107039 1045718692 /nfs/dbraw/zinc/71/86/92/1045718692.db2.gz LFQFHMYBHGOMCR-OAQYLSRUSA-N 2 0 342.527 4.459 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cccc(C(F)(F)F)c2)cc1 ZINC000768910259 1045858951 /nfs/dbraw/zinc/85/89/51/1045858951.db2.gz DEHZOEZRMDSKLA-UHFFFAOYSA-N 2 0 336.401 4.399 20 0 EIADRP CC[C@@H]1C[C@@H]([N@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)CCO1 ZINC001170176604 1045912987 /nfs/dbraw/zinc/91/29/87/1045912987.db2.gz AAEJAJVUHWWWJQ-AIKVAWSJSA-N 2 0 342.527 4.072 20 0 EIADRP CC[C@H]1C[C@H]([N@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170194961 1045933983 /nfs/dbraw/zinc/93/39/83/1045933983.db2.gz PHMNLCQJQTZKDF-NCYKPQTJSA-N 2 0 330.516 4.025 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@@H](C)c2cccc(Br)c2)CC1 ZINC000037150422 1046012181 /nfs/dbraw/zinc/01/21/81/1046012181.db2.gz NOEMQRQVQCTMLW-AWEZNQCLSA-N 2 0 339.321 4.364 20 0 EIADRP CC(C)O[C@@H]1C[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCCC3)c2)C1(C)C ZINC001170397921 1046031433 /nfs/dbraw/zinc/03/14/33/1046031433.db2.gz BEJGTFBTXAPIDW-NHCUHLMSSA-N 2 0 344.543 4.354 20 0 EIADRP CCc1nc(CN2CCC(C[NH2+][C@H](C)C3CCCC3)CC2)cs1 ZINC000161793208 1046036348 /nfs/dbraw/zinc/03/63/48/1046036348.db2.gz HJIZKSDJRSXEBT-OAHLLOKOSA-N 2 0 335.561 4.086 20 0 EIADRP C[NH2+]C[C@H]1CCC[N@H+](CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000262052730 1046175977 /nfs/dbraw/zinc/17/59/77/1046175977.db2.gz ZVFWEQXMRAYNRA-MRXNPFEDSA-N 2 0 344.449 4.028 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccccc1Br ZINC000123618790 1046188698 /nfs/dbraw/zinc/18/86/98/1046188698.db2.gz UISBBDFMTDUXRK-CQSZACIVSA-N 2 0 347.300 4.362 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1 ZINC000125513293 1046312776 /nfs/dbraw/zinc/31/27/76/1046312776.db2.gz KMRNHPQZTFRNGT-INIZCTEOSA-N 2 0 344.524 4.320 20 0 EIADRP Cc1ccc(C)c([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c1 ZINC000162549803 1046326139 /nfs/dbraw/zinc/32/61/39/1046326139.db2.gz HKDJZROYLLCRJT-GOSISDBHSA-N 2 0 326.484 4.095 20 0 EIADRP C[C@H](NC1(c2ccccc2F)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508717801 1046376202 /nfs/dbraw/zinc/37/62/02/1046376202.db2.gz IBOBXUSGNOHDRE-PKOBYXMFSA-N 2 0 338.470 4.315 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cccc(Cl)n2)CC1)CC1CC1 ZINC000771476275 1046408566 /nfs/dbraw/zinc/40/85/66/1046408566.db2.gz WSTBJKVLQZUBKG-UHFFFAOYSA-N 2 0 335.923 4.069 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccnc(Cl)c2)CC1)CC1CC1 ZINC000771474677 1046408938 /nfs/dbraw/zinc/40/89/38/1046408938.db2.gz BUDIAEABERQTQJ-UHFFFAOYSA-N 2 0 335.923 4.069 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(C)c(OC(F)F)c(C)c2)[C@H](C)C1 ZINC000536660003 1046629454 /nfs/dbraw/zinc/62/94/54/1046629454.db2.gz SASDIZZBPCSPCK-WBVHZDCISA-N 2 0 340.458 4.067 20 0 EIADRP CCC[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1F ZINC000459447242 1046677658 /nfs/dbraw/zinc/67/76/58/1046677658.db2.gz UKWMCXRFQNLQSS-FQEVSTJZSA-N 2 0 345.437 4.460 20 0 EIADRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2ccc(OC)c3ccccc23)C1 ZINC000536695779 1046690656 /nfs/dbraw/zinc/69/06/56/1046690656.db2.gz FOHCGYIKXYMJDF-QGZVFWFLSA-N 2 0 326.484 4.012 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCc4cc(F)ccc43)CC2)CC1 ZINC000536833673 1046809502 /nfs/dbraw/zinc/80/95/02/1046809502.db2.gz ODPZQWFTQQGBQK-GZNCHQMQSA-N 2 0 330.491 4.446 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cccc(F)c1F ZINC000536863757 1046829977 /nfs/dbraw/zinc/82/99/77/1046829977.db2.gz MSKUJLBHWZNHIN-JXFKEZNVSA-N 2 0 344.449 4.008 20 0 EIADRP C[C@H](CCCc1cccnc1)[NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1 ZINC000459645830 1046832029 /nfs/dbraw/zinc/83/20/29/1046832029.db2.gz HOZDBUYPELEKMM-WOIUINJBSA-N 2 0 343.559 4.426 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)c2c(F)cccc2Cl)[C@@H](C)C1 ZINC000536875852 1046839282 /nfs/dbraw/zinc/83/92/82/1046839282.db2.gz JFKJRTMHLMEYDP-XJKSGUPXSA-N 2 0 326.887 4.077 20 0 EIADRP C[C@H](C[NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000459725134 1046865072 /nfs/dbraw/zinc/86/50/72/1046865072.db2.gz BATFYJPYBJRHIE-HUUCEWRRSA-N 2 0 328.422 4.130 20 0 EIADRP CC(C)[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccc2[nH]c(=O)oc2c1 ZINC000536961943 1046871134 /nfs/dbraw/zinc/87/11/34/1046871134.db2.gz VMVPKWCRSKGGDB-KXBFYZLASA-N 2 0 345.487 4.085 20 0 EIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CC(C1CC1)C1CC1)c1ccccc1O2 ZINC000537191957 1047011584 /nfs/dbraw/zinc/01/15/84/1047011584.db2.gz JERSQWFUTOQNNM-FQEVSTJZSA-N 2 0 340.511 4.000 20 0 EIADRP CC(C)CCC[C@H](C)[NH+]1CCC2(CCC[N@@H+]2Cc2cnn(C)c2)CC1 ZINC001170079617 1047066513 /nfs/dbraw/zinc/06/65/13/1047066513.db2.gz DYXMDFFDFCIEHM-IBGZPJMESA-N 2 0 346.563 4.065 20 0 EIADRP CC(C)=CCOc1ccc(CC[C@@H](C)[NH2+]CC2=CC[N@H+](C)CC2)cc1 ZINC000537305199 1047084685 /nfs/dbraw/zinc/08/46/85/1047084685.db2.gz HAYSKWGVBQGOSE-LJQANCHMSA-N 2 0 342.527 4.204 20 0 EIADRP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+]CC2=CC[N@H+](C)CC2)cc1 ZINC000537305198 1047086510 /nfs/dbraw/zinc/08/65/10/1047086510.db2.gz HAYSKWGVBQGOSE-IBGZPJMESA-N 2 0 342.527 4.204 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](c2ccc(F)cn2)C(C)C)c1 ZINC000497816901 1047097725 /nfs/dbraw/zinc/09/77/25/1047097725.db2.gz KHKGCHQRZDNNSE-FQEVSTJZSA-N 2 0 329.463 4.159 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)Nc2cc(C)ccn2)ccc1OC ZINC000537406374 1047199773 /nfs/dbraw/zinc/19/97/73/1047199773.db2.gz GQEHARHOJVPVDG-INIZCTEOSA-N 2 0 327.472 4.414 20 0 EIADRP [NH3+]CCCCCC[NH+]1CCC(c2cccc(Br)c2)CC1 ZINC001236092890 1047444540 /nfs/dbraw/zinc/44/45/40/1047444540.db2.gz AAVUCABXZLJJQH-UHFFFAOYSA-N 2 0 339.321 4.148 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCSC(C)(C)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000897796002 1047484712 /nfs/dbraw/zinc/48/47/12/1047484712.db2.gz VUSHWYNCVIPERR-QXAKKESOSA-N 2 0 332.557 4.161 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)[C@@H]1CCOC1 ZINC000129870672 1047520719 /nfs/dbraw/zinc/52/07/19/1047520719.db2.gz JVLZYAAJTGNTJR-IFMALSPDSA-N 2 0 344.543 4.356 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@@H]2CCSC2)cc1C[NH+]1CCCCC1 ZINC000790494932 1047598887 /nfs/dbraw/zinc/59/88/87/1047598887.db2.gz HHQPFBAWSPKIGF-IRXDYDNUSA-N 2 0 348.556 4.085 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2cn3ccccc3n2)c1 ZINC000556236932 1047602618 /nfs/dbraw/zinc/60/26/18/1047602618.db2.gz XIVCXAIMIDBHSC-KRWDZBQOSA-N 2 0 336.483 4.027 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H](c2ccncc2)C2CC2)CC1 ZINC000898322390 1047616409 /nfs/dbraw/zinc/61/64/09/1047616409.db2.gz KJRQLUABEYKPRQ-TYCQWZJGSA-N 2 0 327.516 4.165 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)CC1 ZINC000498422122 1047658205 /nfs/dbraw/zinc/65/82/05/1047658205.db2.gz KWUHOWBEAHXPQD-OAQYLSRUSA-N 2 0 330.491 4.473 20 0 EIADRP CCc1cnc(CC[NH2+][C@H](C)c2ccc(-n3ccnc3C)cc2)s1 ZINC000130287594 1047670242 /nfs/dbraw/zinc/67/02/42/1047670242.db2.gz SZXCFVSFCJGSIF-CQSZACIVSA-N 2 0 340.496 4.093 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)cc1F ZINC000130298034 1047673619 /nfs/dbraw/zinc/67/36/19/1047673619.db2.gz RTZOLMFAXMUAAP-GJZGRUSLSA-N 2 0 332.385 4.098 20 0 EIADRP CC(C)Oc1ccc(C[NH2+][C@H]2CCN(C)[C@@H](c3ccccc3)C2)cc1 ZINC000550606178 1047746749 /nfs/dbraw/zinc/74/67/49/1047746749.db2.gz FNEDSKRBVSTLST-RBBKRZOGSA-N 2 0 338.495 4.399 20 0 EIADRP Cc1cc(F)ccc1CC[NH2+][C@@H]1CCN(C)[C@H](c2ccccc2)C1 ZINC000550680213 1047813960 /nfs/dbraw/zinc/81/39/60/1047813960.db2.gz JFRGNXJXGSXPGI-RTWAWAEBSA-N 2 0 326.459 4.102 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000556589891 1047835134 /nfs/dbraw/zinc/83/51/34/1047835134.db2.gz QPMLMMWPJMIJCC-HRQSHJORSA-N 2 0 330.516 4.041 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)Cc2cc3c(cccc3Cl)[nH]2)CC1 ZINC001136860853 1047858263 /nfs/dbraw/zinc/85/82/63/1047858263.db2.gz FCNCXWNNASIEIQ-UHFFFAOYSA-N 2 0 333.907 4.374 20 0 EIADRP CC1(C)[C@@H]2C[C@@H]([NH2+]CC3CC[NH+](Cc4ccccc4F)CC3)C[C@@H]21 ZINC001170732306 1047877391 /nfs/dbraw/zinc/87/73/91/1047877391.db2.gz YBQVRSMTBDUVNE-LDLYASANSA-N 2 0 330.491 4.062 20 0 EIADRP C[C@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000824775078 1047932669 /nfs/dbraw/zinc/93/26/69/1047932669.db2.gz YFVHBNRDGSHPJV-USXIJHARSA-N 2 0 341.326 4.071 20 0 EIADRP CCCCC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)C(C)(C)C ZINC000808706539 1048054475 /nfs/dbraw/zinc/05/44/75/1048054475.db2.gz MNRRSSGCJKQRGO-AQNXPRMDSA-N 2 0 338.580 4.339 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000556857804 1048074345 /nfs/dbraw/zinc/07/43/45/1048074345.db2.gz HMYRKBIAFRQBKG-SUMWQHHRSA-N 2 0 342.405 4.110 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2CCc3cc(Cl)ccc3C2)c1 ZINC001171093424 1048129098 /nfs/dbraw/zinc/12/90/98/1048129098.db2.gz FTXFAEOUOAYVSC-HXUWFJFHSA-N 2 0 328.887 4.049 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171109701 1048219070 /nfs/dbraw/zinc/21/90/70/1048219070.db2.gz LMEZNVGDTGRZGV-GPJFCIFZSA-N 2 0 334.935 4.440 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CC2Cc4ccccc4C2)C3)cc1 ZINC000499224973 1048454841 /nfs/dbraw/zinc/45/48/41/1048454841.db2.gz YVOUHUFZVLWVOZ-JOZNFPNDSA-N 2 0 346.518 4.187 20 0 EIADRP Cc1ccc(OC(F)F)c(C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)c1 ZINC000809737630 1048508574 /nfs/dbraw/zinc/50/85/74/1048508574.db2.gz IIFLGYJSDKZEGD-UHFFFAOYSA-N 2 0 348.437 4.290 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+]Cc2ccc(SC(F)(F)F)cc2)c(F)c1 ZINC000844904125 1048540417 /nfs/dbraw/zinc/54/04/17/1048540417.db2.gz BJEUVJGDMYLYLA-UHFFFAOYSA-N 2 0 344.377 4.186 20 0 EIADRP Cc1cc(F)ccc1[C@H](C)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000815622222 1048548224 /nfs/dbraw/zinc/54/82/24/1048548224.db2.gz PRERQPXJGDLASI-PKOBYXMFSA-N 2 0 326.459 4.307 20 0 EIADRP Cc1c([C@H](C)[NH2+]CCCCC[NH+]2CCCC2)cnn1-c1ccccc1 ZINC000815647347 1048571365 /nfs/dbraw/zinc/57/13/65/1048571365.db2.gz HPGOJGHEMCZDLT-SFHVURJKSA-N 2 0 340.515 4.097 20 0 EIADRP Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3ccc([C@@H]4CC[N@H+](C)C4)cc3)c2c1 ZINC001171167789 1048615092 /nfs/dbraw/zinc/61/50/92/1048615092.db2.gz MQQKKLQDVXNWPC-PKOBYXMFSA-N 2 0 347.506 4.248 20 0 EIADRP Clc1ccc2c(C[N@@H+]3CCCC[C@@H]3CC[NH+]3CCCC3)c[nH]c2n1 ZINC001144414482 1048649346 /nfs/dbraw/zinc/64/93/46/1048649346.db2.gz ICWLVDXKTKDYAD-MRXNPFEDSA-N 2 0 346.906 4.057 20 0 EIADRP c1cc2cccc(C[NH+]3CC[C@H]4C[N@@H+](Cc5ccccc5)C[C@H]4C3)c2[nH]1 ZINC001144718329 1048818862 /nfs/dbraw/zinc/81/88/62/1048818862.db2.gz HQZRWDQUAYKAET-RBBKRZOGSA-N 2 0 345.490 4.122 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2c[nH]nc2-c2ccccc2)CC1 ZINC000134155312 1048888500 /nfs/dbraw/zinc/88/85/00/1048888500.db2.gz PWAADVDGWUPYFG-UHFFFAOYSA-N 2 0 340.515 4.021 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)cc1 ZINC000237344854 1048927797 /nfs/dbraw/zinc/92/77/97/1048927797.db2.gz WPLBOJYJHBQVJJ-PMACEKPBSA-N 2 0 338.495 4.325 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(Cl)ccc1OC ZINC000817949931 1049063310 /nfs/dbraw/zinc/06/33/10/1049063310.db2.gz ULGPVYFNQPVYOA-GOSISDBHSA-N 2 0 332.875 4.091 20 0 EIADRP [NH3+]CCc1ccc(C[NH2+][C@H](c2ccc(F)cc2)C2CCCC2)cc1 ZINC000817948438 1049064991 /nfs/dbraw/zinc/06/49/91/1049064991.db2.gz JZUMXRCGXUTHIG-NRFANRHFSA-N 2 0 326.459 4.348 20 0 EIADRP [NH3+]CCc1ccc(C[NH2+][C@@H]2CCSc3ccc(Cl)cc32)cc1 ZINC000817947951 1049065108 /nfs/dbraw/zinc/06/51/08/1049065108.db2.gz GVEPRADIISGDHP-QGZVFWFLSA-N 2 0 332.900 4.168 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cc(Cl)c(N)c(Cl)c2)cc1 ZINC000817963152 1049069138 /nfs/dbraw/zinc/06/91/38/1049069138.db2.gz ORRGITQTQWGEDJ-MNOVXSKESA-N 2 0 338.282 4.446 20 0 EIADRP CC(C)c1ccc(C2(O)CCC([NH2+][C@H]3CCCC[C@H]3C[NH3+])CC2)cc1 ZINC000817961136 1049069487 /nfs/dbraw/zinc/06/94/87/1049069487.db2.gz UTADKXXEELJCAZ-YOLZPYMBSA-N 2 0 344.543 4.047 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ccnc(Cl)c2Cl)C1 ZINC000811474204 1049094261 /nfs/dbraw/zinc/09/42/61/1049094261.db2.gz FJOIUHUBXYAABB-KBPBESRZSA-N 2 0 344.330 4.236 20 0 EIADRP Fc1cc(F)c2c(c1)CC[C@@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)C2 ZINC001170677634 1049466679 /nfs/dbraw/zinc/46/66/79/1049466679.db2.gz QUWLADJSYQXHDA-LJQANCHMSA-N 2 0 348.481 4.066 20 0 EIADRP C[C@H](C[C@H](O)c1ccc(F)cc1)[NH2+][C@H](C)c1cccc(C[NH+](C)C)c1 ZINC000820814881 1049556485 /nfs/dbraw/zinc/55/64/85/1049556485.db2.gz NVZYKBIDAKEEHV-ZOCZFRKYSA-N 2 0 344.474 4.050 20 0 EIADRP CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2cccc(C[NH+](C)C)c2)C12CCCC2 ZINC000820813116 1049556775 /nfs/dbraw/zinc/55/67/75/1049556775.db2.gz YYIHBXIKJQZKEL-FFZOFVMBSA-N 2 0 330.516 4.137 20 0 EIADRP Cc1cccc(C)c1C[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000773066941 1049559695 /nfs/dbraw/zinc/55/96/95/1049559695.db2.gz GLIIRBNWKHCRNO-GOSISDBHSA-N 2 0 326.484 4.095 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1cccc(C[NH+](C)C)c1 ZINC000820840689 1049564972 /nfs/dbraw/zinc/56/49/72/1049564972.db2.gz ATPLEVUKKPRDEW-IFXJQAMLSA-N 2 0 328.431 4.062 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1cccc(C[NH+](C)C)c1 ZINC000820840682 1049565776 /nfs/dbraw/zinc/56/57/76/1049565776.db2.gz ATPLEVUKKPRDEW-AUUYWEPGSA-N 2 0 328.431 4.062 20 0 EIADRP C[C@H]([NH3+])c1ncc(-c2ccccc2)n1-c1ccc([C@@H]2CCC[NH2+]C2)cc1 ZINC001170688105 1049606382 /nfs/dbraw/zinc/60/63/82/1049606382.db2.gz SPGUXZHMEHQSMM-QFBILLFUSA-N 2 0 346.478 4.026 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(Cl)cc3cccnc32)[C@H](C)C1 ZINC000081096712 1049624374 /nfs/dbraw/zinc/62/43/74/1049624374.db2.gz FJRCTWKZTARRIK-KDOFPFPSSA-N 2 0 331.891 4.050 20 0 EIADRP Fc1cccc2c1CC[C@@H]([NH2+]C1CC[NH+](C[C@@H]3CC=CCC3)CC1)C2 ZINC001171419779 1049656611 /nfs/dbraw/zinc/65/66/11/1049656611.db2.gz UWLNMZPOMAETSC-YLJYHZDGSA-N 2 0 342.502 4.093 20 0 EIADRP Fc1cccc2c1C[C@H]([NH2+]CC1CC[NH+](CC3CCCC3)CC1)CC2 ZINC001170971178 1049688200 /nfs/dbraw/zinc/68/82/00/1049688200.db2.gz OGEISNCBQJCGOT-HXUWFJFHSA-N 2 0 344.518 4.175 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1CCc2c(F)cccc2C1 ZINC001171439397 1049690762 /nfs/dbraw/zinc/69/07/62/1049690762.db2.gz YKEDZPQBCRVPBI-OTWHNJEPSA-N 2 0 330.491 4.022 20 0 EIADRP C[NH+](C)CCC1CC[NH+](CCSc2ccc(Cl)cc2)CC1 ZINC000615462746 1049697491 /nfs/dbraw/zinc/69/74/91/1049697491.db2.gz IQKNRTAICMFMHQ-UHFFFAOYSA-N 2 0 326.937 4.096 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@H]2CCc3cc(F)c(F)cc3C2)CC1(C)C ZINC001171462900 1049714272 /nfs/dbraw/zinc/71/42/72/1049714272.db2.gz LHLQYDJLPNWRJW-HNNXBMFYSA-N 2 0 336.470 4.063 20 0 EIADRP Cc1cccc2c1CC[C@H]([N@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171559089 1049754696 /nfs/dbraw/zinc/75/46/96/1049754696.db2.gz VGGJRKZYTOYHMJ-FKBYEOEOSA-N 2 0 349.522 4.019 20 0 EIADRP Cc1cccc2c1CC[C@@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)C2 ZINC001171559328 1049755071 /nfs/dbraw/zinc/75/50/71/1049755071.db2.gz DPKHLDVJEPUROZ-OAQYLSRUSA-N 2 0 326.528 4.097 20 0 EIADRP COc1ccccc1[C@H]1CC[N@@H+](C2CC(C)(C)[NH+](C)C(C)(C)C2)C1 ZINC001171628586 1049762347 /nfs/dbraw/zinc/76/23/47/1049762347.db2.gz BYCHIOWWIQFDHD-INIZCTEOSA-N 2 0 330.516 4.136 20 0 EIADRP C[NH+]1C(C)(C)CC(n2c3ccccc3c3c2C[C@@H]([NH3+])CC3)CC1(C)C ZINC001171623832 1049768003 /nfs/dbraw/zinc/76/80/03/1049768003.db2.gz HJPCQVVTPANLGX-HNNXBMFYSA-N 2 0 339.527 4.281 20 0 EIADRP C[NH+]1C(C)(C)CC(n2c3ccccc3c3c2C[C@H]([NH3+])CC3)CC1(C)C ZINC001171623834 1049768578 /nfs/dbraw/zinc/76/85/78/1049768578.db2.gz HJPCQVVTPANLGX-OAHLLOKOSA-N 2 0 339.527 4.281 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1nc2c(s1)CCCC2 ZINC000245535848 1049769421 /nfs/dbraw/zinc/76/94/21/1049769421.db2.gz KSBHPZQJGDIKMT-HZPDHXFCSA-N 2 0 335.561 4.185 20 0 EIADRP C[NH+]1C(C)(C)CC([N@H+](Cc2ccccc2)C2CCOCC2)CC1(C)C ZINC001171639394 1049778898 /nfs/dbraw/zinc/77/88/98/1049778898.db2.gz IMDGENZHWYAWHZ-UHFFFAOYSA-N 2 0 344.543 4.319 20 0 EIADRP C[NH2+]Cc1ccc2c(ccn2[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC001171744480 1049789841 /nfs/dbraw/zinc/78/98/41/1049789841.db2.gz HARYVHNJWSHJRN-UTKZUKDTSA-N 2 0 333.479 4.196 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001171958825 1049822364 /nfs/dbraw/zinc/82/23/64/1049822364.db2.gz JAMBPGAAXOWCIP-CQSZACIVSA-N 2 0 328.422 4.099 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCC[NH+]1CCCCC1 ZINC001171960267 1049823450 /nfs/dbraw/zinc/82/34/50/1049823450.db2.gz UJBZOTSUXHKMAV-OAHLLOKOSA-N 2 0 328.422 4.102 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001171961114 1049824320 /nfs/dbraw/zinc/82/43/20/1049824320.db2.gz QAXDRLMHGJAZBF-OAHLLOKOSA-N 2 0 342.449 4.346 20 0 EIADRP Cc1noc(C2CCC([NH2+]CCCCCCC[NH+]3CCCC3)CC2)n1 ZINC000813859935 1049825157 /nfs/dbraw/zinc/82/51/57/1049825157.db2.gz CDINFJSNTAHHMD-UHFFFAOYSA-N 2 0 348.535 4.040 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CCC(CC[NH3+])CC1 ZINC001171965144 1049826751 /nfs/dbraw/zinc/82/67/51/1049826751.db2.gz PWMXFZLTYHOEFI-TUBUQKNSSA-N 2 0 328.422 4.134 20 0 EIADRP CC1(C)C[C@H]([NH2+]C2(Cc3cccnc3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171974960 1049837325 /nfs/dbraw/zinc/83/73/25/1049837325.db2.gz BJNAPFFCRQTLCN-OAQYLSRUSA-N 2 0 349.522 4.190 20 0 EIADRP C[C@@H](N[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1cncc(F)c1 ZINC001171978455 1049837336 /nfs/dbraw/zinc/83/73/36/1049837336.db2.gz KVYACXZVJSYOOD-UZLBHIALSA-N 2 0 341.474 4.315 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CC2(c3ccccn3)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171984155 1049840755 /nfs/dbraw/zinc/84/07/55/1049840755.db2.gz SFWFKTBEGDFXMN-FQEVSTJZSA-N 2 0 349.522 4.146 20 0 EIADRP [NH3+]CCCCCCC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172077011 1049843798 /nfs/dbraw/zinc/84/37/98/1049843798.db2.gz NVHIFOWZYMTRDJ-KOUNCHBCSA-N 3 0 343.559 4.071 20 0 EIADRP C[N@H+](C[C@H]1CCCCO1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076439 1049845246 /nfs/dbraw/zinc/84/52/46/1049845246.db2.gz YOKNTWVFPLFCQJ-CIAFKFPVSA-N 2 0 342.527 4.073 20 0 EIADRP FC1(F)C[C@@]12CC[N@@H+]([C@H]1C[C@H]3CCC[C@@H](C1)[NH+]3Cc1ccccc1)C2 ZINC001172074405 1049845548 /nfs/dbraw/zinc/84/55/48/1049845548.db2.gz IRDZIINYEOOPCE-FUMNGEBKSA-N 2 0 346.465 4.303 20 0 EIADRP Fc1ccccc1CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245746915 1049845949 /nfs/dbraw/zinc/84/59/49/1049845949.db2.gz SSFBICODDTUSFK-MZADTFQBSA-N 2 0 338.470 4.153 20 0 EIADRP CC(C)O[C@H]1CC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172082433 1049847550 /nfs/dbraw/zinc/84/75/50/1049847550.db2.gz JWBQXKNRWMHQCY-LRSLUSHPSA-N 2 0 342.527 4.071 20 0 EIADRP C[C@@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccn1 ZINC001172062339 1049850261 /nfs/dbraw/zinc/85/02/61/1049850261.db2.gz NELUWNOIFSTXJW-WLRLJWMZSA-N 2 0 335.495 4.318 20 0 EIADRP FC1(F)CC[C@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172068240 1049853435 /nfs/dbraw/zinc/85/34/35/1049853435.db2.gz PSESVDKMJHPNCN-OKYOBFRVSA-N 2 0 334.454 4.350 20 0 EIADRP CCC1([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CCOCC1 ZINC001172070113 1049853581 /nfs/dbraw/zinc/85/35/81/1049853581.db2.gz MJZVUIBHXBMKTO-WKCHPHFGSA-N 2 0 342.527 4.121 20 0 EIADRP C[C@H]1OC2(CC[NH+]([C@@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4C)CC2)c2ccccc21 ZINC001172133958 1049855060 /nfs/dbraw/zinc/85/50/60/1049855060.db2.gz UUGCNAIWIKHFIE-AKHDSKFASA-N 2 0 340.511 4.084 20 0 EIADRP c1ccc2c(c1)C[C@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)CS2 ZINC001172203692 1049863266 /nfs/dbraw/zinc/86/32/66/1049863266.db2.gz VDCHGTQUHDFXGG-MOPGFXCFSA-N 2 0 330.541 4.044 20 0 EIADRP Clc1cccc2c1CC[C@H]([NH2+]C1CC[NH+](C3CCCC3)CC1)C2 ZINC001171022024 1049863473 /nfs/dbraw/zinc/86/34/73/1049863473.db2.gz ISDIAFSEPZERBA-KRWDZBQOSA-N 2 0 332.919 4.194 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCC2)[C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171024669 1049869471 /nfs/dbraw/zinc/86/94/71/1049869471.db2.gz GCKYUOWWTVTAOQ-SZMVWBNQSA-N 2 0 332.919 4.322 20 0 EIADRP C[C@@H]1CC[C@@H]([NH+]2CCC3(CC[N@H+](Cc4cccnc4)C3)CC2)C[C@@H]1C ZINC001172381014 1049885695 /nfs/dbraw/zinc/88/56/95/1049885695.db2.gz ZSPZFTBVVNIWFL-SVFBPWRDSA-N 2 0 341.543 4.194 20 0 EIADRP CC(C)COCC[C@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1C ZINC001172470549 1049908617 /nfs/dbraw/zinc/90/86/17/1049908617.db2.gz ZKHUCUVTMGGRGX-URVUXULASA-N 2 0 346.559 4.185 20 0 EIADRP CC(C)COCC[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172465283 1049917909 /nfs/dbraw/zinc/91/79/09/1049917909.db2.gz UJBSFTWZEPADIM-NMIHRBCNSA-N 2 0 344.543 4.223 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH+]1CCC(C[NH+](C)C)CC1 ZINC001172574675 1049941821 /nfs/dbraw/zinc/94/18/21/1049941821.db2.gz SBFOXIAPHYVQQN-CYBMUJFWSA-N 2 0 344.877 4.213 20 0 EIADRP [NH3+]C1(Cc2cccnc2)CC[NH+]([C@@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172541829 1049944368 /nfs/dbraw/zinc/94/43/68/1049944368.db2.gz BXDWOHJGLASCHU-FGZHOGPDSA-N 2 0 349.522 4.144 20 0 EIADRP Cc1cc(N2CC[NH+]([C@H]3CCC[C@@H](c4ccccc4)C3)CC2)cc[nH+]1 ZINC001172548796 1049947744 /nfs/dbraw/zinc/94/77/44/1049947744.db2.gz IWNLKOJLOWECCP-RTWAWAEBSA-N 2 0 335.495 4.238 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001172578985 1049951912 /nfs/dbraw/zinc/95/19/12/1049951912.db2.gz TYZPFXSKYOZBLH-BPLDGKMQSA-N 2 0 344.877 4.402 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CCCCCCC[NH3+] ZINC001172579545 1049952040 /nfs/dbraw/zinc/95/20/40/1049952040.db2.gz XNBXQJQJUAQZRX-CYBMUJFWSA-N 2 0 332.866 4.438 20 0 EIADRP CC1(C)CC([NH2+]C2CC[NH+](C[C@@H]3CC=CCC3)CC2)CC(C)(C)O1 ZINC001172654519 1049957079 /nfs/dbraw/zinc/95/70/79/1049957079.db2.gz FGXYRJANJSIAIT-QGZVFWFLSA-N 2 0 334.548 4.133 20 0 EIADRP CCC(CC)[NH+]1CCC(C[NH2+][C@@H]2Cc3ccc(Cl)cc3C2)CC1 ZINC001172718385 1049965402 /nfs/dbraw/zinc/96/54/02/1049965402.db2.gz VBFXIXVCUIRATN-LJQANCHMSA-N 2 0 334.935 4.297 20 0 EIADRP C[C@@]12CC3([NH3+])CC([NH2+][C@H]4Cc5ccc(Cl)cc5C4)(C1)C[C@](C)(C3)C2 ZINC001172714799 1049972722 /nfs/dbraw/zinc/97/27/22/1049972722.db2.gz DBQXWOLFTDYOCZ-DOIVMEMASA-N 2 0 344.930 4.227 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CCN(C)[C@@H](C)C1 ZINC000247044051 1050011326 /nfs/dbraw/zinc/01/13/26/1050011326.db2.gz OIONFXABPGHRHZ-GDZNZVCISA-N 2 0 347.503 4.391 20 0 EIADRP CCC[N@@H+]1CC[C@H](CN[C@H](C)c2nc(-c3ccccc3)cs2)C1 ZINC000247114652 1050013102 /nfs/dbraw/zinc/01/31/02/1050013102.db2.gz QVDJXEVDCKRJMK-HZPDHXFCSA-N 2 0 329.513 4.193 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(CC)s2)[C@H](C)C1 ZINC000248174433 1050045888 /nfs/dbraw/zinc/04/58/88/1050045888.db2.gz VJBVKJMUFCTYPB-NUJGCVRESA-N 2 0 338.561 4.098 20 0 EIADRP CC(C)(C[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000248728252 1050075126 /nfs/dbraw/zinc/07/51/26/1050075126.db2.gz VFIVEOUOCMHTAC-IRXDYDNUSA-N 2 0 340.433 4.199 20 0 EIADRP COC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCCC1 ZINC000248876174 1050081889 /nfs/dbraw/zinc/08/18/89/1050081889.db2.gz JNVFOCBAGAZFCR-MZADTFQBSA-N 2 0 342.527 4.121 20 0 EIADRP CCC[C@H]([NH2+][C@H]1CC[N@H+](CCCOCC)C[C@H]1C)c1ccsc1 ZINC000249080963 1050090850 /nfs/dbraw/zinc/09/08/50/1050090850.db2.gz LOPPMPMVMMUCGZ-NEWSRXKRSA-N 2 0 338.561 4.316 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1cccc(O)c1 ZINC000249380541 1050096661 /nfs/dbraw/zinc/09/66/61/1050096661.db2.gz BECWMRSHCLBGMU-ZWKOTPCHSA-N 2 0 338.495 4.475 20 0 EIADRP Cc1nc(CN[C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)sc1C ZINC000249501819 1050099860 /nfs/dbraw/zinc/09/98/60/1050099860.db2.gz XLLQOSYRHOCZQM-QVDMIQRCSA-N 2 0 343.540 4.006 20 0 EIADRP CCC[NH+]1C[C@@H]2C[NH+](C3CCC(Cc4ccccc4)CC3)C[C@H]2C1 ZINC001172825533 1050166834 /nfs/dbraw/zinc/16/68/34/1050166834.db2.gz WXAKQMCGQOLUEA-PWAJEDTMSA-N 2 0 326.528 4.062 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1cccc(Br)c1 ZINC000251335478 1050168969 /nfs/dbraw/zinc/16/89/69/1050168969.db2.gz YTXFOVKGNLZJLO-IKGGRYGDSA-N 2 0 337.305 4.117 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([NH2+]CC1CC[NH+](CC(C)(C)C)CC1)CC2 ZINC001172832293 1050169685 /nfs/dbraw/zinc/16/96/85/1050169685.db2.gz SBWCBEDTEXWSRT-NRFANRHFSA-N 2 0 328.544 4.200 20 0 EIADRP CC(C)[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccc(F)cc2Cl)[C@H](C)C1 ZINC001172864995 1050175444 /nfs/dbraw/zinc/17/54/44/1050175444.db2.gz JFLZOMWEYHLLBZ-LBTNJELSSA-N 2 0 326.887 4.119 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1csc(C)c1C ZINC001177294122 1050178159 /nfs/dbraw/zinc/17/81/59/1050178159.db2.gz GEEKQMPZIGJZQB-UHFFFAOYSA-N 2 0 346.540 4.375 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([N@H+](C)C[C@@H]1CC[NH+](Cc3ccccc3)C1)CC2 ZINC001172844394 1050181280 /nfs/dbraw/zinc/18/12/80/1050181280.db2.gz SQCFVCBOKKWGHM-URXFXBBRSA-N 2 0 348.534 4.306 20 0 EIADRP COC1(C[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)CCCCC1 ZINC001177261959 1050182791 /nfs/dbraw/zinc/18/27/91/1050182791.db2.gz MBBRMQYBZHQQFW-LJQANCHMSA-N 2 0 344.543 4.357 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC001172850004 1050188717 /nfs/dbraw/zinc/18/87/17/1050188717.db2.gz RTPIWBWVUCSMMP-WLYUNCDWSA-N 2 0 326.887 4.120 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[NH2+]C1CC[NH+](CC2CCC2)CC1 ZINC001172855950 1050192264 /nfs/dbraw/zinc/19/22/64/1050192264.db2.gz BKOIKZBVGRKPMN-CQSZACIVSA-N 2 0 338.898 4.264 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]CC1CC[NH+](C2CCC2)CC1 ZINC001172857744 1050193390 /nfs/dbraw/zinc/19/33/90/1050193390.db2.gz HZEJTXAZFSTDAE-AWEZNQCLSA-N 2 0 338.898 4.264 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[N@@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001172860341 1050198157 /nfs/dbraw/zinc/19/81/57/1050198157.db2.gz CMWHILMRNJKCCY-CABCVRRESA-N 2 0 326.887 4.251 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC001172861598 1050198582 /nfs/dbraw/zinc/19/85/82/1050198582.db2.gz UOTHHCFQKUMJCN-CQSZACIVSA-N 2 0 347.865 4.064 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC001172864125 1050200805 /nfs/dbraw/zinc/20/08/05/1050200805.db2.gz UQIGVTMKLUNWDP-CQSZACIVSA-N 2 0 334.866 4.262 20 0 EIADRP CC(C)CC[C@H]1CC[C@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)C1 ZINC001177529923 1050242491 /nfs/dbraw/zinc/24/24/91/1050242491.db2.gz UXAMUHPDTZYRCW-ICSRJNTNSA-N 2 0 332.532 4.322 20 0 EIADRP C[C@H]1CC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)CS1 ZINC001177529958 1050243250 /nfs/dbraw/zinc/24/32/50/1050243250.db2.gz WNSAWGXLMXIYMB-FXAWDEMLSA-N 2 0 332.557 4.436 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)C2CCC3(CCOCC3)CC2)CC1 ZINC001173044595 1050270439 /nfs/dbraw/zinc/27/04/39/1050270439.db2.gz UUIUKKFNXWASKD-MXVIHJGJSA-N 2 0 348.575 4.488 20 0 EIADRP CC[C@H]1CCC[C@H]([NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)CC1 ZINC001177673902 1050273142 /nfs/dbraw/zinc/27/31/42/1050273142.db2.gz BMGWQLWKDLZXQU-ICSRJNTNSA-N 2 0 332.532 4.466 20 0 EIADRP CCCc1ccc(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)s1 ZINC001177668979 1050273407 /nfs/dbraw/zinc/27/34/07/1050273407.db2.gz LXOWZNGBARDTCF-IBGZPJMESA-N 2 0 342.552 4.355 20 0 EIADRP C(C[NH+]1CCCC1)[C@H]1CCCC[N@@H+]1C1CCC2(CCOCC2)CC1 ZINC001173049144 1050274649 /nfs/dbraw/zinc/27/46/49/1050274649.db2.gz AZEVRWNKAXDBFZ-LJQANCHMSA-N 2 0 334.548 4.066 20 0 EIADRP CCCOC1CCC([NH2+][C@H]2CCN(Cc3ccccc3)[C@H](C)C2)CC1 ZINC001173092094 1050283184 /nfs/dbraw/zinc/28/31/84/1050283184.db2.gz IVVUORPUCJZCFT-DWOCFRCJSA-N 2 0 344.543 4.367 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CC2CC[NH+](C3CCCCC3)CC2)CC1 ZINC001173102586 1050304436 /nfs/dbraw/zinc/30/44/36/1050304436.db2.gz ARUXDFUIHRLPFP-UHFFFAOYSA-N 3 0 349.607 4.274 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccccc2OC(F)(F)F)CC1 ZINC001173105211 1050305686 /nfs/dbraw/zinc/30/56/86/1050305686.db2.gz HLOIFRDFLMHJTL-UHFFFAOYSA-N 2 0 344.421 4.328 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CC2(Cc3ccccn3)CCC2)CC1 ZINC001173106657 1050306741 /nfs/dbraw/zinc/30/67/41/1050306741.db2.gz PPIVLPNWRREXTO-UHFFFAOYSA-N 2 0 329.532 4.037 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](c2ccccc2OC)C2CC2)CC1 ZINC001173110402 1050307216 /nfs/dbraw/zinc/30/72/16/1050307216.db2.gz NHXXTUQOTTUXDU-NGICGMGXSA-N 2 0 330.516 4.389 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2(Cc3cccc(OC)c3)CCC2)CC1 ZINC001173107155 1050307434 /nfs/dbraw/zinc/30/74/34/1050307434.db2.gz XJFXRDUJXISXBD-UHFFFAOYSA-N 2 0 344.543 4.403 20 0 EIADRP CC[NH+](CC)C1CCC([N@H+](CC2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001173109838 1050308440 /nfs/dbraw/zinc/30/84/40/1050308440.db2.gz INHCJPROHXSRRQ-IKVFXUPASA-N 3 0 349.607 4.402 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCO[C@@](C)(c3ccc(C)cc3)C2)CC1 ZINC001173114343 1050310139 /nfs/dbraw/zinc/31/01/39/1050310139.db2.gz HGZKEXMBNSFIHV-LZBANZJXSA-N 2 0 344.543 4.195 20 0 EIADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2ccc(Cl)cc2Br)CC1 ZINC001206311598 1050339182 /nfs/dbraw/zinc/33/91/82/1050339182.db2.gz REIWDZMTBZUBTB-OAHLLOKOSA-N 2 0 345.712 4.053 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+](C1CCC(Oc3ccccc3)CC1)CC2 ZINC001173206725 1050366290 /nfs/dbraw/zinc/36/62/90/1050366290.db2.gz VOWIRHOVSDDBMN-UHFFFAOYSA-N 2 0 342.527 4.184 20 0 EIADRP CCCC[C@@H](CC(C)C)[N@H+]1C[C@H]2CN(Cc3cccnc3)C[C@H]2C1 ZINC001173263849 1050388426 /nfs/dbraw/zinc/38/84/26/1050388426.db2.gz XAUAEHVGKWWTOD-HBMCJLEFSA-N 2 0 329.532 4.050 20 0 EIADRP CC[C@@H]1CC[C@H](n2cc(CC[NH+]3CCC([NH3+])CC3)c3ccccc32)C1 ZINC001173269557 1050389273 /nfs/dbraw/zinc/38/92/73/1050389273.db2.gz XIGTYZNJSVDGSC-XLIONFOSSA-N 2 0 339.527 4.358 20 0 EIADRP CCSC[C@H](C)[N@H+]1C[C@H]2c3ccccc3[C@H]([NH+](C)C(C)C)[C@H]2C1 ZINC001173306090 1050404306 /nfs/dbraw/zinc/40/43/06/1050404306.db2.gz LLOWNZHHAGHMCY-KNTRFNDTSA-N 2 0 332.557 4.239 20 0 EIADRP CCSC[C@@H](C)[NH+]1CCC(N(C)Cc2ccc(Cl)cc2)CC1 ZINC001173313559 1050405734 /nfs/dbraw/zinc/40/57/34/1050405734.db2.gz CPNWMBAZDFPTJJ-OAHLLOKOSA-N 2 0 340.964 4.378 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+]Cc2cccc(COc3ccccc3)c2)CC1 ZINC001178284966 1050427960 /nfs/dbraw/zinc/42/79/60/1050427960.db2.gz FUWZPHJHDVHGOZ-UHFFFAOYSA-N 2 0 338.495 4.087 20 0 EIADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1 ZINC001178284843 1050428547 /nfs/dbraw/zinc/42/85/47/1050428547.db2.gz CTZVDLJPZFNAEF-YTFSRNRJSA-N 2 0 334.507 4.385 20 0 EIADRP COc1cc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)cc2ccccc21 ZINC001203254639 1050445708 /nfs/dbraw/zinc/44/57/08/1050445708.db2.gz IVIHRDVNVADUAK-UHFFFAOYSA-N 2 0 338.495 4.060 20 0 EIADRP c1ccc(C[N@H+]2CC[C@@H](C[NH2+][C@H]3CCCNc4ccccc43)C2)cc1 ZINC000253355504 1050455324 /nfs/dbraw/zinc/45/53/24/1050455324.db2.gz HNOFEUCVUDALQA-UGKGYDQZSA-N 2 0 335.495 4.045 20 0 EIADRP CC(C)Oc1ccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC001178457725 1050474247 /nfs/dbraw/zinc/47/42/47/1050474247.db2.gz CGLPVPRKQIHJMJ-PKOBYXMFSA-N 2 0 330.516 4.216 20 0 EIADRP C[C@H]1C[N@H+](CCC[NH2+]Cc2ccc(-c3cccs3)cc2)CCCO1 ZINC001178473530 1050479544 /nfs/dbraw/zinc/47/95/44/1050479544.db2.gz SKMRVSJCRVTKSX-KRWDZBQOSA-N 2 0 344.524 4.006 20 0 EIADRP c1ccc2c(c1)CCC21CCC([NH+]2CCN(c3cc[nH+]cc3)CC2)CC1 ZINC001173686650 1050538552 /nfs/dbraw/zinc/53/85/52/1050538552.db2.gz VGEHYWCPOSWZLR-UHFFFAOYSA-N 2 0 347.506 4.030 20 0 EIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+][C@H](C)CC(C)(C)C)CC1 ZINC001178882270 1050577231 /nfs/dbraw/zinc/57/72/31/1050577231.db2.gz VDSPYRLOFICQEI-GOSISDBHSA-N 2 0 331.548 4.133 20 0 EIADRP CC[C@@H]1C[C@@H](C[NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC001179277881 1050668977 /nfs/dbraw/zinc/66/89/77/1050668977.db2.gz OZQRCNBBARYZPF-FCHUYYIVSA-N 2 0 344.543 4.084 20 0 EIADRP CC(C)[C@H]1C[C@@H]([NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC001179277989 1050669473 /nfs/dbraw/zinc/66/94/73/1050669473.db2.gz PZDFFLNSSHDBDE-FCHUYYIVSA-N 2 0 344.543 4.082 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+]Cc2cccc(OC(F)(F)F)c2)CC1 ZINC001179277775 1050669812 /nfs/dbraw/zinc/66/98/12/1050669812.db2.gz MYBXIDXLBPBHDV-UHFFFAOYSA-N 2 0 344.421 4.185 20 0 EIADRP CC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(-c3ccccc3OC)cc2)C1 ZINC000093770397 1050691586 /nfs/dbraw/zinc/69/15/86/1050691586.db2.gz JYMSEXIYFVGQBO-IBGZPJMESA-N 2 0 338.495 4.136 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccccc2N(C)C)c1 ZINC000093943469 1050724325 /nfs/dbraw/zinc/72/43/25/1050724325.db2.gz HTUKOQPYQCKDGL-SFHVURJKSA-N 2 0 339.527 4.444 20 0 EIADRP CC(C)(C)[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCCCC2)CCO1 ZINC000763533251 1050729584 /nfs/dbraw/zinc/72/95/84/1050729584.db2.gz ZETWSAUIDQAPDU-LEWJYISDSA-N 2 0 344.543 4.356 20 0 EIADRP CC[NH+](CC)CC[C@H](C)[NH2+]Cc1cc2ccnc(Cl)c2s1 ZINC001179830096 1050787733 /nfs/dbraw/zinc/78/77/33/1050787733.db2.gz LBDJKFZKWLCWGI-LBPRGKRZSA-N 2 0 325.909 4.160 20 0 EIADRP C[C@]1(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)CCCS1 ZINC001179918978 1050833435 /nfs/dbraw/zinc/83/34/35/1050833435.db2.gz GEQHTJJWHJCDFZ-PCCBWWKXSA-N 2 0 344.568 4.259 20 0 EIADRP c1ccc2c(c1)CC[C@H]2C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC001180076889 1050875381 /nfs/dbraw/zinc/87/53/81/1050875381.db2.gz JZIKSJXOWFSUMD-NRFANRHFSA-N 2 0 326.528 4.304 20 0 EIADRP c1ccc([C@@H]2C[C@H]2C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cc1 ZINC001180076132 1050875442 /nfs/dbraw/zinc/87/54/42/1050875442.db2.gz BABNXHYXAZLGTL-VXKWHMMOSA-N 2 0 326.528 4.378 20 0 EIADRP C[C@H](C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C)[NH+]1CCCC1 ZINC001180586673 1051044879 /nfs/dbraw/zinc/04/48/79/1051044879.db2.gz UBNQVICVJOBINU-OAHLLOKOSA-N 2 0 328.481 4.056 20 0 EIADRP Clc1ccc([C@@H]2CC[C@@H]([NH2+]CC3CC[NH+](C4CC4)CC3)C2)cc1 ZINC001181234164 1051192306 /nfs/dbraw/zinc/19/23/06/1051192306.db2.gz HWJPFHFCKJAPLH-IEBWSBKVSA-N 2 0 332.919 4.440 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@H]2CCCSC2)ccc1OC ZINC000775397549 1051219740 /nfs/dbraw/zinc/21/97/40/1051219740.db2.gz WDDAHFHITGUISV-YJBOKZPZSA-N 2 0 336.545 4.083 20 0 EIADRP CC(C)(C[N@@H+]1CCC[C@@](F)(C[NH3+])CC1)Sc1ccc(Cl)cc1 ZINC001205537929 1051254648 /nfs/dbraw/zinc/25/46/48/1051254648.db2.gz KQUIWSUSUAXUHU-KRWDZBQOSA-N 2 0 344.927 4.364 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2sc(-c3ccccc3F)nc2C)C1 ZINC000163230581 1051291273 /nfs/dbraw/zinc/29/12/73/1051291273.db2.gz CWXYCSHDNGMBCU-DZGCQCFKSA-N 2 0 347.503 4.250 20 0 EIADRP COCCN1CCC([NH2+][C@@H](C)c2cccc(-c3ccccc3)c2)CC1 ZINC000154817442 1051338830 /nfs/dbraw/zinc/33/88/30/1051338830.db2.gz IMNGZPNFTAMNHF-SFHVURJKSA-N 2 0 338.495 4.115 20 0 EIADRP Clc1ccc([C@H]2CC[C@@H]([NH2+]Cc3ccc4c[nH+]cn4c3)C2)cc1 ZINC001182249669 1051440473 /nfs/dbraw/zinc/44/04/73/1051440473.db2.gz FYTFTULKKNNNBO-FUHWJXTLSA-N 2 0 325.843 4.414 20 0 EIADRP [NH3+]CCC1CC[NH+](Cc2ccc3ccccc3c2Br)CC1 ZINC001206500703 1051501213 /nfs/dbraw/zinc/50/12/13/1051501213.db2.gz PWMIETIYZLBPRQ-UHFFFAOYSA-N 2 0 347.300 4.163 20 0 EIADRP COc1ccc([C@@H](C)NC2CC[NH+](C3CCCCC3)CC2)c(F)c1 ZINC000157516606 1051645521 /nfs/dbraw/zinc/64/55/21/1051645521.db2.gz OWSVJNIFXMPEDL-OAHLLOKOSA-N 2 0 334.479 4.282 20 0 EIADRP COC(C)(C)[C@@H](C)[NH2+]CCCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC000671113292 1051659128 /nfs/dbraw/zinc/65/91/28/1051659128.db2.gz RMWGNOMPNDEXMS-LJQANCHMSA-N 2 0 346.559 4.124 20 0 EIADRP CCC(CC)(C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)SC ZINC000775511593 1051660040 /nfs/dbraw/zinc/66/00/40/1051660040.db2.gz DUIDCTFIHDIIPZ-IEBWSBKVSA-N 2 0 334.573 4.408 20 0 EIADRP CC(C)COc1cccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC001192323742 1051691642 /nfs/dbraw/zinc/69/16/42/1051691642.db2.gz FCNKMXJVYXYQAC-KNQAVFIVSA-N 2 0 342.527 4.170 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc2ccccc2c1OC(F)F ZINC000158109680 1051712760 /nfs/dbraw/zinc/71/27/60/1051712760.db2.gz STNZCQWGZNPLOD-CABCVRRESA-N 2 0 348.437 4.434 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)cc1 ZINC000158142511 1051720061 /nfs/dbraw/zinc/72/00/61/1051720061.db2.gz BJFQOAQJUJBIEY-ZWKOTPCHSA-N 2 0 338.495 4.355 20 0 EIADRP Cc1ccc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c(Cl)n1 ZINC001192401309 1051724360 /nfs/dbraw/zinc/72/43/60/1051724360.db2.gz MVROEGDIGSXMNG-UHFFFAOYSA-N 2 0 335.923 4.131 20 0 EIADRP c1ccc(SC2CC([NH2+]C[C@H]3CCN3C3CCCCC3)C2)cc1 ZINC001182919170 1051730407 /nfs/dbraw/zinc/73/04/07/1051730407.db2.gz VYCFDMQRHYGCFT-KGXSXCIVSA-N 2 0 330.541 4.306 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC(NC[C@@H]2CC[N@@H+]2C2CCCCC2)CC1 ZINC001182918236 1051745709 /nfs/dbraw/zinc/74/57/09/1051745709.db2.gz KMLSZNISQLRKIH-BVYCBKJFSA-N 2 0 347.591 4.026 20 0 EIADRP COCCC[NH+]1CCC(N[C@@H](C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000159082835 1051810341 /nfs/dbraw/zinc/81/03/41/1051810341.db2.gz YMCWTSIPGJNTDX-ZDUSSCGKSA-N 2 0 345.314 4.145 20 0 EIADRP Cc1ccc(C[C@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC001183281083 1051813288 /nfs/dbraw/zinc/81/32/88/1051813288.db2.gz LQUNGGYLYYEMQN-SXWKCWPCSA-N 2 0 336.523 4.284 20 0 EIADRP CC[NH+](CC)CCC[NH2+][C@H](COc1c(C)cccc1C)C(C)(C)C ZINC001192849301 1051822370 /nfs/dbraw/zinc/82/23/70/1051822370.db2.gz RZKOPKONMBCNEA-LJQANCHMSA-N 2 0 334.548 4.418 20 0 EIADRP [NH3+]Cc1ccc(Nc2ccc3c(c2)CC[C@@H]([NH+]2CCCC2)CC3)cc1 ZINC001175972639 1051854895 /nfs/dbraw/zinc/85/48/95/1051854895.db2.gz FGLLUOJBSATPHW-QFIPXVFZSA-N 2 0 335.495 4.232 20 0 EIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001193091735 1051875108 /nfs/dbraw/zinc/87/51/08/1051875108.db2.gz BHDIIDPAQQWFPA-QZTJIDSGSA-N 2 0 347.506 4.414 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1cccc(SC(F)(F)F)c1 ZINC001183885344 1051915025 /nfs/dbraw/zinc/91/50/25/1051915025.db2.gz IFLGRNMZVYLNRL-GFCCVEGCSA-N 2 0 332.435 4.291 20 0 EIADRP CC(C)(C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)C1CCC1 ZINC000716731041 1051980410 /nfs/dbraw/zinc/98/04/10/1051980410.db2.gz JFDWZDGUZJSWDB-TYPHKJRUSA-N 2 0 326.528 4.455 20 0 EIADRP C(CC[NH2+]C1CC[NH+](C2CCCCC2)CC1)CC[NH+]1CCCCC1 ZINC000164609903 1052034990 /nfs/dbraw/zinc/03/49/90/1052034990.db2.gz FZOUPMOBYRKYBX-UHFFFAOYSA-N 3 0 335.580 4.029 20 0 EIADRP Cc1ccc(C)c(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c1 ZINC000622267347 1052169531 /nfs/dbraw/zinc/16/95/31/1052169531.db2.gz LMGCEEQKSGPMID-UHFFFAOYSA-N 2 0 328.525 4.367 20 0 EIADRP CC(C)(C)n1cncc1[C@H]1CCC[N@H+](Cc2ccc(Cl)nc2)C1 ZINC001176990251 1052215199 /nfs/dbraw/zinc/21/51/99/1052215199.db2.gz FXESEWGZRAKMOK-HNNXBMFYSA-N 2 0 332.879 4.066 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cccc(C)c1Br ZINC001177093143 1052229617 /nfs/dbraw/zinc/22/96/17/1052229617.db2.gz NYSOGUMAKVRGSU-HNNXBMFYSA-N 2 0 341.337 4.358 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cccc(OC(F)F)c1 ZINC000171129196 1052396916 /nfs/dbraw/zinc/39/69/16/1052396916.db2.gz OKXVVZURGCCIEP-CQSZACIVSA-N 2 0 334.410 4.200 20 0 EIADRP CCCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000171133256 1052397798 /nfs/dbraw/zinc/39/77/98/1052397798.db2.gz LYUBHMNPYYJZSX-QGZVFWFLSA-N 2 0 326.484 4.388 20 0 EIADRP C[C@@H]([NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1)C1CC[NH+](C)CC1 ZINC000671302701 1052597974 /nfs/dbraw/zinc/59/79/74/1052597974.db2.gz RSCLLFPEEVXYND-CYBMUJFWSA-N 2 0 349.931 4.283 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1cccc2n[nH]cc21 ZINC000623358199 1052630819 /nfs/dbraw/zinc/63/08/19/1052630819.db2.gz SSWQEXIIXIDHIE-KRWDZBQOSA-N 2 0 348.494 4.227 20 0 EIADRP C[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)c1ccoc1 ZINC000178284353 1052704516 /nfs/dbraw/zinc/70/45/16/1052704516.db2.gz KIKYURUNPPVXTQ-SFHVURJKSA-N 2 0 342.483 4.002 20 0 EIADRP CO[C@@H](C[NH2+][C@H](C)c1ccc(-n2ccnc2C)cc1)c1ccccc1 ZINC000178458168 1052705808 /nfs/dbraw/zinc/70/58/08/1052705808.db2.gz YHSQQJFIAILUPY-IERDGZPVSA-N 2 0 335.451 4.219 20 0 EIADRP Cc1csc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)n1 ZINC000623873261 1052827324 /nfs/dbraw/zinc/82/73/24/1052827324.db2.gz BWSPQSFBRHRILB-MRXNPFEDSA-N 2 0 329.513 4.014 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccc(F)cc1C(F)(F)F ZINC000623999527 1052849907 /nfs/dbraw/zinc/84/99/07/1052849907.db2.gz SXFVBWIXIZANPC-STQMWFEESA-N 2 0 332.385 4.227 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(F)cc1C(F)(F)F ZINC000624002736 1052850634 /nfs/dbraw/zinc/85/06/34/1052850634.db2.gz CUCBKEWGFSVMNU-LMWSTFAQSA-N 2 0 332.385 4.368 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCCc3c4cc(Cl)ccc4[nH]c32)C1 ZINC000624008859 1052855123 /nfs/dbraw/zinc/85/51/23/1052855123.db2.gz JAIOGDYYBSBVMY-WRSAYESZSA-N 2 0 331.891 4.129 20 0 EIADRP CSc1ccc(OCC[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185763826 1053021132 /nfs/dbraw/zinc/02/11/32/1053021132.db2.gz FCLCYPLZUYMXKA-SJORKVTESA-N 2 0 348.556 4.030 20 0 EIADRP Fc1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1Cl ZINC000380899468 1053047088 /nfs/dbraw/zinc/04/70/88/1053047088.db2.gz FIQRJAWLZHIJBK-KRWDZBQOSA-N 2 0 332.850 4.091 20 0 EIADRP Fc1cccc(C2CC([NH2+]C[C@@H]3CC[N@H+](Cc4ccccc4)C3)C2)c1 ZINC000381147889 1053054750 /nfs/dbraw/zinc/05/47/50/1053054750.db2.gz IYYDCRYYIZFSRP-NLMOZGTASA-N 2 0 338.470 4.183 20 0 EIADRP COC1([C@@H](C)[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CCC1 ZINC000850470608 1053248834 /nfs/dbraw/zinc/24/88/34/1053248834.db2.gz GAIMRDDYZRJUQQ-LBFURVHYSA-N 2 0 342.527 4.119 20 0 EIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH+](C)CCC(C)(C)C)cc2)C[C@H](C)O1 ZINC001195651937 1053455667 /nfs/dbraw/zinc/45/56/67/1053455667.db2.gz ZZCLOEJBYFFFNI-HDICACEKSA-N 2 0 332.532 4.164 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)s1 ZINC000765307575 1053503439 /nfs/dbraw/zinc/50/34/39/1053503439.db2.gz ZXFMQNKWSQYDHZ-CVEARBPZSA-N 2 0 332.513 4.409 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cnc(Cl)c(F)c2)c1 ZINC000865433135 1053504287 /nfs/dbraw/zinc/50/42/87/1053504287.db2.gz FXKUMKQXKOUHMA-UHFFFAOYSA-N 2 0 335.854 4.004 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+]CCc2cc(Cl)cc(Cl)c2)CC1 ZINC000765357281 1053513588 /nfs/dbraw/zinc/51/35/88/1053513588.db2.gz ACXMRAWSHHYMOH-UHFFFAOYSA-N 2 0 329.315 4.388 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)c1cccc(F)c1 ZINC000765360762 1053517003 /nfs/dbraw/zinc/51/70/03/1053517003.db2.gz SHQMWRMNRHXVFX-SJORKVTESA-N 2 0 344.474 4.220 20 0 EIADRP C[C@@H](CSC(C)(C)C)[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000765450258 1053549513 /nfs/dbraw/zinc/54/95/13/1053549513.db2.gz PBYNWNYEOWEPQC-HKUYNNGSSA-N 2 0 334.573 4.408 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccnc(Cl)c1 ZINC000765449394 1053551880 /nfs/dbraw/zinc/55/18/80/1053551880.db2.gz JJJAPKMQMWUBKW-FUHWJXTLSA-N 2 0 343.902 4.298 20 0 EIADRP CC[NH+](CC)Cc1ccccc1CNCc1nc(C(C)(C)C)co1 ZINC000921514345 1053563029 /nfs/dbraw/zinc/56/30/29/1053563029.db2.gz YUNGWPSVLIQYKT-UHFFFAOYSA-N 2 0 329.488 4.104 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2cc(Cl)cc3cccnc32)CC1 ZINC000865765184 1053587500 /nfs/dbraw/zinc/58/75/00/1053587500.db2.gz KAWSBLMWTOIIQB-UHFFFAOYSA-N 2 0 331.891 4.241 20 0 EIADRP Clc1nc2ccccc2cc1C[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000852753541 1053610992 /nfs/dbraw/zinc/61/09/92/1053610992.db2.gz DGFGTUOUIKHWEN-KRWDZBQOSA-N 2 0 343.902 4.100 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)CCc2cncc3ccccc32)C1 ZINC000866260912 1053666896 /nfs/dbraw/zinc/66/68/96/1053666896.db2.gz PHORDZFIMHHLHA-RBUKOAKNSA-N 2 0 339.527 4.266 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@H](C)CCc2cncc3ccccc32)CC1 ZINC000866289384 1053678412 /nfs/dbraw/zinc/67/84/12/1053678412.db2.gz CACWIFITZXIOEG-QGZVFWFLSA-N 2 0 325.500 4.018 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+][C@@H](CCc2ccccc2)c2ccccn2)CC1 ZINC000866337085 1053695959 /nfs/dbraw/zinc/69/59/59/1053695959.db2.gz OHNSAHKMNGSWAG-NRFANRHFSA-N 2 0 337.511 4.077 20 0 EIADRP CCOc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000386416508 1053712964 /nfs/dbraw/zinc/71/29/64/1053712964.db2.gz YTOLFOWGZUAATJ-GHTZIAJQSA-N 2 0 338.495 4.086 20 0 EIADRP C[C@H]([NH2+]CCC1CC[NH+](Cc2ccccc2)CC1)c1cncs1 ZINC000866469732 1053740441 /nfs/dbraw/zinc/74/04/41/1053740441.db2.gz KRDHXIZBDZCDSH-INIZCTEOSA-N 2 0 329.513 4.096 20 0 EIADRP C[C@@H]([NH2+]CCC1CC[NH+](Cc2ccccc2)CC1)c1cscn1 ZINC000866468830 1053740833 /nfs/dbraw/zinc/74/08/33/1053740833.db2.gz DJQWTPCOFIIZFT-MRXNPFEDSA-N 2 0 329.513 4.096 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ccc(C)o2)ccc1OC ZINC000866479085 1053745771 /nfs/dbraw/zinc/74/57/71/1053745771.db2.gz PQGAUYZEGQURCP-INIZCTEOSA-N 2 0 330.472 4.289 20 0 EIADRP CC(C)Oc1cccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000386492479 1053749010 /nfs/dbraw/zinc/74/90/10/1053749010.db2.gz XTCRMKZHSGDKPM-OAQYLSRUSA-N 2 0 338.495 4.086 20 0 EIADRP Cc1cccnc1[C@H]1CCC[C@@H]([NH2+]C2CCC(C)([NH+](C)C)CC2)C1 ZINC000866518134 1053763998 /nfs/dbraw/zinc/76/39/98/1053763998.db2.gz TVVYHTJJIAVIHX-VWMQHHCSSA-N 2 0 329.532 4.269 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C2CCC(C)([NH+](C)C)CC2)C1 ZINC000866518130 1053764329 /nfs/dbraw/zinc/76/43/29/1053764329.db2.gz TVVYHTJJIAVIHX-GUFYVYCGSA-N 2 0 329.532 4.269 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000866516659 1053764513 /nfs/dbraw/zinc/76/45/13/1053764513.db2.gz RWRZWJWUYPESLZ-AFVILVPDSA-N 2 0 330.516 4.007 20 0 EIADRP CC(C)C[N@@H+](Cc1cc(Cl)ccc1F)CC1CC[NH+](C)CC1 ZINC001197194253 1053850590 /nfs/dbraw/zinc/85/05/90/1053850590.db2.gz KOKYIJZXZRLMAK-UHFFFAOYSA-N 2 0 326.887 4.279 20 0 EIADRP CC(C)C[N@@H+](Cc1cnc(-c2ccccc2)o1)CC1CC[NH+](C)CC1 ZINC001197194523 1053851288 /nfs/dbraw/zinc/85/12/88/1053851288.db2.gz PGIQYXSTVHVWRK-UHFFFAOYSA-N 2 0 341.499 4.141 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H](Cc2ccccc2F)c2ccccc2)CC1 ZINC000429518448 1053885619 /nfs/dbraw/zinc/88/56/19/1053885619.db2.gz UKHOKALITNIDAN-OAQYLSRUSA-N 2 0 326.459 4.041 20 0 EIADRP CC(C)[N@H+](C)Cc1cc(O[C@@H]2CC[NH+](C[C@H](C)C(C)(C)C)C2)ccn1 ZINC000856558419 1054085673 /nfs/dbraw/zinc/08/56/73/1054085673.db2.gz IGNGOVBHKKLAIH-FXAWDEMLSA-N 2 0 347.547 4.057 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1N ZINC001198952645 1054312588 /nfs/dbraw/zinc/31/25/88/1054312588.db2.gz QPGKTESPSARZMF-LBPRGKRZSA-N 2 0 332.319 4.176 20 0 EIADRP Fc1ccc(/C=C/C[NH2+]C[C@@H](c2ccccc2)N2CCCC2)c(F)c1 ZINC001198967736 1054312844 /nfs/dbraw/zinc/31/28/44/1054312844.db2.gz BZNJKGZGBBDBFQ-JLXBBBJOSA-N 2 0 342.433 4.405 20 0 EIADRP CCCOc1cccc(C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c1 ZINC001199320036 1054390597 /nfs/dbraw/zinc/39/05/97/1054390597.db2.gz HAGSUXFCMGHING-KDURUIRLSA-N 2 0 332.532 4.323 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CC[C@@H](C)[C@@H](C)C1 ZINC001199329100 1054392035 /nfs/dbraw/zinc/39/20/35/1054392035.db2.gz NEAYVFVJFIKHQO-WSTZPKSXSA-N 2 0 332.532 4.322 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2ncccc12)c1cccc(OCC[NH+](C)C)c1 ZINC000872125110 1054404220 /nfs/dbraw/zinc/40/42/20/1054404220.db2.gz YDBAZBHFZPJKSO-QGZVFWFLSA-N 2 0 349.478 4.026 20 0 EIADRP CC1(C)CCC[C@H]([NH2+]CCCC[NH+]2CCN(c3ccccc3)CC2)C1 ZINC001199403212 1054405939 /nfs/dbraw/zinc/40/59/39/1054405939.db2.gz LOVMAUVBJCYCLL-FQEVSTJZSA-N 2 0 343.559 4.147 20 0 EIADRP FC(F)Sc1ccc(C[NH2+]Cc2ccc(-n3ccnc3)cc2)cc1 ZINC001199895980 1054483756 /nfs/dbraw/zinc/48/37/56/1054483756.db2.gz GEAAQVBACFQAAV-UHFFFAOYSA-N 2 0 345.418 4.477 20 0 EIADRP c1ccc2oc(CNCc3cccc(C[NH+]4CCCCCC4)c3)nc2c1 ZINC001199896012 1054484692 /nfs/dbraw/zinc/48/46/92/1054484692.db2.gz HHXAOVMXZFKKBS-UHFFFAOYSA-N 2 0 349.478 4.494 20 0 EIADRP COc1ccc(-c2ccccc2C)cc1CN[C@@H](C)CC[NH+](C)C ZINC001199907471 1054487306 /nfs/dbraw/zinc/48/73/06/1054487306.db2.gz XAYBTGNAWZFHPQ-KRWDZBQOSA-N 2 0 326.484 4.100 20 0 EIADRP CS[C@@H]1CCC[C@@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)C1 ZINC001199883253 1054490947 /nfs/dbraw/zinc/49/09/47/1054490947.db2.gz HSTZIYCBNTXBLS-IAGOWNOFSA-N 2 0 338.586 4.224 20 0 EIADRP [NH3+][C@H](C[C@@H]1CCC[N@H+](Cc2cnc(C3CC3)s2)C1)C1CCCC1 ZINC000873232526 1054509960 /nfs/dbraw/zinc/50/99/60/1054509960.db2.gz SDZZWXWQRPDLKB-KBXCAEBGSA-N 2 0 333.545 4.140 20 0 EIADRP Clc1ccc2c(c1)[C@@H]([NH2+]Cc1cc3c(s1)CC[NH2+]C3)CCC2 ZINC000873212595 1054510148 /nfs/dbraw/zinc/51/01/48/1054510148.db2.gz OYYIEOCDNRDZCO-KRWDZBQOSA-N 2 0 332.900 4.214 20 0 EIADRP FC(F)(F)[C@@H]1CC=CC[C@H]1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000873250239 1054515380 /nfs/dbraw/zinc/51/53/80/1054515380.db2.gz FIAPMMLKTBVFGY-ZOFXXKQRSA-N 2 0 330.438 4.032 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000873259150 1054517841 /nfs/dbraw/zinc/51/78/41/1054517841.db2.gz YECMPUKVKKLMOO-JRKPZEMJSA-N 2 0 340.311 4.112 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873267789 1054517858 /nfs/dbraw/zinc/51/78/58/1054517858.db2.gz JSWVWRXKMOMEAI-ZIAGYGMSSA-N 2 0 329.513 4.157 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873273281 1054519351 /nfs/dbraw/zinc/51/93/51/1054519351.db2.gz ZWPWUYZIVMODNI-QWHCGFSZSA-N 2 0 347.503 4.296 20 0 EIADRP Cc1ccc2ncc(C[N@@H+](C)Cc3ccc(C[NH+](C)C)cc3)cc2c1 ZINC000859213340 1054644660 /nfs/dbraw/zinc/64/46/60/1054644660.db2.gz WCMLZLIUPRLSMC-UHFFFAOYSA-N 2 0 333.479 4.237 20 0 EIADRP CN(Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(Cl)nc1Cl ZINC000859212965 1054645671 /nfs/dbraw/zinc/64/56/71/1054645671.db2.gz PJUBQRKEFQTVNM-UHFFFAOYSA-N 2 0 338.282 4.082 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cc(-c3ccccc3)no2)cc1 ZINC000859214579 1054645707 /nfs/dbraw/zinc/64/57/07/1054645707.db2.gz KXGCLARJYUGQBN-UHFFFAOYSA-N 2 0 335.451 4.035 20 0 EIADRP Cc1ccc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c(C)c1 ZINC000060952654 1054733130 /nfs/dbraw/zinc/73/31/30/1054733130.db2.gz YPYUQXDTBXKVPW-UHFFFAOYSA-N 2 0 328.525 4.367 20 0 EIADRP CCc1ccc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1 ZINC000060952650 1054733500 /nfs/dbraw/zinc/73/35/00/1054733500.db2.gz VECJTLDGSVRWFM-UHFFFAOYSA-N 2 0 328.525 4.312 20 0 EIADRP COc1cc(NC2=C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)[nH+]cc1C ZINC001201474644 1054827807 /nfs/dbraw/zinc/82/78/07/1054827807.db2.gz ISVBJYFNMZURFR-MOPGFXCFSA-N 2 0 335.451 4.131 20 0 EIADRP CCC[C@@H](C)C[NH+]1CCC2(CC([N@H+](C)Cc3ccncc3)C2)CC1 ZINC001201543839 1054837368 /nfs/dbraw/zinc/83/73/68/1054837368.db2.gz LBXRLFACSMYEEQ-GOSISDBHSA-N 2 0 329.532 4.194 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(C(F)(F)F)cc2)C1 ZINC001201559507 1054849064 /nfs/dbraw/zinc/84/90/64/1054849064.db2.gz ZEHIOMAJVAETLB-MRXNPFEDSA-N 2 0 328.422 4.163 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)c1ccc(C(C)(C)C)cc1 ZINC000173427975 1054945810 /nfs/dbraw/zinc/94/58/10/1054945810.db2.gz UNILHGHLMYOJJQ-ZWKOTPCHSA-N 2 0 344.543 4.136 20 0 EIADRP COc1ccc(C[NH2+]CC[C@H](C)[NH+]2CCCCC2)cc1C(C)(C)C ZINC001201962404 1054968033 /nfs/dbraw/zinc/96/80/33/1054968033.db2.gz AXJFRRNQVBUHEI-KRWDZBQOSA-N 2 0 332.532 4.347 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2cc3c(ccnc3Cl)o2)CC1 ZINC000876934520 1054987209 /nfs/dbraw/zinc/98/72/09/1054987209.db2.gz ISZCZVNWIULRJA-UHFFFAOYSA-N 2 0 335.879 4.083 20 0 EIADRP CS[C@@H]1CC[C@H]([NH2+][C@H]2CCN(C3CC3)[C@H](c3ccccc3)C2)C1 ZINC000877070926 1055010628 /nfs/dbraw/zinc/01/06/28/1055010628.db2.gz YVAQTJYWMDZCNL-XEYPJELSSA-N 2 0 330.541 4.228 20 0 EIADRP CS[C@@H]1CC[C@H]([NH2+][C@@H]2CCN(C3CC3)[C@@H](c3ccccc3)C2)C1 ZINC000877070924 1055012370 /nfs/dbraw/zinc/01/23/70/1055012370.db2.gz YVAQTJYWMDZCNL-ONCXSQPRSA-N 2 0 330.541 4.228 20 0 EIADRP CCO[P@](C)(=O)CC[C@@H](C)[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000877075637 1055013690 /nfs/dbraw/zinc/01/36/90/1055013690.db2.gz DGWCOEIUYMHAEC-OSPVRFOGSA-N 2 0 344.480 4.096 20 0 EIADRP Cc1c(C[NH2+]Cc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)ccnc1F ZINC000862270820 1055041238 /nfs/dbraw/zinc/04/12/38/1055041238.db2.gz TTZDLMNGLMUVBP-MRXNPFEDSA-N 2 0 341.474 4.193 20 0 EIADRP C[NH+]1CCC2(CCC[N@H+](Cc3csc(C(F)(F)F)c3)C2)CC1 ZINC000862352446 1055051680 /nfs/dbraw/zinc/05/16/80/1055051680.db2.gz HJDOHBQWDQUUGL-UHFFFAOYSA-N 2 0 332.435 4.075 20 0 EIADRP Cc1cc([NH+]2CCCCCC2)ccc1N[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000671766316 1055072233 /nfs/dbraw/zinc/07/22/33/1055072233.db2.gz CWVSLAHOOGJBMC-OALUTQOASA-N 2 0 327.516 4.414 20 0 EIADRP c1ccc([C@@H]2C[C@@H]([NH2+]CC[C@@H]3CCSC3)CCN2C2CC2)cc1 ZINC000877661545 1055101506 /nfs/dbraw/zinc/10/15/06/1055101506.db2.gz DTLXRJAVMCMWGO-KPFFTGBYSA-N 2 0 330.541 4.087 20 0 EIADRP C[N@H+](Cc1cccs1)[C@@H]1CCC[C@H]2C[NH+](CCC(F)(F)F)C[C@@H]21 ZINC001202328548 1055142638 /nfs/dbraw/zinc/14/26/38/1055142638.db2.gz HNJRBGOQNWHGLN-CWRNSKLLSA-N 2 0 346.462 4.233 20 0 EIADRP C[C@@H]([NH2+]Cc1nc2c(s1)CCCC2)c1cccc(-n2ccnc2)c1 ZINC000776367158 1055223553 /nfs/dbraw/zinc/22/35/53/1055223553.db2.gz YZQZTBXYYGNTBA-CQSZACIVSA-N 2 0 338.480 4.058 20 0 EIADRP FC(F)n1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)c2ccccc21 ZINC000863548090 1055226608 /nfs/dbraw/zinc/22/66/08/1055226608.db2.gz USDQNPYWSMIJRP-IXDOHACOSA-N 2 0 333.426 4.047 20 0 EIADRP C(C1CCCCC1)[NH+]1CCC([NH2+][C@@H]2CCOC3(CCCC3)C2)CC1 ZINC000127281611 1055376521 /nfs/dbraw/zinc/37/65/21/1055376521.db2.gz RKBZECUIZPKJOW-HXUWFJFHSA-N 2 0 334.548 4.113 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@H]1CCCCc2cc(Br)ccc21 ZINC000338671172 1055506987 /nfs/dbraw/zinc/50/69/87/1055506987.db2.gz ABHOTQDEJKMKSH-KRWDZBQOSA-N 2 0 339.321 4.148 20 0 EIADRP Cc1cc(C[NH2+]C[C@@H]2CCCC[N@@H+](C)C2)ccc1Oc1cccnc1 ZINC000623656529 1055526613 /nfs/dbraw/zinc/52/66/13/1055526613.db2.gz WFPBPVXGNAXWRB-IBGZPJMESA-N 2 0 339.483 4.004 20 0 EIADRP C[C@@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1cncs1 ZINC000903312415 1055573134 /nfs/dbraw/zinc/57/31/34/1055573134.db2.gz VQDUIQLAXQGPMM-FAEJEUNOSA-N 2 0 329.513 4.237 20 0 EIADRP CCN(C)c1ccccc1C[NH2+][C@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000765849465 1055890376 /nfs/dbraw/zinc/89/03/76/1055890376.db2.gz OVLCSIDKPZVHFE-QGZVFWFLSA-N 2 0 348.494 4.488 20 0 EIADRP C[C@H]([NH2+]CCCc1cccs1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000542818644 1056119168 /nfs/dbraw/zinc/11/91/68/1056119168.db2.gz XZRXJUXHEZVART-PKOBYXMFSA-N 2 0 328.525 4.181 20 0 EIADRP CC(C)[NH+]1CCC([NH2+]Cc2ccc(N(C)c3ccccc3)cc2)CC1 ZINC000620857502 1056724808 /nfs/dbraw/zinc/72/48/08/1056724808.db2.gz AXSCWBDFOHTICX-UHFFFAOYSA-N 2 0 337.511 4.417 20 0 EIADRP Clc1cccc2c1C[C@H]([NH2+]CC1CC[NH+](C3CCCCC3)CC1)C2 ZINC001168689596 1056774062 /nfs/dbraw/zinc/77/40/62/1056774062.db2.gz HBBVAYPIUABRSN-GOSISDBHSA-N 2 0 346.946 4.442 20 0 EIADRP Cc1n[nH]cc1[C@H](C)[NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000180143853 1058379899 /nfs/dbraw/zinc/37/98/99/1058379899.db2.gz FXFACPCRCAEDRM-BBWFWOEESA-N 2 0 340.515 4.047 20 0 EIADRP S=c1ccn(C[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)c2ccccc12 ZINC000742169646 1058530684 /nfs/dbraw/zinc/53/06/84/1058530684.db2.gz FHXFYZAWNQJYBT-QGZVFWFLSA-N 2 0 341.524 4.136 20 0 EIADRP c1cc2cnccc2c(C[N@H+]2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1 ZINC000183252256 1059964687 /nfs/dbraw/zinc/96/46/87/1059964687.db2.gz ZFRZTBFKYPXKPJ-IBGZPJMESA-N 2 0 337.511 4.323 20 0 EIADRP C[C@@H]1CCCC[C@@H]1C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001168825268 1060430455 /nfs/dbraw/zinc/43/04/55/1060430455.db2.gz HRUOHJMONODKKW-UYAOXDASSA-N 2 0 329.532 4.446 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1ccc2c(c1)CCO2 ZINC000766512490 1060454778 /nfs/dbraw/zinc/45/47/78/1060454778.db2.gz LJRFWNGZLJLLFQ-PBPGXSGUSA-N 2 0 328.500 4.069 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCC[NH+](C(C)C)C(C)C)cc1 ZINC000348093938 1060553369 /nfs/dbraw/zinc/55/33/69/1060553369.db2.gz VFGVKMDEDNRGLP-SFHVURJKSA-N 2 0 342.531 4.340 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CCCc1ccc(Cl)cc1Cl)C2 ZINC001169101883 1060635890 /nfs/dbraw/zinc/63/58/90/1060635890.db2.gz VXDDJCCFSFWRMG-PHZGNYQRSA-N 2 0 327.299 4.141 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CC(C)(c1ccccc1)c1ccccc1)C2 ZINC001169089555 1060644766 /nfs/dbraw/zinc/64/47/66/1060644766.db2.gz CPVBCJOHMCNHSX-KOUNCHBCSA-N 2 0 334.507 4.207 20 0 EIADRP CC1(C)C[C@H](Nc2ccc([C@@H]3CCC[NH2+]C3)cc2)C[C@](C)(C[NH3+])C1 ZINC001169145228 1060665574 /nfs/dbraw/zinc/66/55/74/1060665574.db2.gz DGPYIKWOCHAIDI-LMNJBCLMSA-N 2 0 329.532 4.109 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+](CCc1ccccc1)Cc1ccccc1)C2 ZINC001169148094 1060666715 /nfs/dbraw/zinc/66/67/15/1060666715.db2.gz YPZWHUWNCUQCLC-JKHIJQBDSA-N 2 0 334.507 4.357 20 0 EIADRP CC[N@H+](Cc1cccc(C(F)(F)F)c1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169154948 1060670404 /nfs/dbraw/zinc/67/04/04/1060670404.db2.gz VBBSRQTUACIPOC-FVQHAEBGSA-N 2 0 326.406 4.153 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC[C@H]1c1ccc(C(F)(F)F)cc1)C2 ZINC001169154260 1060670672 /nfs/dbraw/zinc/67/06/72/1060670672.db2.gz PCDDHHYQTQGNMG-MHORFTMASA-N 2 0 338.417 4.468 20 0 EIADRP C[C@H](c1cccc(Br)c1)[N@H+](C)[C@@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169162480 1060674191 /nfs/dbraw/zinc/67/41/91/1060674191.db2.gz TZKBJVHQKJIXTQ-VDNDLQMASA-N 2 0 337.305 4.067 20 0 EIADRP C[C@H]1C[N@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)CCC[C@@H]1C[NH3+] ZINC001206011911 1060841639 /nfs/dbraw/zinc/84/16/39/1060841639.db2.gz HANOUXUPGYBENU-WCQYABFASA-N 2 0 334.813 4.166 20 0 EIADRP C[C@@H]1C[N@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)CCC[C@@H]1C[NH3+] ZINC001206011910 1060842593 /nfs/dbraw/zinc/84/25/93/1060842593.db2.gz HANOUXUPGYBENU-DGCLKSJQSA-N 2 0 334.813 4.166 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1ccc([C@H]2CC[N@@H+](C)C2)cc1 ZINC001169690534 1060902560 /nfs/dbraw/zinc/90/25/60/1060902560.db2.gz WSWYFEDAXUMUDI-RXVVDRJESA-N 2 0 335.495 4.346 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1cc[nH+]c(N2CCCCC2)c1 ZINC001169695615 1060904025 /nfs/dbraw/zinc/90/40/25/1060904025.db2.gz IPBUPYVIWQWAJK-LJQANCHMSA-N 2 0 336.483 4.312 20 0 EIADRP C[N@@H+]1CCC[C@H]1CCN1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000767370737 1061215498 /nfs/dbraw/zinc/21/54/98/1061215498.db2.gz DTVZWJPXPHGDJA-YOEHRIQHSA-N 2 0 326.406 4.327 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CCc3c2cccc3Cl)ccc1F ZINC000532223327 1032102535 /nfs/dbraw/zinc/10/25/35/1032102535.db2.gz JWJJRLAVFNMQTP-IBGZPJMESA-N 2 0 332.850 4.318 20 0 EIADRP CC(C)=CCOc1ccc(CC[C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)cc1 ZINC000532225971 1032103036 /nfs/dbraw/zinc/10/30/36/1032103036.db2.gz GIPOACTXIFXJGR-TZIWHRDSSA-N 2 0 344.543 4.284 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2ccccc2C(F)(F)F)CC1 ZINC000532236110 1032117480 /nfs/dbraw/zinc/11/74/80/1032117480.db2.gz UDWJCXUIKCBMHB-AWEZNQCLSA-N 2 0 328.422 4.478 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1C[C@H](C)c2c1cccc2Br ZINC000423434071 1038234851 /nfs/dbraw/zinc/23/48/51/1038234851.db2.gz NSOWKIZRPTYTGW-ZOWXZIJZSA-N 2 0 325.294 4.105 20 0 EIADRP CN(Cc1ccco1)Cc1ccc(F)c(CN(C)Cc2ccco2)c1 ZINC000450221762 1032359688 /nfs/dbraw/zinc/35/96/88/1032359688.db2.gz VWDYHBQJBNBTDN-UHFFFAOYSA-N 2 0 342.414 4.276 20 0 EIADRP Cc1cc(C)c([C@@H](C)[NH+]2CCC(OCC[NH+]3CCCC3)CC2)c(C)c1 ZINC000532989241 1032428711 /nfs/dbraw/zinc/42/87/11/1032428711.db2.gz KUPWHGIWCFJLAQ-HXUWFJFHSA-N 2 0 344.543 4.250 20 0 EIADRP C[C@@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)C1CC(F)(F)C1 ZINC000529547952 1032438837 /nfs/dbraw/zinc/43/88/37/1032438837.db2.gz ZHAGYXRYZAPTAB-OLMMMNRUSA-N 2 0 336.470 4.166 20 0 EIADRP C[C@H]([NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C)C1CC(F)(F)C1 ZINC000529547950 1032440234 /nfs/dbraw/zinc/44/02/34/1032440234.db2.gz ZHAGYXRYZAPTAB-CYJAXWMASA-N 2 0 336.470 4.166 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1)C1CC(F)(F)C1 ZINC000529575083 1032455448 /nfs/dbraw/zinc/45/54/48/1032455448.db2.gz PTTVBMCICXBFGK-FUHWJXTLSA-N 2 0 336.470 4.312 20 0 EIADRP C[C@@H](c1ccc(CN2CC[C@@H](C[NH+]3CCCC3)C2)cc1)C(F)(F)F ZINC000450427246 1032487192 /nfs/dbraw/zinc/48/71/92/1032487192.db2.gz FFOPRUKBJWKTEV-RDJZCZTQSA-N 2 0 340.433 4.270 20 0 EIADRP C[N@H+](C[C@H]1CCCCC1(F)F)C1CCN(Cc2ccccc2)CC1 ZINC000450569482 1032561123 /nfs/dbraw/zinc/56/11/23/1032561123.db2.gz WUQOOUBBXLQHOJ-GOSISDBHSA-N 2 0 336.470 4.408 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc(Cl)nc1 ZINC000760174783 1032572256 /nfs/dbraw/zinc/57/22/56/1032572256.db2.gz ZCJCNBODKRODBJ-FUHWJXTLSA-N 2 0 343.902 4.298 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)C[C@H]1CCC(F)(F)C1 ZINC000450654489 1032625377 /nfs/dbraw/zinc/62/53/77/1032625377.db2.gz RQMWEAQCIRUGKI-KRWDZBQOSA-N 2 0 337.458 4.055 20 0 EIADRP CCC[C@@H](NCC[C@H](C)[N@H+](C)Cc1ccccc1)c1ccccn1 ZINC000500619756 1032726856 /nfs/dbraw/zinc/72/68/56/1032726856.db2.gz UQRIWIGODPXZCC-AZUAARDMSA-N 2 0 325.500 4.423 20 0 EIADRP CC[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(Br)cc1 ZINC000643546172 1018899977 /nfs/dbraw/zinc/89/99/77/1018899977.db2.gz JXMBMOPLNXMPFK-HZPDHXFCSA-N 2 0 337.305 4.165 20 0 EIADRP C[NH+](C)[C@@H]1CCCN(Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000432793003 1032812726 /nfs/dbraw/zinc/81/27/26/1032812726.db2.gz NAJVQQBFOINWFJ-OAHLLOKOSA-N 2 0 332.488 4.470 20 0 EIADRP Cc1cnc([C@H](C)C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000274752187 1019188793 /nfs/dbraw/zinc/18/87/93/1019188793.db2.gz HTZQEHKJOKIWON-SZVBFZGTSA-N 2 0 343.540 4.055 20 0 EIADRP C[NH+](C)[C@H]1CCC[N@H+](Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000432796464 1032819558 /nfs/dbraw/zinc/81/95/58/1032819558.db2.gz AMUDMZYRSALFLB-KRWDZBQOSA-N 2 0 332.488 4.470 20 0 EIADRP CCN(Cc1ccccc1)c1ccc(C[NH2+][C@H](C)CC[NH+](C)C)cc1 ZINC000065981538 1019375069 /nfs/dbraw/zinc/37/50/69/1019375069.db2.gz UBKDNEVHYOZVRQ-LJQANCHMSA-N 2 0 339.527 4.143 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)cn2)c1 ZINC000274945396 1019875502 /nfs/dbraw/zinc/87/55/02/1019875502.db2.gz UJNUDPJXELPALK-HNNXBMFYSA-N 2 0 331.891 4.426 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc(Cl)cn1 ZINC000274961671 1019878837 /nfs/dbraw/zinc/87/88/37/1019878837.db2.gz WXEBUAXHEYEVNC-ZLPCBKJTSA-N 2 0 335.923 4.429 20 0 EIADRP c1c[nH]c([C@@H]2CCC[NH+]2CCCCC[N@@H+]2CCC[C@H]2c2ccc[nH]2)c1 ZINC000533491656 1019888032 /nfs/dbraw/zinc/88/80/32/1019888032.db2.gz GYDGRFNBCFSBRP-SFTDATJTSA-N 2 0 340.515 4.487 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1Cl ZINC000123627830 1020239027 /nfs/dbraw/zinc/23/90/27/1020239027.db2.gz JHBWCTCOICQSRE-CQSZACIVSA-N 2 0 332.875 4.261 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+]C3CCC(C)CC3)CC2)cc1 ZINC000237288674 1020762442 /nfs/dbraw/zinc/76/24/42/1020762442.db2.gz JLUBIDIGLWYLSA-UHFFFAOYSA-N 2 0 330.516 4.076 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655803780 1020975260 /nfs/dbraw/zinc/97/52/60/1020975260.db2.gz DNODXFHEDBLZGE-ZACQAIPSSA-N 2 0 327.516 4.154 20 0 EIADRP CC[C@H]([NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)[C@@H]1CCCCO1 ZINC000655846806 1021011061 /nfs/dbraw/zinc/01/10/61/1021011061.db2.gz LZNVEOHGIYKVDN-NYVOZVTQSA-N 2 0 344.543 4.019 20 0 EIADRP C[C@@H](NC1CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cc1F ZINC000122162687 1021039321 /nfs/dbraw/zinc/03/93/21/1021039321.db2.gz LHKPGVMTSKDCET-OAHLLOKOSA-N 2 0 330.422 4.280 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000340471392 1021078786 /nfs/dbraw/zinc/07/87/86/1021078786.db2.gz WJIZFGCZRKDVEF-OAQYLSRUSA-N 2 0 338.495 4.401 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]CCCCC[NH+]1CCCC1)CCS2 ZINC000340475279 1021094712 /nfs/dbraw/zinc/09/47/12/1021094712.db2.gz MNQVYOWWASIOBI-SFHVURJKSA-N 2 0 334.529 4.088 20 0 EIADRP c1ccc(C[N@H+]2CCC[C@H](C[NH2+][C@@H]3CCCNc4ccccc43)C2)cc1 ZINC000683690498 1021098580 /nfs/dbraw/zinc/09/85/80/1021098580.db2.gz LXCNRXJQOCVLDR-NFBKMPQASA-N 2 0 349.522 4.435 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1cncs1 ZINC000155768393 1021609274 /nfs/dbraw/zinc/60/92/74/1021609274.db2.gz DWCCRZDBAOPXLF-CVEARBPZSA-N 2 0 329.513 4.226 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cscc2C(F)(F)F)CC1 ZINC000685834621 1021654169 /nfs/dbraw/zinc/65/41/69/1021654169.db2.gz QKSPZQRRNDHEDW-UHFFFAOYSA-N 2 0 334.451 4.319 20 0 EIADRP CCCO[C@@H]1CCC[N@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC001167363522 1021734753 /nfs/dbraw/zinc/73/47/53/1021734753.db2.gz AUTMZCUEXLQQPK-JOCHJYFZSA-N 2 0 344.543 4.454 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)C1 ZINC000580225600 1021779443 /nfs/dbraw/zinc/77/94/43/1021779443.db2.gz UTMDEGDQYQEHMI-PKOBYXMFSA-N 2 0 332.536 4.133 20 0 EIADRP Clc1ccc([C@@H]2CCC[C@@H]([NH2+][C@H]3CCn4ccnc4C3)C2)cc1 ZINC000414131997 1021903970 /nfs/dbraw/zinc/90/39/70/1021903970.db2.gz LRWRQGSCOZPAGS-NXHRZFHOSA-N 2 0 329.875 4.167 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CC[C@H]2CCC[N@H+](C)C2)c2ccccc12 ZINC000414173960 1022030751 /nfs/dbraw/zinc/03/07/51/1022030751.db2.gz HEMSHFWOHXDMIF-DLBZAZTESA-N 2 0 326.484 4.231 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000398053768 1022051163 /nfs/dbraw/zinc/05/11/63/1022051163.db2.gz YTONRPZHVFJZJR-MGPUTAFESA-N 2 0 346.877 4.479 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]CC[C@@H]2CCC[N@H+](C)C2)sc1Br ZINC000414193284 1022086357 /nfs/dbraw/zinc/08/63/57/1022086357.db2.gz SYLISOSGWOFARE-OLZOCXBDSA-N 2 0 345.350 4.202 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)c1cncc(F)c1 ZINC000155772730 1022163026 /nfs/dbraw/zinc/16/30/26/1022163026.db2.gz NQYXKBRCQLZBMB-SJORKVTESA-N 2 0 341.474 4.303 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC000236665625 1022185084 /nfs/dbraw/zinc/18/50/84/1022185084.db2.gz JNZBQTOSWYHEHI-UHFFFAOYSA-N 2 0 332.875 4.176 20 0 EIADRP COc1cccc(C[C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000089622953 1022219561 /nfs/dbraw/zinc/21/95/61/1022219561.db2.gz AXMAWBOUPUCTCF-KRWDZBQOSA-N 2 0 330.516 4.013 20 0 EIADRP Cc1cc(F)ncc1C[NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000892570762 1022240666 /nfs/dbraw/zinc/24/06/66/1022240666.db2.gz NSFIOPSFCUIXSH-QGZVFWFLSA-N 2 0 341.474 4.193 20 0 EIADRP CSC1(C[NH2+]Cc2cc(-c3ccccc3)cs2)CC[NH+](C)CC1 ZINC000580604055 1022290646 /nfs/dbraw/zinc/29/06/46/1022290646.db2.gz HGYAXTVCABNWKJ-UHFFFAOYSA-N 2 0 346.565 4.332 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@@H](C)CC(F)(F)F)CC1 ZINC000414264534 1022340197 /nfs/dbraw/zinc/34/01/97/1022340197.db2.gz KOEMPTAFJPUMJV-JKSUJKDBSA-N 2 0 342.449 4.260 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2cccc(OC3CCCC3)c2)CC1 ZINC000511506534 1022520019 /nfs/dbraw/zinc/52/00/19/1022520019.db2.gz QRACCZZQIWLSAP-UHFFFAOYSA-N 2 0 330.516 4.172 20 0 EIADRP COc1cccc([C@H](C)[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000310858206 1022523148 /nfs/dbraw/zinc/52/31/48/1022523148.db2.gz BYMOXHZFKZYYNU-PGRDOPGGSA-N 2 0 338.495 4.258 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)CC3 ZINC000180825808 1022545599 /nfs/dbraw/zinc/54/55/99/1022545599.db2.gz VPAQQQQWXGDEKB-KRWDZBQOSA-N 2 0 339.527 4.186 20 0 EIADRP c1nc(C[N@@H+]2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)sc1-c1ccccc1 ZINC000647542745 1022779444 /nfs/dbraw/zinc/77/94/44/1022779444.db2.gz BJFDCXQURDSEQC-MSOLQXFVSA-N 2 0 341.524 4.022 20 0 EIADRP Clc1ccc2cccnc2c1C[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647543393 1022794210 /nfs/dbraw/zinc/79/42/10/1022794210.db2.gz MNGJNWHCSWRADH-DLBZAZTESA-N 2 0 343.902 4.100 20 0 EIADRP Clc1ccc(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c2ncccc12 ZINC000647543835 1022797302 /nfs/dbraw/zinc/79/73/02/1022797302.db2.gz SRFKPSBBSHAPRI-HZPDHXFCSA-N 2 0 343.902 4.100 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+][C@H]2CN(C)Cc3ccccc32)cc1 ZINC000378407581 1022805128 /nfs/dbraw/zinc/80/51/28/1022805128.db2.gz YAGSJCRJZJWUMT-ZHRRBRCNSA-N 2 0 346.478 4.018 20 0 EIADRP CN1CC[C@H]([NH2+][C@H]2CCCc3cc(N)ccc32)C[C@H]1c1ccccc1 ZINC000423369631 1022860839 /nfs/dbraw/zinc/86/08/39/1022860839.db2.gz SUBYGKHTHQEKMK-BVSLBCMMSA-N 2 0 335.495 4.071 20 0 EIADRP CC[N@H+](Cc1ccc(C(=O)Nc2ccc([C@@H](C)[NH3+])cc2)cc1)C(C)C ZINC000178219439 1023074022 /nfs/dbraw/zinc/07/40/22/1023074022.db2.gz HXTDAWJMBBPRCY-MRXNPFEDSA-N 2 0 339.483 4.189 20 0 EIADRP C[C@H]([NH2+][C@H](Cc1ccccc1)c1cccs1)C1CC[NH+](C)CC1 ZINC000090015776 1023264820 /nfs/dbraw/zinc/26/48/20/1023264820.db2.gz SWZVLKGEOMJOQA-QFBILLFUSA-N 2 0 328.525 4.352 20 0 EIADRP COc1cccc(SCC[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000660257462 1023395864 /nfs/dbraw/zinc/39/58/64/1023395864.db2.gz TZZSCRKNKKBFNG-DLBZAZTESA-N 2 0 348.556 4.030 20 0 EIADRP CSc1ccccc1C[C@H](C)[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415050068 1023407880 /nfs/dbraw/zinc/40/78/80/1023407880.db2.gz IFQDREHFLKXPNV-LPHOPBHVSA-N 2 0 328.525 4.409 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H](CCC[NH3+])c3ccccc3)CC2)C1 ZINC000415061582 1023415374 /nfs/dbraw/zinc/41/53/74/1023415374.db2.gz YRSAXICYQKMCBS-COPCDDAFSA-N 3 0 343.559 4.099 20 0 EIADRP C[C@H]([NH2+]CCC[N@H+](C)Cc1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000310714684 1023426997 /nfs/dbraw/zinc/42/69/97/1023426997.db2.gz VKIBXSTUSBWXDC-IBGZPJMESA-N 2 0 348.494 4.045 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000415086558 1023435910 /nfs/dbraw/zinc/43/59/10/1023435910.db2.gz UTFYGRVNUUIHTN-RHSMWYFYSA-N 2 0 329.513 4.220 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]C1CC[NH2+]CC1 ZINC000415086596 1023437821 /nfs/dbraw/zinc/43/78/21/1023437821.db2.gz UVFIKILYRXYUFC-LLVKDONJSA-N 2 0 335.904 4.175 20 0 EIADRP CC[C@H](c1ccc(Br)cc1)[N@H+](C)C[C@H]1CCCN(C)C1 ZINC000472737617 1023474889 /nfs/dbraw/zinc/47/48/89/1023474889.db2.gz KLPBVDSFEFTOMX-WMLDXEAASA-N 2 0 339.321 4.174 20 0 EIADRP C[C@@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1ccc(OC(F)F)cc1 ZINC000545520857 1023478019 /nfs/dbraw/zinc/47/80/19/1023478019.db2.gz WKLUGSUAULBLRW-CQSZACIVSA-N 2 0 326.431 4.061 20 0 EIADRP Cc1ncc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)s1 ZINC000090400887 1023483090 /nfs/dbraw/zinc/48/30/90/1023483090.db2.gz DMHUZVXFDLZQEV-OAHLLOKOSA-N 2 0 329.513 4.288 20 0 EIADRP C[C@H]1C[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C[C@@H](C)C1 ZINC000341273651 1023494356 /nfs/dbraw/zinc/49/43/56/1023494356.db2.gz QHADYNZPLAPNIH-DZFIZOCASA-N 2 0 330.516 4.074 20 0 EIADRP c1nc(-c2ccccc2)sc1C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656785937 1023534365 /nfs/dbraw/zinc/53/43/65/1023534365.db2.gz NNNHCPCUVISDRZ-SFHVURJKSA-N 2 0 341.524 4.022 20 0 EIADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CCCC1 ZINC000656789498 1023536990 /nfs/dbraw/zinc/53/69/90/1023536990.db2.gz OYNDRTFMDQLHBX-CVEARBPZSA-N 2 0 326.406 4.203 20 0 EIADRP C[C@H]([NH2+]C[C@@]1(C)CC[N@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310081719 1023589945 /nfs/dbraw/zinc/58/99/45/1023589945.db2.gz JTWWQSHTFVIRIJ-LAUBAEHRSA-N 2 0 326.459 4.389 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCNc1cccc2c1C1(C=C2)CC[NH2+]CC1 ZINC001167751961 1023623183 /nfs/dbraw/zinc/62/31/83/1023623183.db2.gz QCYHWIXMLNZNMU-GOSISDBHSA-N 2 0 339.527 4.011 20 0 EIADRP Cc1ccc([C@H](C[NH2+]C2CC(c3ccccn3)C2)N2CCCC2)cc1 ZINC000377616434 1023635433 /nfs/dbraw/zinc/63/54/33/1023635433.db2.gz POBLTDAJPKWGMZ-AOMIVXANSA-N 2 0 335.495 4.063 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+][C@H]1CCCc2c(F)cc(F)cc21)c1ccccc1 ZINC000925674743 1023664650 /nfs/dbraw/zinc/66/46/50/1023664650.db2.gz KIZQZMRPZGDCOV-UXHICEINSA-N 2 0 330.422 4.412 20 0 EIADRP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1cccc(Br)c1 ZINC000020143218 1023739054 /nfs/dbraw/zinc/73/90/54/1023739054.db2.gz BKJUICPMMFFCOG-GFCCVEGCSA-N 2 0 339.321 4.409 20 0 EIADRP C[C@@H]1C[NH+](C[C@H](C[N@H+](C)Cc2ccccc2)c2ccccc2)C[C@H]1C ZINC001167483568 1023740542 /nfs/dbraw/zinc/74/05/42/1023740542.db2.gz XGHBKCQKOSKYBZ-VIZSFHNOSA-N 2 0 336.523 4.490 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000500405438 1023801163 /nfs/dbraw/zinc/80/11/63/1023801163.db2.gz ROVJHGXZFYEPBI-QINSGFPZSA-N 2 0 340.433 4.430 20 0 EIADRP Cc1c([C@H](C)[NH2+]C[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)cnn1C(C)C ZINC000364467969 1023804449 /nfs/dbraw/zinc/80/44/49/1023804449.db2.gz WSROPOXYKFETSX-LDQXTDLNSA-N 2 0 340.515 4.116 20 0 EIADRP Cc1ccc2c(c1)[C@@H](N[C@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CO2 ZINC000581962207 1023938467 /nfs/dbraw/zinc/93/84/67/1023938467.db2.gz PLZIPDQNBSZQFV-IIZPIQPGSA-N 2 0 348.490 4.214 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1cncc(F)c1 ZINC000537939340 1024022738 /nfs/dbraw/zinc/02/27/38/1024022738.db2.gz MBVYCCPJRSHGJZ-LNLFQRSKSA-N 2 0 341.474 4.172 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cc3cnccc3o2)CC1)CC1CC1 ZINC000651664886 1024120649 /nfs/dbraw/zinc/12/06/49/1024120649.db2.gz FDPJXDHJOHJMQP-UHFFFAOYSA-N 2 0 341.499 4.162 20 0 EIADRP FC(F)Oc1ccc2ccccc2c1C[NH+]1CCC2(CC[NH2+]C2)CC1 ZINC000430907748 1024208222 /nfs/dbraw/zinc/20/82/22/1024208222.db2.gz FYMNBRTZWAYOEC-UHFFFAOYSA-N 2 0 346.421 4.017 20 0 EIADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000510673081 1024209439 /nfs/dbraw/zinc/20/94/39/1024209439.db2.gz YMOKLAIZALSYGV-HKBOAZHASA-N 2 0 332.507 4.059 20 0 EIADRP Cc1cccc([C@@H]([NH2+]CC2CC[NH+](C)CC2)c2cccc(F)c2)c1 ZINC000510753284 1024387015 /nfs/dbraw/zinc/38/70/15/1024387015.db2.gz QPHFSTUEAGRBJM-OAQYLSRUSA-N 2 0 326.459 4.155 20 0 EIADRP Cc1nccn1CCCN1C[C@H](c2cccc(Cl)c2)OCC1(C)C ZINC000661740757 1024424543 /nfs/dbraw/zinc/42/45/43/1024424543.db2.gz RVLCAHAPUTXEEE-GOSISDBHSA-N 2 0 347.890 4.087 20 0 EIADRP CS[C@@H]1CCC[C@H]([NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000548483978 1024830892 /nfs/dbraw/zinc/83/08/92/1024830892.db2.gz RGRSLFXTVNAJIW-BTHPGYMESA-N 2 0 332.557 4.161 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CC3c4ccccc4C2c2ccccc23)CC[N@@H+]1C ZINC000246937161 1024863918 /nfs/dbraw/zinc/86/39/18/1024863918.db2.gz HKSRUBZRQXHUFG-OMYRSMHSSA-N 2 0 346.518 4.356 20 0 EIADRP CSc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000063551852 1024938013 /nfs/dbraw/zinc/93/80/13/1024938013.db2.gz JXLDDQPSUHYULG-UHFFFAOYSA-N 2 0 340.536 4.410 20 0 EIADRP c1ccc(C[C@H]([NH2+]Cc2cccc3c2CC[NH2+]C3)c2ccccc2)cc1 ZINC000662280507 1025027305 /nfs/dbraw/zinc/02/73/05/1025027305.db2.gz FQLWEFUJASCDGZ-DEOSSOPVSA-N 2 0 342.486 4.406 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccccc1OC(F)F ZINC000662284475 1025034626 /nfs/dbraw/zinc/03/46/26/1025034626.db2.gz YUHUWIMOEBRODC-GOSISDBHSA-N 2 0 346.421 4.175 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1nc(C(F)(F)F)cs1 ZINC000467743349 1025378067 /nfs/dbraw/zinc/37/80/67/1025378067.db2.gz YVWBUVROKLIJOH-ZDUSSCGKSA-N 2 0 349.466 4.325 20 0 EIADRP Clc1ccc(C2CC([NH2+]C[C@H]3CCC[N@H+](CC4CC4)C3)C2)cc1 ZINC000663466140 1025392262 /nfs/dbraw/zinc/39/22/62/1025392262.db2.gz ONUZGLPLPFHTCF-PPDQVPDSSA-N 2 0 332.919 4.298 20 0 EIADRP Clc1ccc(C2CC([NH2+]C[C@@H]3CCC[N@H+](CC4CC4)C3)C2)cc1 ZINC000663466141 1025392979 /nfs/dbraw/zinc/39/29/79/1025392979.db2.gz ONUZGLPLPFHTCF-VQSBYGRUSA-N 2 0 332.919 4.298 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2ncc(Cl)s2)C[N@@H+]1Cc1ccccc1 ZINC000472037152 1025460977 /nfs/dbraw/zinc/46/09/77/1025460977.db2.gz HQRSXQKRRPEMEJ-ZBFHGGJFSA-N 2 0 349.931 4.187 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1nc2c(s1)C[C@H](c1ccccc1)CC2 ZINC000415006891 1025486704 /nfs/dbraw/zinc/48/67/04/1025486704.db2.gz AQOCIQHWVKGXGN-NVXWUHKLSA-N 2 0 343.540 4.023 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1C[C@H](c2ccc(C)cc2)C[C@H]1C ZINC000426539585 1025492256 /nfs/dbraw/zinc/49/22/56/1025492256.db2.gz NEHVQJLHHAYKKK-YLJYHZDGSA-N 2 0 346.478 4.262 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]CC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000415007665 1025527172 /nfs/dbraw/zinc/52/71/72/1025527172.db2.gz BPNJSSXIYXGOID-HNNXBMFYSA-N 2 0 332.438 4.204 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(Oc2cccc(F)c2)CC1 ZINC001167827830 1025672439 /nfs/dbraw/zinc/67/24/39/1025672439.db2.gz YBULMZPDMDFJGO-QGZVFWFLSA-N 2 0 336.495 4.179 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000511045028 1025832266 /nfs/dbraw/zinc/83/22/66/1025832266.db2.gz RMTHQWIIJXLHSZ-BBKFTCMMSA-N 2 0 332.532 4.192 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1C[C@@H]2C[C@H]1CN2c1ccccc1Cl ZINC001167836177 1025844580 /nfs/dbraw/zinc/84/45/80/1025844580.db2.gz WZDWTUVAPSXSAM-BZSNNMDCSA-N 2 0 349.950 4.113 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC2(CC1)OCCc1ccccc12 ZINC001167836780 1025846280 /nfs/dbraw/zinc/84/62/80/1025846280.db2.gz HCBKDJSMCYPUNZ-IBGZPJMESA-N 2 0 344.543 4.061 20 0 EIADRP C[C@H](C[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1 ZINC000415012431 1025847122 /nfs/dbraw/zinc/84/71/22/1025847122.db2.gz XEDPCEAYMDKVOH-FYINFDKHSA-N 2 0 344.449 4.051 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)n1c2ccc(F)cc2c2c1CC[NH2+]C2 ZINC001167839436 1025851529 /nfs/dbraw/zinc/85/15/29/1025851529.db2.gz XRLMLRRTXQJQCA-OAHLLOKOSA-N 2 0 331.479 4.109 20 0 EIADRP Clc1cc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C2CC2)ccn1 ZINC001167968808 1025910611 /nfs/dbraw/zinc/91/06/11/1025910611.db2.gz VOOZSLFJTARSMU-DLZDZTESSA-N 2 0 345.918 4.181 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCN(C2CC2)[C@@H](c2ccccc2)C1)c1ccncc1 ZINC000638718845 1026032223 /nfs/dbraw/zinc/03/22/23/1026032223.db2.gz MMLXTZDIKYUINP-NQSCKRDGSA-N 2 0 335.495 4.143 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC([C@H](F)c2ccccc2F)CC1 ZINC000511075251 1026187692 /nfs/dbraw/zinc/18/76/92/1026187692.db2.gz RGDCFJQBNDXMSG-PXNSSMCTSA-N 2 0 336.470 4.423 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cc3ccncc3s2)c1 ZINC000657348029 1026211695 /nfs/dbraw/zinc/21/16/95/1026211695.db2.gz IXKUSEYTDDLBJZ-UHFFFAOYSA-N 2 0 325.481 4.038 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](CCCc2cccc(OC)c2)CC1 ZINC000303911019 1026272105 /nfs/dbraw/zinc/27/21/05/1026272105.db2.gz MTUXOYJKQFBBGD-UHFFFAOYSA-N 2 0 332.532 4.072 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)cc1OC ZINC000467834282 1026293377 /nfs/dbraw/zinc/29/33/77/1026293377.db2.gz IEFSAHODHCTBLJ-KSZLIROESA-N 2 0 348.531 4.113 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cccc(-c3ccncc3)c2)CC1 ZINC000506869320 1026476182 /nfs/dbraw/zinc/47/61/82/1026476182.db2.gz YSVFIMTYNXRZMW-UHFFFAOYSA-N 2 0 337.511 4.302 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cccc3cc[nH]c32)C1 ZINC000512214517 1026477377 /nfs/dbraw/zinc/47/73/77/1026477377.db2.gz WOIPRMWVYADPDZ-ROUUACIJSA-N 2 0 325.500 4.254 20 0 EIADRP Cc1c(F)cccc1-c1ccc(C[NH+]2CCC(C[NH+](C)C)CC2)o1 ZINC000506877487 1026482298 /nfs/dbraw/zinc/48/22/98/1026482298.db2.gz VUDBOVLXUFBQBB-UHFFFAOYSA-N 2 0 330.447 4.168 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c2ccccc12 ZINC000506912148 1026510786 /nfs/dbraw/zinc/51/07/86/1026510786.db2.gz ZBHIGPMMIVXBJD-UHFFFAOYSA-N 2 0 338.495 4.156 20 0 EIADRP C[NH+](C)CC1CC[NH+](Cc2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000506943592 1026529364 /nfs/dbraw/zinc/52/93/64/1026529364.db2.gz ILCUSPYPDUNDFB-UHFFFAOYSA-N 2 0 349.931 4.237 20 0 EIADRP CCC[N@H+](CCc1cccs1)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000344756782 1026582869 /nfs/dbraw/zinc/58/28/69/1026582869.db2.gz OEMQDYNASLALKE-UHFFFAOYSA-N 2 0 340.496 4.092 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000119805428 1026655302 /nfs/dbraw/zinc/65/53/02/1026655302.db2.gz YGHQNAKVMHCOAZ-QGZVFWFLSA-N 2 0 348.494 4.093 20 0 EIADRP CC(C)(C)OCCCC[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000512293898 1026659574 /nfs/dbraw/zinc/65/95/74/1026659574.db2.gz NDFPYPUWRAAVBQ-QFIPXVFZSA-N 2 0 344.543 4.180 20 0 EIADRP CCc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)s1 ZINC000560070988 1026672254 /nfs/dbraw/zinc/67/22/54/1026672254.db2.gz FUCZOWWZHDRLGN-UHFFFAOYSA-N 2 0 344.524 4.073 20 0 EIADRP CCC1(C[NH2+][C@@H](C)[C@@H]2CCCOC2)CC[NH+](Cc2ccccc2)CC1 ZINC000507472647 1026807564 /nfs/dbraw/zinc/80/75/64/1026807564.db2.gz RKXUIMNHSFQEMC-PZJWPPBQSA-N 2 0 344.543 4.084 20 0 EIADRP FC1(F)CCC[C@H]([NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]23)C1 ZINC000507507623 1026820762 /nfs/dbraw/zinc/82/07/62/1026820762.db2.gz IOOLLBJQJRQTIL-FCGDIQPGSA-N 2 0 334.454 4.065 20 0 EIADRP CCc1cccnc1[C@@H](C)[NH2+]Cc1ccc(C[NH+](CC)CC)cc1 ZINC000507520586 1026826722 /nfs/dbraw/zinc/82/67/22/1026826722.db2.gz ROZLTRPONUWTCT-QGZVFWFLSA-N 2 0 325.500 4.337 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(Br)ccc2C)C[C@H]1C ZINC001167586227 1026827908 /nfs/dbraw/zinc/82/79/08/1026827908.db2.gz JEHPJOCQVQDRPH-RHSMWYFYSA-N 2 0 339.321 4.062 20 0 EIADRP C[C@H](Cc1ccsc1)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000582586270 1026834047 /nfs/dbraw/zinc/83/40/47/1026834047.db2.gz LHWAMJVGWAAZDD-OTNPHJDUSA-N 2 0 340.536 4.464 20 0 EIADRP CN(CC1CC[NH+](C)CC1)c1cc[nH+]c2cc(C(F)(F)F)ccc21 ZINC000301815200 1027098344 /nfs/dbraw/zinc/09/83/44/1027098344.db2.gz ZKSBFWPREKHLCU-UHFFFAOYSA-N 2 0 337.389 4.032 20 0 EIADRP Cc1ncsc1CC[NH2+][C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168035738 1027106879 /nfs/dbraw/zinc/10/68/79/1027106879.db2.gz USSNKFGBUAGNNF-HGKCTWBKSA-N 2 0 343.540 4.025 20 0 EIADRP Cc1cc(N2CCC([NH2+]C(C)C)CC2)c2cc(OC(F)F)ccc2[nH+]1 ZINC000077216072 1027150692 /nfs/dbraw/zinc/15/06/92/1027150692.db2.gz YSYWVIOUMMXIHC-UHFFFAOYSA-N 2 0 349.425 4.111 20 0 EIADRP c1ccc(CSCC[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1 ZINC000430767325 1027194175 /nfs/dbraw/zinc/19/41/75/1027194175.db2.gz VZXKPJGDNPARQM-UHFFFAOYSA-N 2 0 332.557 4.164 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1)C[NH+]1CCCC1 ZINC000474600110 1027287682 /nfs/dbraw/zinc/28/76/82/1027287682.db2.gz UIQPZCKZDSNJLO-CBBWQLFWSA-N 2 0 326.937 4.215 20 0 EIADRP Clc1ccc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)c2ncccc12 ZINC000054317116 1027308751 /nfs/dbraw/zinc/30/87/51/1027308751.db2.gz HUKVIRSYRNNWLO-UHFFFAOYSA-N 2 0 343.902 4.196 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@@H](C)[C@H](C)c2ccc(OC)c(OC)c2)CC1 ZINC000474614531 1027311934 /nfs/dbraw/zinc/31/19/34/1027311934.db2.gz WVNCGQDHBATZNY-IRXDYDNUSA-N 2 0 348.531 4.050 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]C/C=C/c1ccccc1OC ZINC000520210337 1027319909 /nfs/dbraw/zinc/31/99/09/1027319909.db2.gz INVNIAMOKCHIPZ-GXDHUFHOSA-N 2 0 338.495 4.340 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]C/C=C\c1ccccc1OC ZINC000520210338 1027322521 /nfs/dbraw/zinc/32/25/21/1027322521.db2.gz INVNIAMOKCHIPZ-UVTDQMKNSA-N 2 0 338.495 4.340 20 0 EIADRP Cc1cc(NC2CC[NH+](Cc3cccc(C(F)(F)F)c3)CC2)cc[nH+]1 ZINC000302587733 1027340779 /nfs/dbraw/zinc/34/07/79/1027340779.db2.gz VELLCESPGJGTEY-UHFFFAOYSA-N 2 0 349.400 4.485 20 0 EIADRP CN1CC[C@@H]([NH2+][C@H]2CCCN(C)c3ccccc32)C[C@H]1c1ccccc1 ZINC000453348350 1027417396 /nfs/dbraw/zinc/41/73/96/1027417396.db2.gz GCYYCWMHUNINKH-NWSQWKLXSA-N 2 0 349.522 4.383 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2cccnc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000120483903 1027519555 /nfs/dbraw/zinc/51/95/55/1027519555.db2.gz FKLRGCXOYGYFCT-QGZVFWFLSA-N 2 0 349.478 4.026 20 0 EIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000152449850 1027557245 /nfs/dbraw/zinc/55/72/45/1027557245.db2.gz LGWNCVYBXKCSMZ-UYAOXDASSA-N 2 0 340.536 4.414 20 0 EIADRP FC(F)(F)CCC(CCC(F)(F)F)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000657706270 1027760944 /nfs/dbraw/zinc/76/09/44/1027760944.db2.gz KYOPEPAYXVVQLE-QWHCGFSZSA-N 2 0 346.359 4.256 20 0 EIADRP c1ccc(C[C@H]2CCC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)C2)cc1 ZINC001167995501 1027777097 /nfs/dbraw/zinc/77/70/97/1027777097.db2.gz HTIJQYCABLVOIZ-SSWODZADSA-N 2 0 338.539 4.347 20 0 EIADRP C[C@H]([NH2+][C@@H](C)C1CCSCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000474942042 1027809258 /nfs/dbraw/zinc/80/92/58/1027809258.db2.gz KKSJKFHPEWBXPL-ABSDTBQOSA-N 2 0 332.557 4.018 20 0 EIADRP C[C@H](Cc1ccco1)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000796682291 1027984866 /nfs/dbraw/zinc/98/48/66/1027984866.db2.gz IDVIPCINMNUIFJ-QHGAOEGBSA-N 2 0 326.484 4.243 20 0 EIADRP C[C@H](c1ccncc1)[N@H+](C)CCCCC[NH+](C)[C@@H](C)c1ccncc1 ZINC000091988587 1028148426 /nfs/dbraw/zinc/14/84/26/1028148426.db2.gz IGWFOTRNYNMTDV-KDURUIRLSA-N 2 0 340.515 4.333 20 0 EIADRP CCCCc1oc2ccccc2c1C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000324148540 1028162523 /nfs/dbraw/zinc/16/25/23/1028162523.db2.gz AXPCNKZXIZKNJI-MRXNPFEDSA-N 2 0 326.484 4.349 20 0 EIADRP CC[NH2+]CC1CC[NH+](Cc2nc3ccccc3c(C)c2Cl)CC1 ZINC000261625452 1028206679 /nfs/dbraw/zinc/20/66/79/1028206679.db2.gz BKJZTYDREIJUTO-UHFFFAOYSA-N 2 0 331.891 4.018 20 0 EIADRP c1ccc2c(c1)cccc2OCCC[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC000523556992 1028211462 /nfs/dbraw/zinc/21/14/62/1028211462.db2.gz XFYDAWBKHMEDBN-LJQANCHMSA-N 2 0 338.495 4.026 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc(F)c(F)c2)CC1 ZINC001167659935 1028263732 /nfs/dbraw/zinc/26/37/32/1028263732.db2.gz XTZFJCMFKLFAPR-INIZCTEOSA-N 2 0 336.470 4.441 20 0 EIADRP C[N@H+](CCCCC(F)(F)F)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000154725012 1028276180 /nfs/dbraw/zinc/27/61/80/1028276180.db2.gz MCLNJUGGFQEWCA-QGZVFWFLSA-N 2 0 328.422 4.173 20 0 EIADRP CC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@H](C)c1ccc(F)cc1 ZINC000346142147 1028277941 /nfs/dbraw/zinc/27/79/41/1028277941.db2.gz ACBMKYVCDDNBAO-MRXNPFEDSA-N 2 0 338.430 4.298 20 0 EIADRP [NH3+]C1CC[NH+](Cc2cccc(-c3ccc(C(F)(F)F)cc3)c2)CC1 ZINC000629696268 1028624805 /nfs/dbraw/zinc/62/48/05/1028624805.db2.gz XTCGAWAMMNCEDO-UHFFFAOYSA-N 2 0 334.385 4.296 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CC[C@@H](C)[NH+]2CCCCC2)cc1 ZINC000346870252 1028802948 /nfs/dbraw/zinc/80/29/48/1028802948.db2.gz LSLLFWLRJBCPSN-MSOLQXFVSA-N 2 0 340.515 4.096 20 0 EIADRP CC(C)C[C@H](C[N@@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1)c1ccccc1 ZINC000650707698 1028833035 /nfs/dbraw/zinc/83/30/35/1028833035.db2.gz LAIKJXQJALFBMG-DXBBTUNJSA-N 2 0 344.543 4.035 20 0 EIADRP Fc1ccc(C[NH+]2CCC3(CCC[N@H+](Cc4ccc[nH]4)C3)CC2)cc1 ZINC001279144785 1029033375 /nfs/dbraw/zinc/03/33/75/1029033375.db2.gz PLZLXRVETHUGMW-UHFFFAOYSA-N 2 0 341.474 4.032 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCSc3ccc(Cl)cc32)c(F)c1 ZINC000650752565 1029142077 /nfs/dbraw/zinc/14/20/77/1029142077.db2.gz UFQJXLDAMJAEOX-MRXNPFEDSA-N 2 0 336.863 4.265 20 0 EIADRP CCC[N@@H+]1CC[C@@H](CN[C@@H](C)c2nc(-c3ccccc3)cs2)C1 ZINC000151136431 1029145737 /nfs/dbraw/zinc/14/57/37/1029145737.db2.gz QVDJXEVDCKRJMK-HOTGVXAUSA-N 2 0 329.513 4.193 20 0 EIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650754815 1029178933 /nfs/dbraw/zinc/17/89/33/1029178933.db2.gz RUNVKPWWRSEBBI-GFCCVEGCSA-N 2 0 340.364 4.024 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H]1CCc2cc(Cl)cc(Cl)c21 ZINC000650757174 1029201095 /nfs/dbraw/zinc/20/10/95/1029201095.db2.gz QLHNZNXXRAEEFF-KRWDZBQOSA-N 2 0 335.278 4.490 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1C[NH2+]C)c1cccc(Br)c1 ZINC000650757798 1029210556 /nfs/dbraw/zinc/21/05/56/1029210556.db2.gz BAAPLFRIRBECAP-GOSISDBHSA-N 2 0 347.300 4.409 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1C[NH2+]C)c1cc(Cl)ccc1OC ZINC000650758017 1029215115 /nfs/dbraw/zinc/21/51/15/1029215115.db2.gz GVUCBNPSWSZXMW-GOSISDBHSA-N 2 0 332.875 4.309 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H]1CCSc2c(Cl)cccc21 ZINC000650758599 1029216412 /nfs/dbraw/zinc/21/64/12/1029216412.db2.gz SVWHSICKBKWTDW-KRWDZBQOSA-N 2 0 332.900 4.386 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1oc2ccc(OC)cc2c1C ZINC000650758094 1029219110 /nfs/dbraw/zinc/21/91/10/1029219110.db2.gz ITFQKIQYJNWFDV-HNNXBMFYSA-N 2 0 338.451 4.320 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000583826819 1029243816 /nfs/dbraw/zinc/24/38/16/1029243816.db2.gz CBHZFJDSRJVGLJ-INIZCTEOSA-N 2 0 325.500 4.076 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2c[nH]nc2C(C)(C)C)CC1)CC1CC1 ZINC000536141294 1029255272 /nfs/dbraw/zinc/25/52/72/1029255272.db2.gz QLQMRTRIJIIIPR-UHFFFAOYSA-N 2 0 346.563 4.041 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]CCCCC[NH+]1CCCCC1)CCS2 ZINC000343456193 1029285019 /nfs/dbraw/zinc/28/50/19/1029285019.db2.gz DJCKPJIOLPZOQY-LJQANCHMSA-N 2 0 348.556 4.478 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)CCS2 ZINC000343494393 1029367790 /nfs/dbraw/zinc/36/77/90/1029367790.db2.gz FIHMCEFVRORSJR-APWZRJJASA-N 2 0 348.556 4.334 20 0 EIADRP CSC1(C[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)CC[NH+](C)CC1 ZINC000583964736 1029431551 /nfs/dbraw/zinc/43/15/51/1029431551.db2.gz ZMZLGFIBJLDMHO-LJQANCHMSA-N 2 0 348.531 4.179 20 0 EIADRP CCC[N@H+](C1CCOCC1)[C@@H]1C[C@@H](C)N(Cc2ccccc2)[C@@H](C)C1 ZINC001168059632 1029436788 /nfs/dbraw/zinc/43/67/88/1029436788.db2.gz USQPLUTXAFCUSS-HATOLVCRSA-N 2 0 344.543 4.319 20 0 EIADRP c1nc(-c2ccccc2)sc1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000657812840 1029470390 /nfs/dbraw/zinc/47/03/90/1029470390.db2.gz HBMWDLNHGLYCTQ-UHFFFAOYSA-N 2 0 341.524 4.022 20 0 EIADRP C[C@H](CCc1ccsc1)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475265287 1029475267 /nfs/dbraw/zinc/47/52/67/1029475267.db2.gz IAKYENKSBAKLTK-XLIONFOSSA-N 2 0 328.525 4.181 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@@H]3CC[C@H](c4ccccc4)C3)C2)cc1 ZINC000475276618 1029481736 /nfs/dbraw/zinc/48/17/36/1029481736.db2.gz PHGFMRLCTISBTC-AKIFATBCSA-N 2 0 334.507 4.434 20 0 EIADRP C[C@H](CCc1ccc(F)cc1)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475270423 1029486746 /nfs/dbraw/zinc/48/67/46/1029486746.db2.gz SEXAYVRXHQITJI-WIYYLYMNSA-N 2 0 340.486 4.259 20 0 EIADRP CCOC1CCC([NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000657824906 1029597878 /nfs/dbraw/zinc/59/78/78/1029597878.db2.gz AXKACOADKTXKCT-UHFFFAOYSA-N 2 0 330.516 4.110 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(C(F)F)nc1 ZINC000657827562 1029606388 /nfs/dbraw/zinc/60/63/88/1029606388.db2.gz NLNUSNDNFBMXPG-HNNXBMFYSA-N 2 0 345.437 4.466 20 0 EIADRP Fc1ccc(-c2ccc(C[NH2+]CC3CC[NH+](C4CC4)CC3)o2)cc1 ZINC000446890758 1029627225 /nfs/dbraw/zinc/62/72/25/1029627225.db2.gz OZUUFXZFQDEWKJ-UHFFFAOYSA-N 2 0 328.431 4.050 20 0 EIADRP c1ccc(CC[C@H]2CCC[C@@H]2[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446886670 1029631836 /nfs/dbraw/zinc/63/18/36/1029631836.db2.gz IMYCMTKOADSGHE-IRLDBZIGSA-N 2 0 326.528 4.252 20 0 EIADRP C[C@H](CCc1ccc(Cl)s1)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446886956 1029632121 /nfs/dbraw/zinc/63/21/21/1029632121.db2.gz MFFIIZXEUQHLBZ-CYBMUJFWSA-N 2 0 326.937 4.187 20 0 EIADRP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+]CCC[NH+]1CCCC1 ZINC000584135815 1029641719 /nfs/dbraw/zinc/64/17/19/1029641719.db2.gz WYDBKDLCKFPUHX-QINSGFPZSA-N 2 0 326.406 4.184 20 0 EIADRP Fc1ccc2c(NC[C@@H](c3ccco3)[NH+]3CCCC3)cc[nH+]c2c1 ZINC000301240675 1029692026 /nfs/dbraw/zinc/69/20/26/1029692026.db2.gz FYQWADYWZKRXLM-SFHVURJKSA-N 2 0 325.387 4.216 20 0 EIADRP Cc1cnccc1OC1CC[NH+](Cc2cc3cc(F)ccc3o2)CC1 ZINC000447097613 1029694856 /nfs/dbraw/zinc/69/48/56/1029694856.db2.gz MFRLLWLJYDTVMI-UHFFFAOYSA-N 2 0 340.398 4.319 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000708510422 1029743377 /nfs/dbraw/zinc/74/33/77/1029743377.db2.gz JXVSRBSVBCUHFN-UZLBHIALSA-N 2 0 344.449 4.482 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1CNCc1ccccc1Cl ZINC000708519854 1029743852 /nfs/dbraw/zinc/74/38/52/1029743852.db2.gz KCVXAEZIGVYGHM-LPHOPBHVSA-N 2 0 328.887 4.198 20 0 EIADRP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000584366695 1029769617 /nfs/dbraw/zinc/76/96/17/1029769617.db2.gz HDXPRUDVHREVJG-IYXRBSQSSA-N 2 0 329.315 4.387 20 0 EIADRP Cc1cc(N2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c2cc(F)ccc2[nH+]1 ZINC000301793062 1029809660 /nfs/dbraw/zinc/80/96/60/1029809660.db2.gz RQKBFVPMNMBWAL-FOIQADDNSA-N 2 0 339.458 4.135 20 0 EIADRP C[C@@H](C[NH2+]Cc1cccc(OCc2ccccc2)c1)C[NH+]1CCCC1 ZINC000394463725 1029824149 /nfs/dbraw/zinc/82/41/49/1029824149.db2.gz JBOYGIKJRRRHJX-IBGZPJMESA-N 2 0 338.495 4.087 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccc(Br)c(Cl)c1 ZINC000657859409 1029846127 /nfs/dbraw/zinc/84/61/27/1029846127.db2.gz TYXZNJUTBXJNEN-NSHDSACASA-N 2 0 333.701 4.095 20 0 EIADRP C[C@H]([NH2+][C@@H]1c2ccccc2C[C@@H]1C)c1ccc(OCC[NH+](C)C)cc1 ZINC000089613788 1029850750 /nfs/dbraw/zinc/85/07/50/1029850750.db2.gz CDQUDJXWYJOLAG-HOIFWPIMSA-N 2 0 338.495 4.211 20 0 EIADRP C[C@H]([NH2+][C@H]1c2ccccc2C[C@H]1C)c1cccc(OCC[NH+](C)C)c1 ZINC000089613812 1029850966 /nfs/dbraw/zinc/85/09/66/1029850966.db2.gz LMCCYFPHDGVMMT-HYFFOGBASA-N 2 0 338.495 4.211 20 0 EIADRP FC(F)(F)c1cccc([C@@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)C2CC2)c1 ZINC000091284506 1029882181 /nfs/dbraw/zinc/88/21/81/1029882181.db2.gz UDAASVJVOSSRAX-UGSOOPFHSA-N 2 0 338.417 4.230 20 0 EIADRP FC(F)(F)c1cccc([C@@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)C2CC2)c1 ZINC000091284508 1029882555 /nfs/dbraw/zinc/88/25/55/1029882555.db2.gz UDAASVJVOSSRAX-ACJLOTCBSA-N 2 0 338.417 4.230 20 0 EIADRP CC(C)[C@@H]([NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1)c1cccnc1 ZINC000091310345 1029883671 /nfs/dbraw/zinc/88/36/71/1029883671.db2.gz SZBKJFJSLSFOQK-OAQYLSRUSA-N 2 0 325.500 4.409 20 0 EIADRP CC(C)[C@@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1cccnc1 ZINC000091403719 1029885001 /nfs/dbraw/zinc/88/50/01/1029885001.db2.gz ZQPGSNZOYRAFFA-XVAXZDLZSA-N 2 0 329.532 4.411 20 0 EIADRP Cc1ccc(-c2ncc(C[N@@H+]3CCC[C@H](c4ncc[nH]4)C3)s2)cc1 ZINC000092073920 1029899912 /nfs/dbraw/zinc/89/99/12/1029899912.db2.gz UZXRSIDLULWDBM-INIZCTEOSA-N 2 0 338.480 4.221 20 0 EIADRP COc1cccc([C@H](C)[NH2+]CCC[NH2+][C@@H](C)c2cccc(OC)c2)c1 ZINC000211392235 1030129262 /nfs/dbraw/zinc/12/92/62/1030129262.db2.gz SDRXFDAAZFCZBP-IRXDYDNUSA-N 2 0 342.483 4.095 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)c2cc(C)oc2C)cc1 ZINC000447544338 1030148424 /nfs/dbraw/zinc/14/84/24/1030148424.db2.gz ULCHTJPCXFSLHL-QGZVFWFLSA-N 2 0 344.499 4.468 20 0 EIADRP Cc1cc2c(cc1C)[C@@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CCS2 ZINC000447568325 1030154899 /nfs/dbraw/zinc/15/48/99/1030154899.db2.gz JAQQZDUYYOHMIY-IBGZPJMESA-N 2 0 330.541 4.304 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(c2c(Cl)cccc2Cl)CCC1 ZINC000447571379 1030158718 /nfs/dbraw/zinc/15/87/18/1030158718.db2.gz XXIAANBZCJNINZ-XJKSGUPXSA-N 2 0 341.326 4.345 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@@H]2Cc3ccccc32)CC1 ZINC000648447431 1030162685 /nfs/dbraw/zinc/16/26/85/1030162685.db2.gz OVCIRYOJEIMYLX-RXVVDRJESA-N 2 0 334.507 4.012 20 0 EIADRP CCOC1CCC([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000657881766 1030163653 /nfs/dbraw/zinc/16/36/53/1030163653.db2.gz VIQJKHDJUFIXLK-QMIIDVESSA-N 2 0 342.527 4.119 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@@H](c2cccnc2)C2CC2)C3)cc1 ZINC000447588805 1030187679 /nfs/dbraw/zinc/18/76/79/1030187679.db2.gz VNTDPFGVYHXBDI-BXXSPATCSA-N 2 0 347.506 4.318 20 0 EIADRP FC1(F)CCC[C@@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000447578777 1030207165 /nfs/dbraw/zinc/20/71/65/1030207165.db2.gz HHPZPIHSPBNQDP-MKXGPGLRSA-N 2 0 334.454 4.350 20 0 EIADRP FC1(F)CC(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)C1 ZINC000451064398 1030212560 /nfs/dbraw/zinc/21/25/60/1030212560.db2.gz IQMIGBKYGIXCNC-UHFFFAOYSA-N 2 0 334.454 4.020 20 0 EIADRP CC[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)CCO1 ZINC000648453870 1030215269 /nfs/dbraw/zinc/21/52/69/1030215269.db2.gz LRTONMAQNMCQBO-SFTDATJTSA-N 2 0 330.516 4.110 20 0 EIADRP C[NH+]1CCC(CC[NH2+][C@@H](c2ccccc2)c2ccc(F)cc2)CC1 ZINC000392394085 1030215554 /nfs/dbraw/zinc/21/55/54/1030215554.db2.gz XMXJWBHECFEECT-NRFANRHFSA-N 2 0 326.459 4.237 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC2CCC(F)CC2)CC1 ZINC000647350336 1030277457 /nfs/dbraw/zinc/27/74/57/1030277457.db2.gz KPXVZZBXHIZZDA-KKXNLOMOSA-N 2 0 332.507 4.200 20 0 EIADRP C[C@@H](CC[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1)c1ccccc1 ZINC000447735316 1030311833 /nfs/dbraw/zinc/31/18/33/1030311833.db2.gz CVXCFBZANCNWSL-SLFFLAALSA-N 2 0 344.543 4.001 20 0 EIADRP CC(C)CCOc1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000685443828 1030320507 /nfs/dbraw/zinc/32/05/07/1030320507.db2.gz WVCYPTZADFCUGY-YOFSQIOKSA-N 2 0 330.516 4.169 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C[C@H]2CCC3(CCCC3)O2)C1 ZINC000530358421 1030338297 /nfs/dbraw/zinc/33/82/97/1030338297.db2.gz ZQKPMSQORVLIAF-VAMGGRTRSA-N 2 0 334.548 4.065 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1cccc2cccnc21 ZINC000708571138 1030392386 /nfs/dbraw/zinc/39/23/86/1030392386.db2.gz QRYGAPPCCUQJCV-PGRDOPGGSA-N 2 0 345.490 4.093 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ncc(C(C)(C)C)s2)C1 ZINC000447939240 1030430584 /nfs/dbraw/zinc/43/05/84/1030430584.db2.gz JMDYOHQHSGEEFU-HOTGVXAUSA-N 2 0 337.577 4.288 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c3cccnc23)C[C@H]1C ZINC000530663225 1030618610 /nfs/dbraw/zinc/61/86/10/1030618610.db2.gz YNSHKOXVEPOUSC-ZBFHGGJFSA-N 2 0 331.891 4.193 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc3ccncc3s2)C1 ZINC000657932155 1030637901 /nfs/dbraw/zinc/63/79/01/1030637901.db2.gz UQPQMHBWDDNADY-JKSUJKDBSA-N 2 0 331.529 4.315 20 0 EIADRP CC(C)[C@H](CC(F)(F)F)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000527349641 1030640951 /nfs/dbraw/zinc/64/09/51/1030640951.db2.gz PVYVVBGCFVMPMX-NXHRZFHOSA-N 2 0 342.449 4.464 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc(C[N@H+]3C[C@H](C)C[C@H](C)C3)cc2)ccn1 ZINC000527638276 1030791081 /nfs/dbraw/zinc/79/10/81/1030791081.db2.gz HPKSYNPBRWFNDO-HDICACEKSA-N 2 0 337.511 4.158 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21)c1ccccn1 ZINC000658066534 1030814637 /nfs/dbraw/zinc/81/46/37/1030814637.db2.gz MJXQFIANKRHLSJ-KPUOSGPGSA-N 2 0 349.522 4.218 20 0 EIADRP CCCc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658069299 1030815282 /nfs/dbraw/zinc/81/52/82/1030815282.db2.gz LVSZOOMOXBFOAD-SFHVURJKSA-N 2 0 344.543 4.181 20 0 EIADRP Cc1cc(C)c([C@@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1C ZINC000658069015 1030816166 /nfs/dbraw/zinc/81/61/66/1030816166.db2.gz JKLJITBJFYVYQN-LJQANCHMSA-N 2 0 344.543 4.153 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cccc(C)c1 ZINC000658162513 1030859360 /nfs/dbraw/zinc/85/93/60/1030859360.db2.gz DWLUKPVUFWDBES-JOCHJYFZSA-N 2 0 337.511 4.343 20 0 EIADRP C[C@@H]1CCc2ccccc2[C@@H]1[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658167705 1030864049 /nfs/dbraw/zinc/86/40/49/1030864049.db2.gz SZIMGQNHDXHXBD-WZONZLPQSA-N 2 0 349.522 4.207 20 0 EIADRP c1ccc([C@@H]2CCC[C@@H]2[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658168778 1030865055 /nfs/dbraw/zinc/86/50/55/1030865055.db2.gz YSOOTCPXIWSFSZ-GOTSBHOMSA-N 2 0 349.522 4.220 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCCOC(C)(C)C)CC1 ZINC000658188627 1030872774 /nfs/dbraw/zinc/87/27/74/1030872774.db2.gz SLPVXUVWVYAWCR-UHFFFAOYSA-N 2 0 332.532 4.224 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CC[C@@]2(C)CC2(F)F)CC1 ZINC000658217931 1030893845 /nfs/dbraw/zinc/89/38/45/1030893845.db2.gz BEMAXWXEVWKOJD-ACBHZAAOSA-N 2 0 336.470 4.455 20 0 EIADRP CC1(C)[C@@H](C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1(F)F ZINC000658280752 1030937840 /nfs/dbraw/zinc/93/78/40/1030937840.db2.gz LCKZLVROWVDLOO-XMTFNYHQSA-N 2 0 334.454 4.063 20 0 EIADRP CC1(C)[C@@H](C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1(F)F ZINC000658280753 1030939328 /nfs/dbraw/zinc/93/93/28/1030939328.db2.gz LCKZLVROWVDLOO-ZJPYXAASSA-N 2 0 334.454 4.063 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CC2CC[NH+](CC3CC3)CC2)ccc1SC ZINC000658357717 1031031022 /nfs/dbraw/zinc/03/10/22/1031031022.db2.gz VXZDOZFJQKFOBV-OAHLLOKOSA-N 2 0 348.556 4.190 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)C1CCOCC1 ZINC000532459777 1031109036 /nfs/dbraw/zinc/10/90/36/1031109036.db2.gz IVSHHGSSUUXKFV-XMSQKQJNSA-N 2 0 344.543 4.213 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)C1CCOCC1 ZINC000532459774 1031109690 /nfs/dbraw/zinc/10/96/90/1031109690.db2.gz IVSHHGSSUUXKFV-AVRDEDQJSA-N 2 0 344.543 4.213 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CCCC[NH+](C)C ZINC000532489903 1031221235 /nfs/dbraw/zinc/22/12/35/1031221235.db2.gz IKSUJISPGXFXOX-ZDUSSCGKSA-N 2 0 335.492 4.250 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@@H](Cc1cccc(F)c1)c1cccc(F)c1 ZINC000532491492 1031232165 /nfs/dbraw/zinc/23/21/65/1031232165.db2.gz AMMQMQTVXXQBJO-FQEVSTJZSA-N 2 0 332.438 4.180 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2c(C)cc(C)c(C(C)=O)c2C)C[C@@H]1C ZINC000532589649 1031321465 /nfs/dbraw/zinc/32/14/65/1031321465.db2.gz ROVIOMMRJWFCJD-QFBILLFUSA-N 2 0 330.516 4.119 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@H]2CCOC3(CCC3)C2)cc1 ZINC000449080390 1031435279 /nfs/dbraw/zinc/43/52/79/1031435279.db2.gz VTTAYHOTQNXRDC-NQIIRXRSSA-N 2 0 342.527 4.252 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(C(C)C)cc2)[C@@H](C)C1 ZINC000531676915 1031468258 /nfs/dbraw/zinc/46/82/58/1031468258.db2.gz PEJIBJQZBDGKJQ-SIKLNZKXSA-N 2 0 346.559 4.079 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(C(C)C)cc2)[C@H](C)C1 ZINC000531676913 1031469008 /nfs/dbraw/zinc/46/90/08/1031469008.db2.gz PEJIBJQZBDGKJQ-DENIHFKCSA-N 2 0 346.559 4.079 20 0 EIADRP Cc1cc(C)c2c(c1)[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)CCCO2 ZINC000123697745 1031481151 /nfs/dbraw/zinc/48/11/51/1031481151.db2.gz CWHLPFZQLNVWRL-NRFANRHFSA-N 2 0 338.495 4.369 20 0 EIADRP C[C@@H](c1ccccc1)[NH+]1CCC(NCc2cc3cccnc3o2)CC1 ZINC000449146319 1031481618 /nfs/dbraw/zinc/48/16/18/1031481618.db2.gz BYYVJUCMSCJUGQ-INIZCTEOSA-N 2 0 335.451 4.143 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCCOc3cc(C)ccc32)c1 ZINC000123914428 1031493217 /nfs/dbraw/zinc/49/32/17/1031493217.db2.gz SOTGBNULVKXIRS-NRFANRHFSA-N 2 0 338.495 4.450 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000124066452 1031502479 /nfs/dbraw/zinc/50/24/79/1031502479.db2.gz PESRETOWASEPAX-FQEVSTJZSA-N 2 0 330.447 4.007 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@@H]2[C@H]3CCO[C@@H]3C2(C)C)CC1 ZINC000449163138 1031502922 /nfs/dbraw/zinc/50/29/22/1031502922.db2.gz LJGBCPYARCDWKK-KURKYZTESA-N 2 0 336.564 4.069 20 0 EIADRP Cn1ccc(C[NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)c1 ZINC000124102363 1031505418 /nfs/dbraw/zinc/50/54/18/1031505418.db2.gz QDBSOVXOZNCEOD-UHFFFAOYSA-N 2 0 325.500 4.079 20 0 EIADRP COCCC1(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CCC1 ZINC000449181681 1031520034 /nfs/dbraw/zinc/52/00/34/1031520034.db2.gz IHMBYVCQESYXAE-UHFFFAOYSA-N 2 0 338.580 4.462 20 0 EIADRP CC(C)[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)C1CC1 ZINC000531725026 1031526886 /nfs/dbraw/zinc/52/68/86/1031526886.db2.gz UMRHQYGJKLFRPZ-OAQYLSRUSA-N 2 0 326.484 4.436 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c2sccc21 ZINC000453069629 1031534669 /nfs/dbraw/zinc/53/46/69/1031534669.db2.gz UCNYCIYMNYWZKH-DNVCBOLYSA-N 2 0 344.524 4.417 20 0 EIADRP CC1CC[NH+](Cc2ccccc2C[NH2+][C@@H]2CCOC3(CCC3)C2)CC1 ZINC000449218068 1031553497 /nfs/dbraw/zinc/55/34/97/1031553497.db2.gz FEJSWHQLHZZMOV-OAQYLSRUSA-N 2 0 342.527 4.110 20 0 EIADRP COCC(C)(C)CCC[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449334408 1031652264 /nfs/dbraw/zinc/65/22/64/1031652264.db2.gz XHDWFTOYWMVGOH-LJQANCHMSA-N 2 0 346.559 4.124 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H]([NH2+]CCCc3ccccn3)[C@H]3CCC[C@H]32)cc1 ZINC000453163303 1031665137 /nfs/dbraw/zinc/66/51/37/1031665137.db2.gz PXXDVVCJCTYYCO-XPWALMASSA-N 2 0 349.522 4.047 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H]([NH2+]CCCc3ccccn3)[C@@H]3CCC[C@H]32)cc1 ZINC000453163297 1031665172 /nfs/dbraw/zinc/66/51/72/1031665172.db2.gz PXXDVVCJCTYYCO-RJGXRXQPSA-N 2 0 349.522 4.047 20 0 EIADRP Cc1nccn1CCC[N@@H+](CC(C)C)[C@@H]1CCCc2cccnc21 ZINC000126884340 1031666958 /nfs/dbraw/zinc/66/69/58/1031666958.db2.gz RIHFREFOVVWDQO-LJQANCHMSA-N 2 0 326.488 4.012 20 0 EIADRP C[C@@H](CCCc1cccnc1)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000453167084 1031672152 /nfs/dbraw/zinc/67/21/52/1031672152.db2.gz ITWDXWZQWZOVDF-KPQWGBOZSA-N 2 0 343.559 4.426 20 0 EIADRP CC1(C)C[N@H+](Cc2ccccn2)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449411958 1031696078 /nfs/dbraw/zinc/69/60/78/1031696078.db2.gz DKPLFRXNWBKQJW-QFIPXVFZSA-N 2 0 349.522 4.204 20 0 EIADRP FC(F)C1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)CC1 ZINC000453228676 1031748041 /nfs/dbraw/zinc/74/80/41/1031748041.db2.gz UTBGRQFFYXVERG-KSZLIROESA-N 2 0 334.454 4.065 20 0 EIADRP C/C=C/COc1ccc(CC[C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000449560322 1031847736 /nfs/dbraw/zinc/84/77/36/1031847736.db2.gz JJJMNEODENUPIH-ZIXFQYOSSA-N 2 0 342.527 4.177 20 0 EIADRP Clc1ccc(C[C@H]([NH2+]CCn2ccnc2)c2ccccc2)cc1 ZINC000531947977 1031860983 /nfs/dbraw/zinc/86/09/83/1031860983.db2.gz WZAQUEHAGYKKQI-IBGZPJMESA-N 2 0 325.843 4.110 20 0 EIADRP CC[C@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](Cc2ccc(OC)cc2)CC1 ZINC000531950169 1031864250 /nfs/dbraw/zinc/86/42/50/1031864250.db2.gz CZBJDUFKVKEWEB-FPOVZHCZSA-N 2 0 330.516 4.076 20 0 EIADRP C[C@@H](C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000531958346 1031876486 /nfs/dbraw/zinc/87/64/86/1031876486.db2.gz NVBMEVIGRXDVQU-DLBZAZTESA-N 2 0 344.474 4.220 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccccc2C(F)(F)F)C1 ZINC000531958971 1031878518 /nfs/dbraw/zinc/87/85/18/1031878518.db2.gz HCMKGAVIKAHKPO-HUUCEWRRSA-N 2 0 328.422 4.476 20 0 EIADRP C[C@H](C[NH2+][C@@H]1C[C@@H](C)[N@H+](C)C[C@@H]1C)c1c(Cl)cccc1Cl ZINC000531963664 1031883822 /nfs/dbraw/zinc/88/38/22/1031883822.db2.gz LNNLFEFSMYYNES-OQMKEHIESA-N 2 0 329.315 4.415 20 0 EIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cc1 ZINC000531972877 1031909037 /nfs/dbraw/zinc/90/90/37/1031909037.db2.gz BEMRBFRKIGSERO-OALUTQOASA-N 2 0 332.532 4.433 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2cccc(Br)c21 ZINC000453366822 1031909517 /nfs/dbraw/zinc/90/95/17/1031909517.db2.gz SWLNWJYQITZZPD-JYCGFUEUSA-N 2 0 349.316 4.212 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000453373227 1031919545 /nfs/dbraw/zinc/91/95/45/1031919545.db2.gz WZFLZFSHYSQAGU-KRXYWNSISA-N 2 0 328.500 4.239 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+](C)C2CC2)c2ccccc12 ZINC000453405874 1031941695 /nfs/dbraw/zinc/94/16/95/1031941695.db2.gz QQFKQWVOVBKQRH-MRXNPFEDSA-N 2 0 326.484 4.373 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(F)c(Br)c1 ZINC000453408200 1031943412 /nfs/dbraw/zinc/94/34/12/1031943412.db2.gz SMWSMUIIWFMGFK-LBPRGKRZSA-N 2 0 343.284 4.113 20 0 EIADRP C[N@H+](CCCC[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)C1CC1 ZINC000453411464 1031947376 /nfs/dbraw/zinc/94/73/76/1031947376.db2.gz VNXBGPSRBDCXBG-UHFFFAOYSA-N 3 0 337.596 4.130 20 0 EIADRP C[N@H+](CCCC[NH2+][C@H](c1cc2ccccc2o1)c1cccnc1)C1CC1 ZINC000453418470 1031952611 /nfs/dbraw/zinc/95/26/11/1031952611.db2.gz YEGAECCSMHKKMO-QFIPXVFZSA-N 2 0 349.478 4.381 20 0 EIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]Cc1cccc2[nH]ccc21 ZINC000532120801 1032051559 /nfs/dbraw/zinc/05/15/59/1032051559.db2.gz LIVLJYIEKMWQTL-QZTJIDSGSA-N 2 0 347.506 4.414 20 0 EIADRP FC1(F)CCC[C@H]([NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000512646588 1033613231 /nfs/dbraw/zinc/61/32/31/1033613231.db2.gz BMWAUGSCCQIEGO-FUMNGEBKSA-N 2 0 348.481 4.455 20 0 EIADRP c1ccc(C[N@@H+]2CC[C@H]([NH2+][C@H]3C[C@H]4C[C@H]4C3)[C@@H](c3ccccc3)C2)cc1 ZINC001167917490 1033843860 /nfs/dbraw/zinc/84/38/60/1033843860.db2.gz MMHMYQVKLXQSAI-BAHGYDIPSA-N 2 0 346.518 4.433 20 0 EIADRP c1cc(C[N@@H+]2CCC[C@@H]2C2CCOCC2)cc(C[NH+]2CCCCC2)c1 ZINC000411500007 1033941497 /nfs/dbraw/zinc/94/14/97/1033941497.db2.gz REVLKJUHOYSYQW-JOCHJYFZSA-N 2 0 342.527 4.064 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000333303411 1034628062 /nfs/dbraw/zinc/62/80/62/1034628062.db2.gz QLCMFRXPUSOVPY-WWGRRREGSA-N 2 0 345.487 4.186 20 0 EIADRP C[NH+](C)CCC1CC[NH+](CCCSc2ccccc2Cl)CC1 ZINC000500976494 1034653676 /nfs/dbraw/zinc/65/36/76/1034653676.db2.gz MUIBZSUGTAROQO-UHFFFAOYSA-N 2 0 340.964 4.486 20 0 EIADRP C[C@@H](COc1ccc(Cl)c(Cl)c1)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC001204939459 1034725826 /nfs/dbraw/zinc/72/58/26/1034725826.db2.gz XWDPNAVWYJQOMQ-ZDUSSCGKSA-N 2 0 345.314 4.082 20 0 EIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2ccc(Cl)o2)C[N@@H+]1Cc1ccccc1 ZINC000513501539 1034998226 /nfs/dbraw/zinc/99/82/26/1034998226.db2.gz TVTQRHXIURNJQL-DOTOQJQBSA-N 2 0 332.875 4.323 20 0 EIADRP C[C@@H](c1cccc(F)c1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501018137 1035350825 /nfs/dbraw/zinc/35/08/25/1035350825.db2.gz CUPGQHHRXTWCRD-INIZCTEOSA-N 2 0 327.447 4.130 20 0 EIADRP C[C@H](c1cccc(F)c1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501018138 1035351018 /nfs/dbraw/zinc/35/10/18/1035351018.db2.gz CUPGQHHRXTWCRD-MRXNPFEDSA-N 2 0 327.447 4.130 20 0 EIADRP C[C@@H](c1ccccc1F)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501049479 1035358948 /nfs/dbraw/zinc/35/89/48/1035358948.db2.gz JHLICUHVRMTBQA-INIZCTEOSA-N 2 0 327.447 4.130 20 0 EIADRP c1cncc([C@H]2CCC[C@H]([NH2+]CCCCC[NH+]3CCCCC3)C2)c1 ZINC000501425816 1035443312 /nfs/dbraw/zinc/44/33/12/1035443312.db2.gz PHFHFPOCNBDGAH-FPOVZHCZSA-N 2 0 329.532 4.354 20 0 EIADRP [NH3+]CC[C@H]1CCC[N@H+](Cc2nc(-c3ccccc3Cl)cs2)C1 ZINC000420303715 1035505423 /nfs/dbraw/zinc/50/54/23/1035505423.db2.gz DAJVVVUVSDZXSM-CYBMUJFWSA-N 2 0 335.904 4.024 20 0 EIADRP Clc1ccccc1-c1csc(C[N@@H+]2CCC3(C2)CC[NH2+]CC3)n1 ZINC000420308696 1035507143 /nfs/dbraw/zinc/50/71/43/1035507143.db2.gz NVVZCDHMIZIBEI-UHFFFAOYSA-N 2 0 347.915 4.039 20 0 EIADRP Cc1nc([C@H](C)N2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)oc1-c1ccc(Cl)cc1 ZINC000420315684 1035509292 /nfs/dbraw/zinc/50/92/92/1035509292.db2.gz XEPDGSZYZDPIMX-ZFZWDLNGSA-N 2 0 345.874 4.034 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[N@H+](C)CC[C@H]1CC[NH2+]C1 ZINC000420326859 1035533384 /nfs/dbraw/zinc/53/33/84/1035533384.db2.gz XSWMONHUSDQKKZ-IAGOWNOFSA-N 2 0 343.540 4.419 20 0 EIADRP Brc1ccc([C@@H]2CCC[N@@H+]2CCC2CC[NH2+]CC2)s1 ZINC000420377150 1035560244 /nfs/dbraw/zinc/56/02/44/1035560244.db2.gz RRLZEZOMUWZFPB-ZDUSSCGKSA-N 2 0 343.334 4.037 20 0 EIADRP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC([C@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420389100 1035563332 /nfs/dbraw/zinc/56/33/32/1035563332.db2.gz LXPLISWVTBIJPM-MAODMQOUSA-N 2 0 344.543 4.263 20 0 EIADRP CC(C)c1ccc([C@H](C)[NH+]2CCC([C@@H]3OCCC[C@H]3[NH3+])CC2)cc1 ZINC000420388709 1035565539 /nfs/dbraw/zinc/56/55/39/1035565539.db2.gz XIPPFYBOQCYDQM-DQLDELGASA-N 2 0 330.516 4.089 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000420418677 1035572052 /nfs/dbraw/zinc/57/20/52/1035572052.db2.gz XDYDWSLVNPCRNC-OCCSQVGLSA-N 2 0 349.931 4.422 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000501791701 1035591369 /nfs/dbraw/zinc/59/13/69/1035591369.db2.gz BHBJZGSOPPYDMX-UHFFFAOYSA-N 2 0 339.321 4.003 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC1(c2ccccc2)CCCCC1 ZINC000575115335 1035707098 /nfs/dbraw/zinc/70/70/98/1035707098.db2.gz YHMUJLHZAJRIJR-KRWDZBQOSA-N 2 0 337.511 4.401 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)CC3 ZINC000491043099 1035793531 /nfs/dbraw/zinc/79/35/31/1035793531.db2.gz YZIYFYSDOWEDAL-ROUUACIJSA-N 2 0 339.527 4.044 20 0 EIADRP C[C@H](CC[NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccc1 ZINC000668512616 1036009536 /nfs/dbraw/zinc/00/95/36/1036009536.db2.gz OFTPFSHYLLXXTN-LJQANCHMSA-N 2 0 337.511 4.077 20 0 EIADRP C[C@@H](N[C@@H](C)c1cnn(C2CCCC2)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000502469653 1036247326 /nfs/dbraw/zinc/24/73/26/1036247326.db2.gz CWWZEARNNUJVNN-FGTMMUONSA-N 2 0 344.547 4.302 20 0 EIADRP Cc1ccc(-c2ncc(C[NH2+]C3CCC([NH+](C)C)CC3)s2)cc1 ZINC000421365768 1036311276 /nfs/dbraw/zinc/31/12/76/1036311276.db2.gz AYAMWYOIVQFMBT-UHFFFAOYSA-N 2 0 329.513 4.081 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@@H](C)c1nc2ccccc2s1 ZINC000421379271 1036332945 /nfs/dbraw/zinc/33/29/45/1036332945.db2.gz UGGKNICGYOMXGK-WXLSXGNJSA-N 2 0 331.529 4.251 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2ccc(F)cc2F)CCCC1 ZINC000486079829 1036465831 /nfs/dbraw/zinc/46/58/31/1036465831.db2.gz QGLMYQLUFRVJFR-VCBZYWHSSA-N 2 0 336.470 4.095 20 0 EIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+]C2CCC3(CCCO3)CC2)c1 ZINC000572305208 1036477548 /nfs/dbraw/zinc/47/75/48/1036477548.db2.gz FVVGJQUTDDSXIB-UHFFFAOYSA-N 2 0 342.527 4.254 20 0 EIADRP CSc1ccccc1[C@@H]1CCC[N@@H+]1C1CC[NH+](CC2CC2)CC1 ZINC001168389173 1036736410 /nfs/dbraw/zinc/73/64/10/1036736410.db2.gz KWXGLFMONBVRRY-IBGZPJMESA-N 2 0 330.541 4.420 20 0 EIADRP CCOc1ccc([C@@H](CC)[NH2+]C2CCC([NH+](C)C)CC2)cc1OCC ZINC000421889501 1036835630 /nfs/dbraw/zinc/83/56/30/1036835630.db2.gz XGVDJBYOSJXJDF-CTWPCTMYSA-N 2 0 348.531 4.398 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Br)ccc1F ZINC000421869314 1036837373 /nfs/dbraw/zinc/83/73/73/1036837373.db2.gz DGZJZYGHPOZONJ-LMWSTFAQSA-N 2 0 343.284 4.112 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1CC12CCSCC2 ZINC000421869870 1036839534 /nfs/dbraw/zinc/83/95/34/1036839534.db2.gz DYFYOEIPJOPGHU-YZGWKJHDSA-N 2 0 344.568 4.020 20 0 EIADRP COc1cccc([C@@H]2CCCC[N@@H+]2C2CC[NH+](CC3CC3)CC2)c1 ZINC001168392660 1036852728 /nfs/dbraw/zinc/85/27/28/1036852728.db2.gz RUDHVKOUMPWGQD-NRFANRHFSA-N 2 0 328.500 4.097 20 0 EIADRP c1ccc2c(c1)n[nH]c2C[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000589647346 1036858917 /nfs/dbraw/zinc/85/89/17/1036858917.db2.gz VHZLBVPLKJMVSU-UHFFFAOYSA-N 2 0 348.494 4.229 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CNCc3ccc(Cl)o3)cc2)C1 ZINC000589832005 1036879395 /nfs/dbraw/zinc/87/93/95/1036879395.db2.gz ULZRYFUVYBXSLB-OAHLLOKOSA-N 2 0 332.875 4.455 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CC3CCC(F)(F)CC3)CC2)C1 ZINC000503053481 1036890547 /nfs/dbraw/zinc/89/05/47/1036890547.db2.gz VCACOMPIALAVEO-CRAIPNDOSA-N 2 0 328.491 4.445 20 0 EIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3cccc4[nH]ccc43)CC2)C1 ZINC000503116682 1036928410 /nfs/dbraw/zinc/92/84/10/1036928410.db2.gz HLQZNHXIXHROAW-FXAWDEMLSA-N 2 0 339.527 4.343 20 0 EIADRP C[N@H+](Cc1ccccc1C[NH2+]C[C@H]1CCSC1)C1CCCCC1 ZINC000486979785 1036930608 /nfs/dbraw/zinc/93/06/08/1036930608.db2.gz GNKBATLSYJMYPJ-QGZVFWFLSA-N 2 0 332.557 4.294 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccccc2C[NH2+]C/C=C\c2ccncc2)C1 ZINC000486980343 1036930648 /nfs/dbraw/zinc/93/06/48/1036930648.db2.gz MLNZGQKTTZRNBH-GGJLBNBESA-N 2 0 349.522 4.363 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2[C@H]3Cc4cc(F)ccc4[C@@H]23)CC1 ZINC000668744901 1037014955 /nfs/dbraw/zinc/01/49/55/1037014955.db2.gz RJFXWGKKGQPMKJ-PWWHONJESA-N 2 0 342.502 4.097 20 0 EIADRP C(=C/c1ccncc1)\C[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000487266434 1037080600 /nfs/dbraw/zinc/08/06/00/1037080600.db2.gz OSXMJCGNYOZSEH-BQYQJAHWSA-N 2 0 335.495 4.261 20 0 EIADRP CCC(CC)[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cc(F)ccc2C1 ZINC001168415895 1037088238 /nfs/dbraw/zinc/08/82/38/1037088238.db2.gz FXQSHNKCXMHWAT-JBACZVJFSA-N 2 0 332.507 4.444 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](CCSc2ccc(Cl)cc2)CC1 ZINC000590786501 1037166053 /nfs/dbraw/zinc/16/60/53/1037166053.db2.gz YZFZBRCTFTZBHA-UHFFFAOYSA-N 2 0 340.964 4.484 20 0 EIADRP Cc1ccc(C(C)(C)C[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000590797994 1037169403 /nfs/dbraw/zinc/16/94/03/1037169403.db2.gz SRFMDNLBVQTHKH-UHFFFAOYSA-N 2 0 340.511 4.003 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)[C@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168416355 1037237313 /nfs/dbraw/zinc/23/73/13/1037237313.db2.gz IMFUMACMMGSCJH-FKBYEOEOSA-N 2 0 344.518 4.445 20 0 EIADRP CCC(CC)[NH+]1CCC(C[NH2+][C@@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168416435 1037245996 /nfs/dbraw/zinc/24/59/96/1037245996.db2.gz YBFWUZJJGMQLBZ-HXUWFJFHSA-N 2 0 332.507 4.173 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccccc2CNC(=[NH2+])Nc2ccccc2)C1 ZINC000057887188 1037289080 /nfs/dbraw/zinc/28/90/80/1037289080.db2.gz UJXKHDAUKSJDSQ-KRWDZBQOSA-N 2 0 336.483 4.055 20 0 EIADRP CC(C)(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)CS1 ZINC000488402694 1037570734 /nfs/dbraw/zinc/57/07/34/1037570734.db2.gz CCLXYXWUIVPESY-MOPGFXCFSA-N 2 0 332.557 4.292 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CS1 ZINC000488414665 1037581345 /nfs/dbraw/zinc/58/13/45/1037581345.db2.gz HIDZUXGLTYWYRB-PMACEKPBSA-N 2 0 332.557 4.018 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CS1 ZINC000488547750 1037660384 /nfs/dbraw/zinc/66/03/84/1037660384.db2.gz SWQCUERTPJFSGT-LEAZDLGRSA-N 2 0 332.557 4.017 20 0 EIADRP COC[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(Cl)cc1 ZINC000488736165 1037732736 /nfs/dbraw/zinc/73/27/36/1037732736.db2.gz PKDSWMXZWNDWAP-IBGZPJMESA-N 2 0 338.923 4.273 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000422700794 1037801322 /nfs/dbraw/zinc/80/13/22/1037801322.db2.gz ASIXHMYZQOYDRY-HOTGVXAUSA-N 2 0 330.447 4.183 20 0 EIADRP CC[C@H](C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1 ZINC000422718434 1037813876 /nfs/dbraw/zinc/81/38/76/1037813876.db2.gz PQZPWPJFTNGKOH-NQSCKRDGSA-N 2 0 336.479 4.026 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCc1ccc(Cl)cc1Cl ZINC000422727082 1037819220 /nfs/dbraw/zinc/81/92/20/1037819220.db2.gz GKNGTJYHMWLLBH-LLVKDONJSA-N 2 0 338.282 4.049 20 0 EIADRP Cc1[nH]c2c(cc(C)cc2C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)c1C ZINC000422746697 1037823890 /nfs/dbraw/zinc/82/38/90/1037823890.db2.gz WYOQVTUGDJZLBG-DFQSSKMNSA-N 2 0 325.500 4.103 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(Cl)c1 ZINC000422748883 1037825286 /nfs/dbraw/zinc/82/52/86/1037825286.db2.gz WPUQIYRVBOMEOS-BOUXLOLZSA-N 2 0 342.870 4.247 20 0 EIADRP COc1ccccc1[C@H]([NH2+][C@H](C)CCC[NH3+])c1ccccc1Cl ZINC000422778030 1037830085 /nfs/dbraw/zinc/83/00/85/1037830085.db2.gz GWVQZBJYDDAKDO-AUUYWEPGSA-N 2 0 332.875 4.155 20 0 EIADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](C)c1ccccc1-c1ccc(Cl)cc1 ZINC000422774489 1037831423 /nfs/dbraw/zinc/83/14/23/1037831423.db2.gz XEYRERVEHMWDAG-MAUKXSAKSA-N 2 0 346.902 4.412 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)[C@@H](C)c1ccccc1 ZINC000422828162 1037841616 /nfs/dbraw/zinc/84/16/16/1037841616.db2.gz TVAVFOBSVIOKFU-FIBVWIARSA-N 2 0 336.479 4.024 20 0 EIADRP COc1cc([C@@H](C)[NH2+][C@@H](C)CCCC[NH3+])ccc1OC1CCCC1 ZINC000422875745 1037850394 /nfs/dbraw/zinc/85/03/94/1037850394.db2.gz DBBNHFNYRYXUKH-JKSUJKDBSA-N 2 0 334.504 4.185 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1ccc(OC(C)C)cc1 ZINC000422888636 1037856154 /nfs/dbraw/zinc/85/61/54/1037856154.db2.gz DIJYGPWKMWAEBA-HUUCEWRRSA-N 2 0 327.472 4.048 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](c1ccc(F)cc1F)C(C)C ZINC000422872394 1037858313 /nfs/dbraw/zinc/85/83/13/1037858313.db2.gz GYVYJMJYYRHFNN-ORAYPTAESA-N 2 0 333.426 4.175 20 0 EIADRP CCC[C@@H]([NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)c1ccc(F)cc1F ZINC000422874350 1037859126 /nfs/dbraw/zinc/85/91/26/1037859126.db2.gz NLLUISLSKMXBDD-ORAYPTAESA-N 2 0 333.426 4.319 20 0 EIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000422898144 1037861592 /nfs/dbraw/zinc/86/15/92/1037861592.db2.gz DJFMGKWOFATKOO-PBASOCQRSA-N 2 0 330.516 4.055 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1ccccc1C(F)(F)F ZINC000422927719 1037871694 /nfs/dbraw/zinc/87/16/94/1037871694.db2.gz ZWVDKYXTLJJKSZ-WCQYABFASA-N 2 0 337.389 4.279 20 0 EIADRP COc1ccc([C@@H]([NH2+]C2CCC(C[NH3+])CC2)c2ccc(C)cc2)cc1 ZINC000422936665 1037875717 /nfs/dbraw/zinc/87/57/17/1037875717.db2.gz MYYZVUZRNGDDTB-QVHXHXEWSA-N 2 0 338.495 4.200 20 0 EIADRP COc1ccc([C@@H]([NH2+][C@@H](C)CCCC[NH3+])c2ccc(C)cc2)cc1 ZINC000422936417 1037876366 /nfs/dbraw/zinc/87/63/66/1037876366.db2.gz MIYMLEOQYBFSJV-UWJYYQICSA-N 2 0 326.484 4.200 20 0 EIADRP CC1CC[NH+](Cc2ccccc2CN[C@H]2C[C@@H]([NH3+])c3ccccc32)CC1 ZINC000422967257 1037882270 /nfs/dbraw/zinc/88/22/70/1037882270.db2.gz OTCKRCNGMFAORR-PKTZIBPZSA-N 2 0 349.522 4.153 20 0 EIADRP COc1ccccc1SC[C@H](C)C[NH2+][C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422947683 1037884942 /nfs/dbraw/zinc/88/49/42/1037884942.db2.gz QWTFEVIMJFDJTD-JLSDUUJJSA-N 2 0 342.508 4.158 20 0 EIADRP COc1ccc([C@H]([NH2+][C@H](C)CCCC[NH3+])c2ccc(F)cc2)cc1 ZINC000422950966 1037887668 /nfs/dbraw/zinc/88/76/68/1037887668.db2.gz ZFRHFIZRETWCOB-FOIQADDNSA-N 2 0 330.447 4.031 20 0 EIADRP C[C@@H]([NH2+][C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1)C1C[NH2+]C1 ZINC000423019393 1037902234 /nfs/dbraw/zinc/90/22/34/1037902234.db2.gz VLNIMHKCKAHBPZ-PSLIRLAXSA-N 2 0 332.797 4.007 20 0 EIADRP C[C@H]([NH2+]CC1(c2ccc(Cl)cc2Cl)CCCC1)C1C[NH2+]C1 ZINC000423032148 1037917062 /nfs/dbraw/zinc/91/70/62/1037917062.db2.gz XQTFVVFRLFLOQA-LBPRGKRZSA-N 2 0 327.299 4.003 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000423060506 1037928753 /nfs/dbraw/zinc/92/87/53/1037928753.db2.gz OQBGEWVUJZQXLH-LBPRGKRZSA-N 2 0 337.389 4.027 20 0 EIADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000423070844 1037932820 /nfs/dbraw/zinc/93/28/20/1037932820.db2.gz NWXWKXWVLOPYNB-GHMZBOCLSA-N 2 0 334.813 4.106 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)C1(c2ccccc2)CCCC1 ZINC000423050780 1037936922 /nfs/dbraw/zinc/93/69/22/1037936922.db2.gz MAUOOPCMMYSTRD-SJLPKXTDSA-N 2 0 337.511 4.400 20 0 EIADRP COCCCC[C@H]([NH2+][C@H](C)c1ccc(C[NH3+])nc1C)c1ccccc1 ZINC000423085559 1037945242 /nfs/dbraw/zinc/94/52/42/1037945242.db2.gz KTYQFOFHVRZCHJ-UTKZUKDTSA-N 2 0 341.499 4.057 20 0 EIADRP COCCCC[C@@H]([NH2+][C@H](C)c1ccc(C[NH3+])nc1C)c1ccccc1 ZINC000423085556 1037946480 /nfs/dbraw/zinc/94/64/80/1037946480.db2.gz KTYQFOFHVRZCHJ-DYESRHJHSA-N 2 0 341.499 4.057 20 0 EIADRP Clc1ccc(CCCC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)s1 ZINC000423100123 1037956165 /nfs/dbraw/zinc/95/61/65/1037956165.db2.gz GGORHEHPTGXDGH-BZUAXINKSA-N 2 0 326.937 4.235 20 0 EIADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000423100577 1037956475 /nfs/dbraw/zinc/95/64/75/1037956475.db2.gz HCVXLRKMZGHJND-CJNGLKHVSA-N 2 0 335.904 4.071 20 0 EIADRP Clc1ccc(CCCC[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCC[NH2+]2)s1 ZINC000423100125 1037958548 /nfs/dbraw/zinc/95/85/48/1037958548.db2.gz GGORHEHPTGXDGH-OAGGEKHMSA-N 2 0 326.937 4.235 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+]C[C@@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000423123779 1037968365 /nfs/dbraw/zinc/96/83/65/1037968365.db2.gz FGQXWCFSMYHNJC-OXJNMPFZSA-N 2 0 346.902 4.315 20 0 EIADRP C[C@H](C[C@H](C)[NH3+])[NH2+]C[C@@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000423126481 1037978824 /nfs/dbraw/zinc/97/88/24/1037978824.db2.gz IVPJBMLHGHSKPK-RZQQEMMASA-N 2 0 346.902 4.313 20 0 EIADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+]C[C@@H](OCC1CC1)c1ccc(Cl)cc1 ZINC000423107706 1037983450 /nfs/dbraw/zinc/98/34/50/1037983450.db2.gz QBBBNQWTQFSEFG-CEXWTWQISA-N 2 0 336.907 4.057 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H]1C[C@H](c2ccccc2Cl)C1 ZINC000423147602 1037998845 /nfs/dbraw/zinc/99/88/45/1037998845.db2.gz SHNAGIBRPMWFGG-IIAWOOMASA-N 2 0 329.875 4.099 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(C2CC2)c1 ZINC000423148175 1037998933 /nfs/dbraw/zinc/99/89/33/1037998933.db2.gz USLLWUMKLJOGQG-YTJPUZGESA-N 2 0 348.490 4.471 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1CCCC[C@H]1CC(F)(F)F ZINC000423151874 1038003225 /nfs/dbraw/zinc/00/32/25/1038003225.db2.gz DDDOATGKNCHODG-XEZPLFJOSA-N 2 0 329.410 4.011 20 0 EIADRP CCCCCOc1cc(C[NH2+]CC2(C)CC[NH+](C)CC2)ccc1OC ZINC000503944260 1038035273 /nfs/dbraw/zinc/03/52/73/1038035273.db2.gz GVDMRQYONWLUFF-UHFFFAOYSA-N 2 0 348.531 4.086 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423210418 1038037372 /nfs/dbraw/zinc/03/73/72/1038037372.db2.gz GFIKUABPNOZISN-IXDOHACOSA-N 2 0 327.516 4.202 20 0 EIADRP c1csc(C[N@@H+](CC2CCCCCC2)[C@H]2CC23CC[NH2+]CC3)n1 ZINC000414725789 1038057210 /nfs/dbraw/zinc/05/72/10/1038057210.db2.gz WXSCDRQFBJYRBY-KRWDZBQOSA-N 2 0 333.545 4.058 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423260849 1038071747 /nfs/dbraw/zinc/07/17/47/1038071747.db2.gz QXNIENKYUAQWJZ-QAPCUYQASA-N 2 0 343.540 4.083 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423263423 1038074251 /nfs/dbraw/zinc/07/42/51/1038074251.db2.gz XFLRDWJTDSTGOA-ZBFHGGJFSA-N 2 0 329.513 4.159 20 0 EIADRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc2ccccc2c1OC(F)F ZINC000423248246 1038078806 /nfs/dbraw/zinc/07/88/06/1038078806.db2.gz MTLOIUHFQBFZOR-KGLIPLIRSA-N 2 0 334.410 4.091 20 0 EIADRP Fc1cccc([C@@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2cccc(Cl)c2)c1 ZINC000423247872 1038079491 /nfs/dbraw/zinc/07/94/91/1038079491.db2.gz LVXIWRFMPOYUOJ-LIRRHRJNSA-N 2 0 332.850 4.158 20 0 EIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]CCC1CC[NH+](C)CC1)CCCO2 ZINC000489513851 1038091805 /nfs/dbraw/zinc/09/18/05/1038091805.db2.gz HGBRUMAYRQFQLK-FQEVSTJZSA-N 2 0 330.516 4.345 20 0 EIADRP CC(C)[C@H](COCc1ccccc1)[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000423293692 1038096886 /nfs/dbraw/zinc/09/68/86/1038096886.db2.gz RXUMSWWKBFPFQZ-UTKZUKDTSA-N 2 0 326.484 4.037 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(Br)cc2)cc1 ZINC000423291672 1038097944 /nfs/dbraw/zinc/09/79/44/1038097944.db2.gz JIVDCMMZFGBHIA-OLZOCXBDSA-N 2 0 333.273 4.320 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2nc3ccc(Cl)cc3n2C)cc1 ZINC000423296008 1038123011 /nfs/dbraw/zinc/12/30/11/1038123011.db2.gz YEWKATMSCCHFQB-STQMWFEESA-N 2 0 342.874 4.097 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2CCCOc3c(Cl)cccc32)cc1 ZINC000423293957 1038123516 /nfs/dbraw/zinc/12/35/16/1038123516.db2.gz SPKNJKCPDDHNKB-ACJLOTCBSA-N 2 0 330.859 4.363 20 0 EIADRP CC1(C[NH2+]C(c2ccc(F)cc2)c2ccc(F)cc2)CC[NH2+]CC1 ZINC000423324690 1038138145 /nfs/dbraw/zinc/13/81/45/1038138145.db2.gz IWNVXVZFPQPGIR-UHFFFAOYSA-N 2 0 330.422 4.034 20 0 EIADRP Fc1ccc([C@H]([NH2+]CC2=CC[NH2+]CC2)c2ccccc2Cl)cc1 ZINC000423330496 1038144190 /nfs/dbraw/zinc/14/41/90/1038144190.db2.gz BZNVZGMLMOEZBA-IBGZPJMESA-N 2 0 330.834 4.078 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000423374835 1038158879 /nfs/dbraw/zinc/15/88/79/1038158879.db2.gz KBTFNHLSYHICRN-WQGACYEGSA-N 2 0 333.476 4.049 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CCCC[C@H]2[NH2+]CC2=CC[NH2+]CC2)cc1 ZINC000423349639 1038160764 /nfs/dbraw/zinc/16/07/64/1038160764.db2.gz XGPCEGGAXONKMC-ZWKOTPCHSA-N 2 0 338.417 4.241 20 0 EIADRP CC[C@@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(Br)cc1Cl ZINC000423362777 1038179889 /nfs/dbraw/zinc/17/98/89/1038179889.db2.gz YEMHKGPMUGSUES-OAHLLOKOSA-N 2 0 343.696 4.063 20 0 EIADRP C[C@@H](CCc1ccc(OC(F)F)cc1)[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423361824 1038180322 /nfs/dbraw/zinc/18/03/22/1038180322.db2.gz SCIYNTOBHZWPKL-AWEZNQCLSA-N 2 0 346.421 4.002 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H]1CCC[C@H]([NH3+])C1 ZINC000423368910 1038182202 /nfs/dbraw/zinc/18/22/02/1038182202.db2.gz DMNIISVCNWNTLY-UBHSHLNASA-N 2 0 333.476 4.178 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423375980 1038188441 /nfs/dbraw/zinc/18/84/41/1038188441.db2.gz IZBIUUGIOWINMV-KGLIPLIRSA-N 2 0 337.492 4.181 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423371573 1038190174 /nfs/dbraw/zinc/19/01/74/1038190174.db2.gz GPPDKPJQFKLHQT-IAOVAPTHSA-N 2 0 329.513 4.347 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC[NH2+]1 ZINC000423380577 1038192352 /nfs/dbraw/zinc/19/23/52/1038192352.db2.gz MZAYVAXNNPGAOH-QIJZBDPFSA-N 2 0 326.406 4.072 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC[NH2+]1 ZINC000423380574 1038193569 /nfs/dbraw/zinc/19/35/69/1038193569.db2.gz MZAYVAXNNPGAOH-NQZOLGFYSA-N 2 0 326.406 4.072 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccc2c1CCCN2 ZINC000423422165 1038213858 /nfs/dbraw/zinc/21/38/58/1038213858.db2.gz YKFWFZVBRHMVBX-GCJKJVERSA-N 2 0 349.522 4.045 20 0 EIADRP Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423404863 1038216078 /nfs/dbraw/zinc/21/60/78/1038216078.db2.gz XVJDMQKCXYFDSN-LJQANCHMSA-N 2 0 342.870 4.255 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1cc2cc(Br)ccc2o1 ZINC000423442017 1038224668 /nfs/dbraw/zinc/22/46/68/1038224668.db2.gz UQYXWHNRLVBYPL-RYUDHWBXSA-N 2 0 339.277 4.363 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000423444789 1038225472 /nfs/dbraw/zinc/22/54/72/1038225472.db2.gz MCXAKZSBEREZHE-PGRDOPGGSA-N 2 0 349.522 4.045 20 0 EIADRP Cc1c([C@@H](C)[NH2+][C@H](C)CCCC[NH3+])cnn1-c1cccc(Cl)c1 ZINC000423434514 1038235801 /nfs/dbraw/zinc/23/58/01/1038235801.db2.gz OBTWOTKAMDBYCR-ZIAGYGMSSA-N 2 0 334.895 4.002 20 0 EIADRP Cc1c([C@H](C)[NH2+][C@@H](C)CCCC[NH3+])cnn1-c1cccc(Cl)c1 ZINC000423434511 1038236430 /nfs/dbraw/zinc/23/64/30/1038236430.db2.gz OBTWOTKAMDBYCR-KBPBESRZSA-N 2 0 334.895 4.002 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1ccc(SCC(F)F)cc1 ZINC000423460340 1038240223 /nfs/dbraw/zinc/24/02/23/1038240223.db2.gz ASMONBFCGCOFHJ-KCQAQPDRSA-N 2 0 328.472 4.212 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000423457766 1038240306 /nfs/dbraw/zinc/24/03/06/1038240306.db2.gz PNCYADIDMGDWJS-GHTZIAJQSA-N 3 0 349.538 4.096 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1cccc(Br)c1 ZINC000423458979 1038240689 /nfs/dbraw/zinc/24/06/89/1038240689.db2.gz QTLSNIILDKDVMH-KBXCAEBGSA-N 2 0 347.300 4.256 20 0 EIADRP CCOc1ccc([C@H](CC)[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)cc1OCC ZINC000423464846 1038241951 /nfs/dbraw/zinc/24/19/51/1038241951.db2.gz RGGOQUNVPYKWGB-JQHSSLGASA-N 2 0 334.504 4.042 20 0 EIADRP Fc1ccc(C([NH2+]CCC[C@@H]2CCC[NH2+]2)c2ccc(F)cc2)cc1 ZINC000423474896 1038247369 /nfs/dbraw/zinc/24/73/69/1038247369.db2.gz HVCUOWXIAKYIKI-IBGZPJMESA-N 2 0 330.422 4.176 20 0 EIADRP COc1ccc([C@H]([NH2+][C@H]2CC[C@@H](C[NH3+])C2)c2ccccc2Cl)cc1 ZINC000423502033 1038257596 /nfs/dbraw/zinc/25/75/96/1038257596.db2.gz JMFRYYKHUKJWOY-IIMJZQEZSA-N 2 0 344.886 4.155 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423505351 1038258493 /nfs/dbraw/zinc/25/84/93/1038258493.db2.gz HLXCVGTWRHHQHU-JJCGOBCMSA-N 2 0 338.495 4.257 20 0 EIADRP Brc1ccc([C@@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)C2CC2)s1 ZINC000423486862 1038260000 /nfs/dbraw/zinc/26/00/00/1038260000.db2.gz SWDBUKNNFKASCD-WFASDCNBSA-N 2 0 343.334 4.084 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1ccc2ccccc2c1OC(F)F ZINC000423487190 1038262563 /nfs/dbraw/zinc/26/25/63/1038262563.db2.gz CFFVPISSUASICE-GZBFAFLISA-N 2 0 334.410 4.219 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423495235 1038265044 /nfs/dbraw/zinc/26/50/44/1038265044.db2.gz UDXAKRRLLCATNQ-VPWXQRGCSA-N 2 0 342.458 4.183 20 0 EIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000423512183 1038272042 /nfs/dbraw/zinc/27/20/42/1038272042.db2.gz UPGRADMULNRKGR-UTKZUKDTSA-N 2 0 334.467 4.003 20 0 EIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cc(-c2ccccc2)nn1C ZINC000423521358 1038276315 /nfs/dbraw/zinc/27/63/15/1038276315.db2.gz SSFHYYXITKZPPY-YLJYHZDGSA-N 2 0 348.494 4.218 20 0 EIADRP Clc1ccc2c(c1Cl)OCCC[C@H]2[NH2+]CCC1=CC[NH2+]CC1 ZINC000423537716 1038285230 /nfs/dbraw/zinc/28/52/30/1038285230.db2.gz KSDAIJWBGOJWAI-OAHLLOKOSA-N 2 0 341.282 4.107 20 0 EIADRP Clc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@H]3C[NH2+]C[C@@H]3C1)CCCS2 ZINC000423539076 1038285404 /nfs/dbraw/zinc/28/54/04/1038285404.db2.gz HRDQISNFXJKPPG-YOKBYHGQSA-N 2 0 336.932 4.245 20 0 EIADRP Clc1ccc2c(c1Cl)OCCC[C@@H]2[NH2+]CCC1=CC[NH2+]CC1 ZINC000423537715 1038285929 /nfs/dbraw/zinc/28/59/29/1038285929.db2.gz KSDAIJWBGOJWAI-HNNXBMFYSA-N 2 0 341.282 4.107 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@H]4C3)cs2)cs1 ZINC000423539616 1038286620 /nfs/dbraw/zinc/28/66/20/1038286620.db2.gz IPVSQFKDNNAWLM-ADSMDIBLSA-N 2 0 347.553 4.219 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+][C@@H]3CC[C@H]4C[NH2+]C[C@@H]4C3)cs2)cs1 ZINC000423539620 1038287025 /nfs/dbraw/zinc/28/70/25/1038287025.db2.gz IPVSQFKDNNAWLM-ATVPRXPUSA-N 2 0 347.553 4.219 20 0 EIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@@H]3C[NH2+]C[C@H]3C1)CCCO2 ZINC000423542159 1038289370 /nfs/dbraw/zinc/28/93/70/1038289370.db2.gz LUUKQGMZALNVLE-SOAMZJECSA-N 2 0 328.500 4.001 20 0 EIADRP COCc1cc([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)ccc1OC ZINC000157937702 1038295260 /nfs/dbraw/zinc/29/52/60/1038295260.db2.gz HTLGHNLSZZZISO-ROUUACIJSA-N 2 0 348.531 4.004 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1)c1ccc(F)cn1 ZINC000490123230 1038352337 /nfs/dbraw/zinc/35/23/37/1038352337.db2.gz AGLZZUVUAXUEJD-LJQANCHMSA-N 2 0 329.463 4.302 20 0 EIADRP CC[N@@H+]1CC[C@@H](CN[C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000490167131 1038367716 /nfs/dbraw/zinc/36/77/16/1038367716.db2.gz FYARYIKMISZVGT-JXFKEZNVSA-N 2 0 328.887 4.361 20 0 EIADRP C[C@H]1C[C@H]([NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC[N@@H+]1C ZINC000608061497 1038440721 /nfs/dbraw/zinc/44/07/21/1038440721.db2.gz WIQARCLZVWEGLI-KBXCAEBGSA-N 2 0 346.421 4.329 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC[N@@H+]1C ZINC000608061502 1038452978 /nfs/dbraw/zinc/45/29/78/1038452978.db2.gz WIQARCLZVWEGLI-RDTXWAMCSA-N 2 0 346.421 4.329 20 0 EIADRP Clc1cccc2c1CC[C@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000539037453 1038788616 /nfs/dbraw/zinc/78/86/16/1038788616.db2.gz MTSQOMGZGGJVTG-HXUWFJFHSA-N 2 0 341.886 4.229 20 0 EIADRP Cc1ccc(-c2nc(C[N@H+]3CC4(C[C@@H]3C)CC[NH2+]CC4)cs2)cc1 ZINC000424284647 1038794335 /nfs/dbraw/zinc/79/43/35/1038794335.db2.gz DLHGDIAWHCCYRJ-INIZCTEOSA-N 2 0 341.524 4.083 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1)c1ccccc1C(C)(C)C ZINC000539059890 1038806566 /nfs/dbraw/zinc/80/65/66/1038806566.db2.gz FBSIJKKYZDIVOW-DQLDELGASA-N 2 0 344.543 4.013 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1)c1ccccc1C(C)(C)C ZINC000539059899 1038806907 /nfs/dbraw/zinc/80/69/07/1038806907.db2.gz FBSIJKKYZDIVOW-ZLGUVYLKSA-N 2 0 344.543 4.013 20 0 EIADRP c1csc([C@H](Cc2ccncc2)[NH2+]CCCCC[NH+]2CCCC2)c1 ZINC000424345673 1038831884 /nfs/dbraw/zinc/83/18/84/1038831884.db2.gz IIYWHWXAZXQFMN-IBGZPJMESA-N 2 0 343.540 4.283 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000424369191 1038838532 /nfs/dbraw/zinc/83/85/32/1038838532.db2.gz BIGLCJRJVLRBOY-UOVKNHIHSA-N 2 0 331.287 4.009 20 0 EIADRP CC(C)[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000539163214 1038864720 /nfs/dbraw/zinc/86/47/20/1038864720.db2.gz ONUNWJJIMVWOOT-RDTXWAMCSA-N 2 0 340.433 4.476 20 0 EIADRP CN(CCC[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccc1F ZINC000480897690 1038865150 /nfs/dbraw/zinc/86/51/50/1038865150.db2.gz FYPQIFPDPBJHOC-UHFFFAOYSA-N 2 0 347.522 4.039 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccnn1C1CCC1 ZINC000924686352 1038874013 /nfs/dbraw/zinc/87/40/13/1038874013.db2.gz RIRRRKPVNDTVEF-KURKYZTESA-N 2 0 332.536 4.017 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cnn(C(C)(C)C)c2)CC1 ZINC000537619455 1038941056 /nfs/dbraw/zinc/94/10/56/1038941056.db2.gz DCAMSRZJTZGCCO-SFHVURJKSA-N 2 0 346.563 4.115 20 0 EIADRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc3cc(OC)ccc3c2)C1 ZINC000537620573 1038953518 /nfs/dbraw/zinc/95/35/18/1038953518.db2.gz YZBVTCGVENBGLC-SFHVURJKSA-N 2 0 326.484 4.012 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+][C@H](C)CC[NH+](C)C)cc1 ZINC000470246867 1039029532 /nfs/dbraw/zinc/02/95/32/1039029532.db2.gz QSZGLAUWZOKWGD-SJORKVTESA-N 2 0 326.484 4.353 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2c(Cl)cccc2N2CCCC2)cc1 ZINC000414808095 1039029437 /nfs/dbraw/zinc/02/94/37/1039029437.db2.gz KABGJBQYBCIRJS-HNNXBMFYSA-N 2 0 343.902 4.250 20 0 EIADRP C[C@@H]1CCC[C@H](C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)C1 ZINC000539377636 1039034555 /nfs/dbraw/zinc/03/45/55/1039034555.db2.gz SZXSLKAHBDHRKG-WSTZPKSXSA-N 2 0 342.527 4.391 20 0 EIADRP FC(F)(F)c1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](CC3CC3)CC1)CC2 ZINC001168365428 1039035916 /nfs/dbraw/zinc/03/59/16/1039035916.db2.gz RNHCQOYBKFOHAI-GOSISDBHSA-N 2 0 338.417 4.157 20 0 EIADRP CCCOc1ccc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1OCC ZINC000414811587 1039063901 /nfs/dbraw/zinc/06/39/01/1039063901.db2.gz PTUPVOJKSHFSNZ-MRXNPFEDSA-N 2 0 342.483 4.184 20 0 EIADRP Cc1ccc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c(Br)c1 ZINC000414813454 1039081904 /nfs/dbraw/zinc/08/19/04/1039081904.db2.gz TVFFTXMNXFUPOI-ZDUSSCGKSA-N 2 0 333.273 4.067 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(-c3ccc(F)cc3)o2)C[C@@H]1C ZINC000552070778 1039094470 /nfs/dbraw/zinc/09/44/70/1039094470.db2.gz DJZFMJRANKPBFA-MAUKXSAKSA-N 2 0 330.447 4.390 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(-c3ccc(F)cc3)o2)C[C@H]1C ZINC000552070777 1039097403 /nfs/dbraw/zinc/09/74/03/1039097403.db2.gz DJZFMJRANKPBFA-CRAIPNDOSA-N 2 0 330.447 4.390 20 0 EIADRP CCCOc1ccc(CN(C)[C@@H]2CC[N@H+](CC)[C@H](C)C2)cc1OCC ZINC000552071107 1039099867 /nfs/dbraw/zinc/09/98/67/1039099867.db2.gz PTRQOOFOOMKJQX-IEBWSBKVSA-N 2 0 348.531 4.179 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(c2cccc(Cl)c2F)CCCC1 ZINC000477861510 1039142161 /nfs/dbraw/zinc/14/21/61/1039142161.db2.gz NOAWQAHFHZGAKD-RHSMWYFYSA-N 2 0 338.898 4.221 20 0 EIADRP C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(OC(F)F)cc1 ZINC000120546376 1039153261 /nfs/dbraw/zinc/15/32/61/1039153261.db2.gz WGUSHCRYBAWXHM-LBPRGKRZSA-N 2 0 326.431 4.248 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccc(OC)cc2)cc1 ZINC000120579424 1039181154 /nfs/dbraw/zinc/18/11/54/1039181154.db2.gz UKGREZROYZUDLE-QGZVFWFLSA-N 2 0 326.484 4.388 20 0 EIADRP Cc1ncc([C@@H](C)NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)s1 ZINC000090409167 1039222525 /nfs/dbraw/zinc/22/25/25/1039222525.db2.gz NIZBCNXFITUOFB-FMJMRLDVSA-N 2 0 341.524 4.298 20 0 EIADRP C[N@H+](CCC[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1)C1CCCCC1 ZINC000534351245 1039338789 /nfs/dbraw/zinc/33/87/89/1039338789.db2.gz TWLFGMAGANENQH-DENIHFKCSA-N 2 0 344.543 4.399 20 0 EIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](C[C@H]3CCCC(F)(F)C3)C2)CC1 ZINC000513882640 1039343005 /nfs/dbraw/zinc/34/30/05/1039343005.db2.gz MYLNQFIQCCADMP-ZWKOTPCHSA-N 2 0 328.491 4.256 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccc(Cl)o2)CC1 ZINC000537637209 1039378330 /nfs/dbraw/zinc/37/83/30/1039378330.db2.gz QRPQIGKDJPVLTH-UHFFFAOYSA-N 2 0 332.875 4.277 20 0 EIADRP Cc1c([C@H](C)[NH2+]C2CCC(C)([NH+]3CCC3)CC2)cnn1C(C)(C)C ZINC000927037154 1039400819 /nfs/dbraw/zinc/40/08/19/1039400819.db2.gz LLMPFIJOQOGTHB-FVWXCPNNSA-N 2 0 332.536 4.004 20 0 EIADRP Cc1cc(CC[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)cc(C)c1O ZINC000470132781 1039454573 /nfs/dbraw/zinc/45/45/73/1039454573.db2.gz LPAKSRDOOMWUCN-HRAATJIYSA-N 2 0 344.543 4.184 20 0 EIADRP CC[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1 ZINC000092856888 1039598598 /nfs/dbraw/zinc/59/85/98/1039598598.db2.gz KFLZSCURRMKWPV-HXUWFJFHSA-N 2 0 327.447 4.178 20 0 EIADRP Cc1cccc([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)c1C ZINC000122294962 1039633754 /nfs/dbraw/zinc/63/37/54/1039633754.db2.gz KBPQSRPLZLZQTO-GOSISDBHSA-N 2 0 326.484 4.095 20 0 EIADRP CO[C@H](C[NH+]1CCC(CCC[NH+](C)C)CC1)c1ccc(Cl)cc1 ZINC000514130155 1039643879 /nfs/dbraw/zinc/64/38/79/1039643879.db2.gz HENPEHLGZOMSEN-LJQANCHMSA-N 2 0 338.923 4.081 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(Cl)cc1 ZINC000122381454 1039678089 /nfs/dbraw/zinc/67/80/89/1039678089.db2.gz PBUZTLNIUUTOOM-HNNXBMFYSA-N 2 0 332.875 4.131 20 0 EIADRP C[C@@H](CC[NH2+][C@H](c1cccnc1)C1CCC1)[N@H+](C)Cc1ccccc1 ZINC000481666501 1039718024 /nfs/dbraw/zinc/71/80/24/1039718024.db2.gz IXANJMWBOPJLSZ-AVRDEDQJSA-N 2 0 337.511 4.423 20 0 EIADRP C[C@H](CC[NH2+][C@@H](c1cccnc1)C1CCC1)[N@H+](C)Cc1ccccc1 ZINC000481666507 1039719437 /nfs/dbraw/zinc/71/94/37/1039719437.db2.gz IXANJMWBOPJLSZ-XMSQKQJNSA-N 2 0 337.511 4.423 20 0 EIADRP c1ccc(C2(C[NH2+]C3CC[NH+](CC4CC4)CC3)CCCCC2)cc1 ZINC001168353054 1039824270 /nfs/dbraw/zinc/82/42/70/1039824270.db2.gz IQWDINFJRRTEOO-UHFFFAOYSA-N 2 0 326.528 4.353 20 0 EIADRP CCCC[NH+]1CCC(N[C@H](C)c2cccc(OC(F)F)c2)CC1 ZINC000122965163 1039836025 /nfs/dbraw/zinc/83/60/25/1039836025.db2.gz QWAPDUASXBYUJB-CQSZACIVSA-N 2 0 326.431 4.203 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC000122963181 1039837077 /nfs/dbraw/zinc/83/70/77/1039837077.db2.gz PHXDUVDOYBBEOO-AWEZNQCLSA-N 2 0 326.431 4.203 20 0 EIADRP Clc1ccc(CCCC[NH2+][C@@H]2CC23CC[NH2+]CC3)cc1Cl ZINC000666953700 1039852817 /nfs/dbraw/zinc/85/28/17/1039852817.db2.gz FMRCKVZFUOQJPL-MRXNPFEDSA-N 2 0 327.299 4.048 20 0 EIADRP C(=C\c1ccc(OCc2ccccc2)cc1)\C[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666955509 1039866713 /nfs/dbraw/zinc/86/67/13/1039866713.db2.gz SMVPJOZWEJENII-FDQBOKQBSA-N 2 0 348.490 4.011 20 0 EIADRP c1c2ccccc2sc1C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000537692199 1039909504 /nfs/dbraw/zinc/90/95/04/1039909504.db2.gz GKCMHQRFDBPXSI-VQIMIIECSA-N 2 0 326.509 4.350 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccccc1OCc1ccccc1 ZINC000481951770 1039909833 /nfs/dbraw/zinc/90/98/33/1039909833.db2.gz HJUZBFNJBXVUPW-GOSISDBHSA-N 2 0 326.484 4.258 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1ccc2ccccc2c1OC(F)F ZINC000481954306 1039911019 /nfs/dbraw/zinc/91/10/19/1039911019.db2.gz ZZEXXFSZSIDQBK-AWEZNQCLSA-N 2 0 336.426 4.434 20 0 EIADRP Cc1ccc(OCCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000482034086 1039967123 /nfs/dbraw/zinc/96/71/23/1039967123.db2.gz QANDDRPIRFLXTO-UHFFFAOYSA-N 2 0 330.516 4.151 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CC[C@H](c2ccccc2)C(F)(F)F)[C@@H](C)C1 ZINC000551238871 1040084844 /nfs/dbraw/zinc/08/48/44/1040084844.db2.gz FENIDPXKWAYUGS-UAGQMJEPSA-N 2 0 328.422 4.043 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)[C@H](C)C1 ZINC000551238870 1040086048 /nfs/dbraw/zinc/08/60/48/1040086048.db2.gz FENIDPXKWAYUGS-PVAVHDDUSA-N 2 0 328.422 4.043 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)c(F)c1 ZINC000162903668 1040095644 /nfs/dbraw/zinc/09/56/44/1040095644.db2.gz BXFUGZOSHXDODD-INIZCTEOSA-N 2 0 342.458 4.281 20 0 EIADRP Clc1cccc(Cl)c1CCC[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000482242596 1040098095 /nfs/dbraw/zinc/09/80/95/1040098095.db2.gz UEZDIMZSLIVIRF-KBPBESRZSA-N 2 0 327.299 4.142 20 0 EIADRP Clc1cccc(Cl)c1CCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000482242602 1040098671 /nfs/dbraw/zinc/09/86/71/1040098671.db2.gz UEZDIMZSLIVIRF-ZIAGYGMSSA-N 2 0 327.299 4.142 20 0 EIADRP COc1cccc2cc([C@@H](C)[NH2+]CCCCC[NH+]3CCCC3)oc21 ZINC000551259403 1040107087 /nfs/dbraw/zinc/10/70/87/1040107087.db2.gz PADIMLMJZMFEAS-MRXNPFEDSA-N 2 0 330.472 4.358 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)cc1 ZINC000479120785 1040153139 /nfs/dbraw/zinc/15/31/39/1040153139.db2.gz UMRCYDKHPYMVGC-HXUWFJFHSA-N 2 0 344.886 4.058 20 0 EIADRP c1ccc(N2CCC([NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)CC2)cc1 ZINC000162922488 1040243242 /nfs/dbraw/zinc/24/32/42/1040243242.db2.gz BVCCHENVOPVDCP-UHFFFAOYSA-N 2 0 349.522 4.041 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CC(C)(C)c3ccc(Br)cc32)CC1 ZINC000479402071 1040304110 /nfs/dbraw/zinc/30/41/10/1040304110.db2.gz KEKJVMCBKYCQMS-KRWDZBQOSA-N 2 0 349.316 4.023 20 0 EIADRP CS[C@H]1CC[C@@H]1[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000425355395 1040325257 /nfs/dbraw/zinc/32/52/57/1040325257.db2.gz ONSDLGZCCGPXPX-ROUUACIJSA-N 2 0 338.948 4.036 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cc2c(s1)CCC2 ZINC000479467132 1040391146 /nfs/dbraw/zinc/39/11/46/1040391146.db2.gz VDPXLYFPHNQKBN-FUHWJXTLSA-N 2 0 340.536 4.410 20 0 EIADRP CC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551572367 1040421054 /nfs/dbraw/zinc/42/10/54/1040421054.db2.gz IWOWZDWQTVLZHI-WIYYLYMNSA-N 2 0 330.516 4.218 20 0 EIADRP CC(C)[C@@H](CSc1ccccc1)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000479522499 1040422137 /nfs/dbraw/zinc/42/21/37/1040422137.db2.gz BLVLYOICUAAIJZ-AFMYVXGZSA-N 2 0 332.557 4.410 20 0 EIADRP c1ccc(C[NH+]2CCC[C@@H]3C[N@H+](CCCc4ccncc4)CC[C@@H]32)cc1 ZINC000462314227 1040473586 /nfs/dbraw/zinc/47/35/86/1040473586.db2.gz JBUAKLCMTLYAFJ-PKTZIBPZSA-N 2 0 349.522 4.001 20 0 EIADRP Cc1cc2[nH]c(C[NH2+]Cc3cccc(Cn4ccnc4)c3)cc2c(C)c1 ZINC000479580243 1040490467 /nfs/dbraw/zinc/49/04/67/1040490467.db2.gz PORFLECQCUVIOK-UHFFFAOYSA-N 2 0 344.462 4.319 20 0 EIADRP CC(C)CC[NH+]1CCC([NH2+]C[C@H]2CCCO[C@@H]2c2ccccc2)CC1 ZINC000924781861 1040523187 /nfs/dbraw/zinc/52/31/87/1040523187.db2.gz KKGQBNAUADSOPB-IFMALSPDSA-N 2 0 344.543 4.254 20 0 EIADRP Cc1ccc(C[N@H+](Cc2ccnn2-c2cc[nH+]cc2)C(C)C)s1 ZINC000667555803 1040648621 /nfs/dbraw/zinc/64/86/21/1040648621.db2.gz NQLLYICQXYTQQO-UHFFFAOYSA-N 2 0 326.469 4.048 20 0 EIADRP C[C@H](c1cccc2ccccc21)[NH+]1CCC([C@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000515342936 1040677851 /nfs/dbraw/zinc/67/78/51/1040677851.db2.gz MWOKYXVAGWWNTI-GTCCEBARSA-N 2 0 338.495 4.119 20 0 EIADRP COc1cc(C)c([C@@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)cc1OC ZINC000483186473 1040763345 /nfs/dbraw/zinc/76/33/45/1040763345.db2.gz UWQQKGYNCZKONE-DNVCBOLYSA-N 2 0 336.520 4.029 20 0 EIADRP CCC[C@@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000483258615 1040795998 /nfs/dbraw/zinc/79/59/98/1040795998.db2.gz NJGSIKZABLLINO-FXAWDEMLSA-N 2 0 345.531 4.166 20 0 EIADRP CN(C/C=C/c1ccc(F)cc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000539834038 1040829792 /nfs/dbraw/zinc/82/97/92/1040829792.db2.gz WFTRWPXVSWSNQU-FERLCFGISA-N 2 0 338.470 4.293 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1cccc(F)c1F ZINC000537845142 1040850578 /nfs/dbraw/zinc/85/05/78/1040850578.db2.gz FXPAOTCSYTWRMV-UHFFFAOYSA-N 2 0 345.437 4.098 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](c2ccccc2F)C2CCOCC2)C1 ZINC000903090959 1040898651 /nfs/dbraw/zinc/89/86/51/1040898651.db2.gz KAKOUIHRIQXDMR-DYESRHJHSA-N 2 0 348.506 4.003 20 0 EIADRP c1ccc([C@H](CC2CCOCC2)[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC001168368108 1040912329 /nfs/dbraw/zinc/91/23/29/1040912329.db2.gz AHEPXWPXCMEAPD-QFIPXVFZSA-N 2 0 342.527 4.008 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000462787621 1040934202 /nfs/dbraw/zinc/93/42/02/1040934202.db2.gz BUVFNIPWUDFUJE-STZQEDGTSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CC2(c3ccc(Cl)cc3Cl)CCC2)CC[N@@H+]1C ZINC000537964481 1040937377 /nfs/dbraw/zinc/93/73/77/1040937377.db2.gz RYNOQPCATQMHGK-HIFRSBDPSA-N 2 0 341.326 4.487 20 0 EIADRP CC[C@@H]([NH2+]CCC1CC[NH+](CC)CC1)c1ccc(OC(F)F)cc1 ZINC000483708931 1040979060 /nfs/dbraw/zinc/97/90/60/1040979060.db2.gz IFNBWIIVKPHWFZ-GOSISDBHSA-N 2 0 340.458 4.451 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@H]3CC[C@H](c4ccccc4)C3)C2)cc1 ZINC000436241150 1040989388 /nfs/dbraw/zinc/98/93/88/1040989388.db2.gz QNCYICSGDBNDEB-NHTMILBNSA-N 2 0 348.534 4.477 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)Cc1cccs1 ZINC000483748821 1040997375 /nfs/dbraw/zinc/99/73/75/1040997375.db2.gz WPWKFRSQHNKBTI-IRXDYDNUSA-N 2 0 346.540 4.218 20 0 EIADRP Cc1cccc(O[C@H](C)C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000483750991 1040999544 /nfs/dbraw/zinc/99/95/44/1040999544.db2.gz VBEKSKWYTHDRCB-GOSISDBHSA-N 2 0 330.516 4.149 20 0 EIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC[NH+]2CCCC2)CCC3)cc1 ZINC000480144985 1041001494 /nfs/dbraw/zinc/00/14/94/1041001494.db2.gz GHLIIVXDAOFFPR-QGZVFWFLSA-N 2 0 341.524 4.263 20 0 EIADRP C[C@@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc(F)cc1F ZINC000483809810 1041018019 /nfs/dbraw/zinc/01/80/19/1041018019.db2.gz SBGRJRIMHHQLBY-HNNXBMFYSA-N 2 0 336.470 4.455 20 0 EIADRP CSc1ccc(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000436283107 1041027256 /nfs/dbraw/zinc/02/72/56/1041027256.db2.gz KRWJNODXHVACIQ-UHFFFAOYSA-N 2 0 332.557 4.338 20 0 EIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+][C@@H]2CC[C@H]2C2CC2)CC1 ZINC000554360890 1041035811 /nfs/dbraw/zinc/03/58/11/1041035811.db2.gz NOJUEJRABOUHFF-AZUAARDMSA-N 2 0 332.919 4.330 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000436297321 1041066713 /nfs/dbraw/zinc/06/67/13/1041066713.db2.gz MCLOLUQKKDWDAL-RZDIXWSQSA-N 2 0 340.433 4.414 20 0 EIADRP COc1cc(CC[NH2+][C@@H](C)c2ccc(-n3ccnc3)cc2)ccc1C ZINC000484160251 1041149602 /nfs/dbraw/zinc/14/96/02/1041149602.db2.gz LVZXZLMCPLGHOT-KRWDZBQOSA-N 2 0 335.451 4.083 20 0 EIADRP CCC1(C[NH2+][C@H](C)c2cncs2)CC[NH+](Cc2ccccc2)CC1 ZINC000540144215 1041168665 /nfs/dbraw/zinc/16/86/65/1041168665.db2.gz VTVQPDILLGBCSU-QGZVFWFLSA-N 2 0 343.540 4.486 20 0 EIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)C(C)(C)c1ccccc1 ZINC000540137539 1041179198 /nfs/dbraw/zinc/17/91/98/1041179198.db2.gz FXMHXIOXDVMTDO-SFHVURJKSA-N 2 0 337.511 4.254 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000484305286 1041191250 /nfs/dbraw/zinc/19/12/50/1041191250.db2.gz VFIIDBSKJHHGPW-TZMCWYRMSA-N 2 0 333.303 4.001 20 0 EIADRP Cc1ccc(SC2(C[NH2+][C@H]3CC[N@H+](C)[C@H](C)C3)CCCC2)cc1 ZINC000484287863 1041196629 /nfs/dbraw/zinc/19/66/29/1041196629.db2.gz CYHWAVGHHIMLBB-MSOLQXFVSA-N 2 0 332.557 4.472 20 0 EIADRP COc1cccc2c1CC[C@@H]2[NH2+]CC1CC[NH+](CCC(C)C)CC1 ZINC000484306780 1041202772 /nfs/dbraw/zinc/20/27/72/1041202772.db2.gz XQZXOXCFLADQMK-FQEVSTJZSA-N 2 0 330.516 4.030 20 0 EIADRP c1ccc(C[C@@H]2CC[C@H]([NH2+]CC3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000436401416 1041205871 /nfs/dbraw/zinc/20/58/71/1041205871.db2.gz PDVVMOACFIUGQX-VXKWHMMOSA-N 2 0 349.522 4.299 20 0 EIADRP C[NH+]1CCC(CC[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)CC1 ZINC000480351263 1041225650 /nfs/dbraw/zinc/22/56/50/1041225650.db2.gz BUSJPRHXQYRTMN-UHFFFAOYSA-N 2 0 334.410 4.046 20 0 EIADRP Cc1cc(C)c2c(c1)[C@H](NC1CC[NH+](C(C)(C)C)CC1)CCCO2 ZINC000540189588 1041233929 /nfs/dbraw/zinc/23/39/29/1041233929.db2.gz BFBGRXNCYJNBMA-LJQANCHMSA-N 2 0 330.516 4.370 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)C1 ZINC000540301592 1041353516 /nfs/dbraw/zinc/35/35/16/1041353516.db2.gz LQUYJOUCDUESDK-SJCJKPOMSA-N 2 0 327.299 4.376 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCc2cccc(F)c2)CCN1Cc1ccccc1 ZINC000463138085 1041373349 /nfs/dbraw/zinc/37/33/49/1041373349.db2.gz UNOZMODIRBJRIK-UTKZUKDTSA-N 2 0 326.459 4.011 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000463141464 1041375394 /nfs/dbraw/zinc/37/53/94/1041375394.db2.gz ZDONDTLABANVOK-ONTIZHBOSA-N 2 0 345.575 4.140 20 0 EIADRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1ccsc1 ZINC000540394995 1041428148 /nfs/dbraw/zinc/42/81/48/1041428148.db2.gz MMXBJTXQNOWBIG-QGZVFWFLSA-N 2 0 344.524 4.116 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(OC(F)F)cc1 ZINC000480629486 1041432099 /nfs/dbraw/zinc/43/20/99/1041432099.db2.gz DVGRKGHDZNNMQG-JKSUJKDBSA-N 2 0 340.458 4.451 20 0 EIADRP CCc1nc2c(s1)[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)CCC2 ZINC000480628800 1041432151 /nfs/dbraw/zinc/43/21/51/1041432151.db2.gz ZSSITPGBCKNOMI-INIZCTEOSA-N 2 0 335.561 4.185 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(F)cc1N(C)C ZINC000480634113 1041446841 /nfs/dbraw/zinc/44/68/41/1041446841.db2.gz ZMQNUJHQHXWMSA-IRXDYDNUSA-N 2 0 335.511 4.054 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)C2=CCCCC2)[C@@H](C)C1 ZINC000480693755 1041476229 /nfs/dbraw/zinc/47/62/29/1041476229.db2.gz NDDNXLGUXHNUAM-AZUAARDMSA-N 2 0 336.564 4.240 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1ccc(OC(F)(F)F)cc1 ZINC000484879269 1041478000 /nfs/dbraw/zinc/47/80/00/1041478000.db2.gz DTGDTFRKOHCGLF-DZGCQCFKSA-N 2 0 330.394 4.110 20 0 EIADRP COc1cc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1F ZINC000195133223 1041484601 /nfs/dbraw/zinc/48/46/01/1041484601.db2.gz KOGIPFUHFQOKQY-AEFFLSMTSA-N 2 0 342.458 4.007 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1F ZINC000480714265 1041491935 /nfs/dbraw/zinc/49/19/35/1041491935.db2.gz YGMDWABIOPVABH-JPLJXNOCSA-N 2 0 346.490 4.077 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc3[nH]cnc3c2)CC1 ZINC000538724660 1041496094 /nfs/dbraw/zinc/49/60/94/1041496094.db2.gz VKFIGKQBSGZAAY-KRWDZBQOSA-N 2 0 340.515 4.039 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)[C@H](C)C1 ZINC000540496200 1041499580 /nfs/dbraw/zinc/49/95/80/1041499580.db2.gz YDYQNCIAKAJSCR-JYBIWHBTSA-N 2 0 342.527 4.389 20 0 EIADRP Cc1cccc(COc2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@H](C)C3)cc2)c1 ZINC000480753980 1041510065 /nfs/dbraw/zinc/51/00/65/1041510065.db2.gz CPLQXMMXWSEYHZ-WIYYLYMNSA-N 2 0 338.495 4.146 20 0 EIADRP CC[N@@H+](Cc1ccc(OC)cc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000538761881 1041537045 /nfs/dbraw/zinc/53/70/45/1041537045.db2.gz IUEOQTNFRBUIQR-NRFANRHFSA-N 2 0 338.495 4.039 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@H](c1cc2ccccc2o1)C(C)C ZINC000540657010 1041590168 /nfs/dbraw/zinc/59/01/68/1041590168.db2.gz UNBGNBZZDLCVDO-PXNSSMCTSA-N 2 0 332.488 4.076 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1Nc1ccc(C[NH+]2CCCC[C@@H]2C)cc1 ZINC000540699940 1041614975 /nfs/dbraw/zinc/61/49/75/1041614975.db2.gz RRMSCPHOFKVVRT-IIMDRIAPSA-N 2 0 329.532 4.202 20 0 EIADRP c1ccc(COC2CC([NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)cc1 ZINC000463563573 1041630002 /nfs/dbraw/zinc/63/00/02/1041630002.db2.gz MCUWTZAIGGRXSC-UHFFFAOYSA-N 2 0 342.527 4.121 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2nc3cc(F)ccc3o2)CC1 ZINC000541091457 1041807320 /nfs/dbraw/zinc/80/73/20/1041807320.db2.gz XRLNFHWYTPWWGL-UHFFFAOYSA-N 2 0 347.478 4.301 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2c[nH]nc2-c2ccsc2)CC1 ZINC000437578334 1041845774 /nfs/dbraw/zinc/84/57/74/1041845774.db2.gz JMKBACRMOUVIBG-UHFFFAOYSA-N 2 0 346.544 4.082 20 0 EIADRP CC1(C)[C@@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C[C@H]1c1ccccc1 ZINC000464071242 1041854331 /nfs/dbraw/zinc/85/43/31/1041854331.db2.gz HDTCFAKQOWDEEG-VXKWHMMOSA-N 2 0 349.522 4.470 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000464069679 1041854341 /nfs/dbraw/zinc/85/43/41/1041854341.db2.gz FGTNTOHZIQVIRM-BHIFYINESA-N 2 0 344.543 4.212 20 0 EIADRP C[C@@]1(c2ccccc2)CC[C@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000437779850 1041898099 /nfs/dbraw/zinc/89/80/99/1041898099.db2.gz CKZDCUHKZCIBPI-JTHBVZDNSA-N 2 0 349.522 4.398 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000437782371 1041898990 /nfs/dbraw/zinc/89/89/90/1041898990.db2.gz YLPNXWHQAQHSFG-SJJHQCBESA-N 2 0 326.406 4.201 20 0 EIADRP Cn1ccnc1C[C@@H]1CCC[N@@H+]([C@H]2CC[C@@](C)(c3ccccc3)C2)C1 ZINC000437791853 1041912172 /nfs/dbraw/zinc/91/21/72/1041912172.db2.gz HTYPVOCBVOQNKU-RCZSKKKRSA-N 2 0 337.511 4.185 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](C)CC(F)(F)F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000402757736 1042005611 /nfs/dbraw/zinc/00/56/11/1042005611.db2.gz GDVVHUYJVJMJAI-UXLLHSPISA-N 2 0 328.422 4.075 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCn1c2ccccc2c2ccccc21 ZINC000541571136 1042019176 /nfs/dbraw/zinc/01/91/76/1042019176.db2.gz OSXMEAVDWABZPZ-MBOZVWFJSA-N 2 0 335.495 4.113 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000438208217 1042087348 /nfs/dbraw/zinc/08/73/48/1042087348.db2.gz LYJYWFHKAXNLFS-MRXNPFEDSA-N 2 0 346.515 4.320 20 0 EIADRP COc1cccc(CCC[NH2+][C@H](C)c2cccc(-n3ccnc3)c2)c1 ZINC000542010438 1042230590 /nfs/dbraw/zinc/23/05/90/1042230590.db2.gz NTSAMVYCNWGDFY-QGZVFWFLSA-N 2 0 335.451 4.164 20 0 EIADRP CC(C)c1ccc(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000303163336 1042336552 /nfs/dbraw/zinc/33/65/52/1042336552.db2.gz HMOFLKCZQMTPBV-JOCHJYFZSA-N 2 0 336.523 4.464 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)CC3 ZINC000491354506 1042431379 /nfs/dbraw/zinc/43/13/79/1042431379.db2.gz BXRHXOXPCPPIJS-OAHLLOKOSA-N 2 0 339.527 4.232 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCCOc2ccc(F)cc2)C1 ZINC000303603354 1042483727 /nfs/dbraw/zinc/48/37/27/1042483727.db2.gz NYEWPCQBRHPXPM-RTBURBONSA-N 2 0 348.506 4.181 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCCOc2ccccc2)C1 ZINC000303657676 1042492218 /nfs/dbraw/zinc/49/22/18/1042492218.db2.gz VEFNWMSIQKHOGN-VQTJNVASSA-N 2 0 330.516 4.042 20 0 EIADRP [NH3+][C@H]1CCC[C@H](C[NH2+]Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000414989505 1042556718 /nfs/dbraw/zinc/55/67/18/1042556718.db2.gz HFJZHOQQHBZWDY-ZFWWWQNUSA-N 2 0 334.410 4.048 20 0 EIADRP Cc1cccc2c(CC[NH3+])cn(C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)c21 ZINC001167964464 1042609470 /nfs/dbraw/zinc/60/94/70/1042609470.db2.gz QRLFZHICXAECRO-YOFSQIOKSA-N 2 0 337.511 4.029 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccncc1 ZINC000173931290 1042629108 /nfs/dbraw/zinc/62/91/08/1042629108.db2.gz VJZAOXZMVVYRPW-QRVBRYPASA-N 2 0 337.511 4.410 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2cc3ccnc(Cl)c3s2)c1 ZINC000894383581 1042675473 /nfs/dbraw/zinc/67/54/73/1042675473.db2.gz FTTFNPYOEPTZBZ-UHFFFAOYSA-N 2 0 345.899 4.301 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1 ZINC000415005627 1042793556 /nfs/dbraw/zinc/79/35/56/1042793556.db2.gz JGMMUVNYUZOSIO-JEBQAFNWSA-N 2 0 340.433 4.004 20 0 EIADRP C[C@H]([NH2+]CCC[N@H+](C)Cc1ccccc1)c1cnc2ccsc2c1 ZINC000309942190 1042824660 /nfs/dbraw/zinc/82/46/60/1042824660.db2.gz ISXWVDAKTBEZMB-INIZCTEOSA-N 2 0 339.508 4.469 20 0 EIADRP COc1cccc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)c1 ZINC000177214007 1042830955 /nfs/dbraw/zinc/83/09/55/1042830955.db2.gz PNYGZQWSARBTTG-QGZVFWFLSA-N 2 0 326.484 4.386 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000310998835 1042850066 /nfs/dbraw/zinc/85/00/66/1042850066.db2.gz UVEIKUHUHJNACO-BBTUJRGHSA-N 2 0 338.495 4.256 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000310998850 1042850318 /nfs/dbraw/zinc/85/03/18/1042850318.db2.gz UVEIKUHUHJNACO-WAOWUJCRSA-N 2 0 338.495 4.256 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311145899 1042853590 /nfs/dbraw/zinc/85/35/90/1042853590.db2.gz ZLARZIMBKPEGNL-DKZVUGQWSA-N 2 0 338.470 4.313 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H]2CCc3[nH]c4ccc(C)cc4c3C2)CC1 ZINC000493275764 1042891055 /nfs/dbraw/zinc/89/10/55/1042891055.db2.gz BVJNMFLVASQPHS-GOSISDBHSA-N 2 0 339.527 4.045 20 0 EIADRP c1cc(C[NH+]2CCCCC2)ccc1C[N@@H+]1CCC[C@H]1[C@H]1CCCOC1 ZINC000520575620 1042899598 /nfs/dbraw/zinc/89/95/98/1042899598.db2.gz WNIPTQWPYKYQRX-VXKWHMMOSA-N 2 0 342.527 4.064 20 0 EIADRP C[C@H]1CC([NH2+]CCc2cccs2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168004875 1042942111 /nfs/dbraw/zinc/94/21/11/1042942111.db2.gz BDEMNYAGBXDIDC-IRXDYDNUSA-N 2 0 328.525 4.322 20 0 EIADRP COC[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(Cl)cc1 ZINC000493882620 1042970833 /nfs/dbraw/zinc/97/08/33/1042970833.db2.gz JOXROKYMEUDERV-LPHOPBHVSA-N 2 0 338.923 4.129 20 0 EIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000493978305 1042991321 /nfs/dbraw/zinc/99/13/21/1042991321.db2.gz RMCJMPHOFFAYNX-GCJKJVERSA-N 2 0 340.511 4.393 20 0 EIADRP C[C@@H]1CC([NH2+]CCc2ccccc2F)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168006332 1043000768 /nfs/dbraw/zinc/00/07/68/1043000768.db2.gz NGLQBQVYLWRGFF-QZTJIDSGSA-N 2 0 340.486 4.399 20 0 EIADRP Cc1nc2ccc(C[NH2+]Cc3ccc(F)c(C[NH+](C)C)c3)cc2s1 ZINC000494050550 1043008511 /nfs/dbraw/zinc/00/85/11/1043008511.db2.gz QWROFWRMLLLYNB-UHFFFAOYSA-N 2 0 343.471 4.095 20 0 EIADRP C[C@H]1CC([NH2+]CCc2ccc(F)cc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168006695 1043008712 /nfs/dbraw/zinc/00/87/12/1043008712.db2.gz OFAHIWAUDSCHNX-ROUUACIJSA-N 2 0 340.486 4.399 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2coc(-c3ccccc3)n2)CC1 ZINC000076776551 1043148119 /nfs/dbraw/zinc/14/81/19/1043148119.db2.gz UVKZLBADKYXDTG-UHFFFAOYSA-N 2 0 341.499 4.286 20 0 EIADRP CC(C)[C@H](Cc1ccccc1)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000427715383 1043173902 /nfs/dbraw/zinc/17/39/02/1043173902.db2.gz QFFAHFSCJZQTAW-QFIPXVFZSA-N 2 0 337.511 4.155 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(C(F)F)nc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000657969671 1043232141 /nfs/dbraw/zinc/23/21/41/1043232141.db2.gz SXQAHJCPXGNHDC-LZWOXQAQSA-N 2 0 337.458 4.323 20 0 EIADRP C[C@H]([NH2+]CC1([NH3+])CCCC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000665249773 1043263078 /nfs/dbraw/zinc/26/30/78/1043263078.db2.gz YVAJOTAPZUHDQC-RYUDHWBXSA-N 2 0 331.287 4.010 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccnn2C(C)C)CC1)CC(C)C ZINC000499600915 1043391874 /nfs/dbraw/zinc/39/18/74/1043391874.db2.gz QYCZDNZKZKWGDK-UHFFFAOYSA-N 2 0 334.552 4.044 20 0 EIADRP CC(C)=CCC[C@@H](C)[NH2+]C1CCN(c2ccc(N(C)C)cc2)CC1 ZINC000766189698 1043398904 /nfs/dbraw/zinc/39/89/04/1043398904.db2.gz HGZGEOSTWQHLAF-GOSISDBHSA-N 2 0 329.532 4.446 20 0 EIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)C1CCC(F)(F)CC1 ZINC000474027457 1043432109 /nfs/dbraw/zinc/43/21/09/1043432109.db2.gz DDZKZOCSCPEYAP-HNNXBMFYSA-N 2 0 337.458 4.102 20 0 EIADRP C[C@@H]1CC([NH2+]CC2(C)CC(F)(F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168012808 1043452704 /nfs/dbraw/zinc/45/27/04/1043452704.db2.gz FKQZBWLYAGEQPB-HZPDHXFCSA-N 2 0 336.470 4.453 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CCc3cc(N)ccc32)CC1 ZINC000665270987 1043459878 /nfs/dbraw/zinc/45/98/78/1043459878.db2.gz DVDQJNOFZCGRAK-BBHUYCHWSA-N 2 0 349.522 4.289 20 0 EIADRP CCn1c2ccccc2c2cc(C[NH2+][C@H]3CCn4ccnc4C3)ccc21 ZINC000494409705 1043468065 /nfs/dbraw/zinc/46/80/65/1043468065.db2.gz GZPLESFDXWKLSZ-KRWDZBQOSA-N 2 0 344.462 4.116 20 0 EIADRP Fc1ccc(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)c(F)c1F ZINC000542484443 1043536560 /nfs/dbraw/zinc/53/65/60/1043536560.db2.gz FSRXZXUSERORTF-UHFFFAOYSA-N 2 0 340.433 4.033 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)[C@@H](C)C1 ZINC000674305334 1043571187 /nfs/dbraw/zinc/57/11/87/1043571187.db2.gz HLJLUXFJGCJIAM-YJBOKZPZSA-N 2 0 342.449 4.300 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC000674305331 1043574422 /nfs/dbraw/zinc/57/44/22/1043574422.db2.gz HLJLUXFJGCJIAM-CRAIPNDOSA-N 2 0 342.449 4.300 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccnn1-c1ccccc1 ZINC000467364158 1043582387 /nfs/dbraw/zinc/58/23/87/1043582387.db2.gz JIHAYROLHMUBSG-OALUTQOASA-N 2 0 340.515 4.178 20 0 EIADRP Cc1cccc2c1CCC[C@@H]2[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000665283664 1043689298 /nfs/dbraw/zinc/68/92/98/1043689298.db2.gz RYTLIWNDYGFXNR-QNWVGRARSA-N 2 0 348.490 4.218 20 0 EIADRP CSC1(C[NH2+][C@H](C)c2cccc(CC(C)C)c2)CC[NH+](C)CC1 ZINC000521320531 1043709158 /nfs/dbraw/zinc/70/91/58/1043709158.db2.gz ZCFRAGKKPIKYLS-QGZVFWFLSA-N 2 0 334.573 4.363 20 0 EIADRP c1csc(C[NH+]2CCC(CNc3cc[nH+]c4ccccc34)CC2)c1 ZINC000521364171 1043729033 /nfs/dbraw/zinc/72/90/33/1043729033.db2.gz IQFCVBIVUFMEEP-UHFFFAOYSA-N 2 0 337.492 4.042 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCCC[C@H]3[C@@H]3CCOC3)CC2)CC1 ZINC000474034486 1043730903 /nfs/dbraw/zinc/73/09/03/1043730903.db2.gz SBUVJMHGKWJCIT-VQSBLYBRSA-N 2 0 348.575 4.214 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000191019059 1043765174 /nfs/dbraw/zinc/76/51/74/1043765174.db2.gz ZMTOUURPIPFELT-NSHGMRRFSA-N 2 0 334.548 4.111 20 0 EIADRP COCCC[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCCC1)c1ccc(F)cc1 ZINC000442723111 1043824516 /nfs/dbraw/zinc/82/45/16/1043824516.db2.gz YONZDLNTGGLDAV-FXAWDEMLSA-N 2 0 336.495 4.005 20 0 EIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CCCc1ccsc1 ZINC000469757912 1043935841 /nfs/dbraw/zinc/93/58/41/1043935841.db2.gz OHKLDXFUZAWXFS-WGMWDUQUSA-N 2 0 342.552 4.427 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000442996095 1043941905 /nfs/dbraw/zinc/94/19/05/1043941905.db2.gz XINCRDAZYISRTL-UHFFFAOYSA-N 2 0 328.422 4.224 20 0 EIADRP c1coc(-c2ncc(C[NH2+]CCCCC[NH+]3CCCCC3)s2)c1 ZINC000193101981 1044001695 /nfs/dbraw/zinc/00/16/95/1044001695.db2.gz DJOJOBFLFVTZRJ-UHFFFAOYSA-N 2 0 333.501 4.149 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCCC[C@H]1c1ccccc1 ZINC000358274944 1044261385 /nfs/dbraw/zinc/26/13/85/1044261385.db2.gz FLAWXESQKMFYAV-NRFANRHFSA-N 2 0 332.451 4.303 20 0 EIADRP Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000326934485 1044332491 /nfs/dbraw/zinc/33/24/91/1044332491.db2.gz VVJSWBYPZJKMTD-IBGZPJMESA-N 2 0 339.483 4.255 20 0 EIADRP C[C@@H](C[NH2+]CC1CC[NH+](C2CCOCC2)CC1)CC1CCCCC1 ZINC000657537182 1044377028 /nfs/dbraw/zinc/37/70/28/1044377028.db2.gz BRTYZNMAAHMKEL-GOSISDBHSA-N 2 0 336.564 4.074 20 0 EIADRP CCC(C)(C)[NH2+][C@@H](C)C(=O)Nc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000542515439 1044394866 /nfs/dbraw/zinc/39/48/66/1044394866.db2.gz YGUPKMUGHAVJQG-SJORKVTESA-N 2 0 345.531 4.024 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2CCSc3c(F)cccc32)c1 ZINC000177733508 1044449844 /nfs/dbraw/zinc/44/98/44/1044449844.db2.gz CLCKJWIABXLRHZ-GOSISDBHSA-N 2 0 330.472 4.214 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@H](C[C@H]1CCOC1)c1ccc(F)cc1 ZINC000494880542 1044467291 /nfs/dbraw/zinc/46/72/91/1044467291.db2.gz SNLZLVMODBMLOP-DBXWQHBBSA-N 2 0 348.506 4.148 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@H](C[C@@H]1CCOC1)c1ccc(F)cc1 ZINC000494880545 1044467406 /nfs/dbraw/zinc/46/74/06/1044467406.db2.gz SNLZLVMODBMLOP-LVCYWYKZSA-N 2 0 348.506 4.148 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)c1cccc(C(F)(F)F)c1)C1CC[NH+](C)CC1 ZINC000675807002 1044507972 /nfs/dbraw/zinc/50/79/72/1044507972.db2.gz DGQJIZAYJMXMRC-CQSZACIVSA-N 2 0 342.449 4.303 20 0 EIADRP C[C@@H]1CC(N2CC[C@H]([NH3+])c3ccccc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168023154 1044561933 /nfs/dbraw/zinc/56/19/33/1044561933.db2.gz VMYSCORWSVEKNN-HMFYCAOWSA-N 2 0 349.522 4.338 20 0 EIADRP c1ccc(C[C@H]([NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)C2CCCCC2)cc1 ZINC000480742560 1044579280 /nfs/dbraw/zinc/57/92/80/1044579280.db2.gz CKUDWWFRSXWQEU-VSKRKVRLSA-N 2 0 326.528 4.394 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ncccc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168024270 1044607005 /nfs/dbraw/zinc/60/70/05/1044607005.db2.gz CZYMKNIIAFRCFI-YZIUBNRHSA-N 2 0 335.495 4.100 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3ccc(F)cc32)c1 ZINC000177978440 1044607196 /nfs/dbraw/zinc/60/71/96/1044607196.db2.gz OLVZTOLXHXRKJG-NRFANRHFSA-N 2 0 326.459 4.443 20 0 EIADRP C[C@@H](Cc1cccc(F)c1)[NH2+]C1CC[NH+](C[C@@H]2CC=CCC2)CC1 ZINC001168476307 1044628794 /nfs/dbraw/zinc/62/87/94/1044628794.db2.gz SUHQPJAXWBOSHS-ZWKOTPCHSA-N 2 0 330.491 4.167 20 0 EIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3csc(-c4cccs4)n3)C2)CC1 ZINC000550573283 1044696642 /nfs/dbraw/zinc/69/66/42/1044696642.db2.gz BNUPBSXUKKYVGQ-HNNXBMFYSA-N 2 0 347.553 4.035 20 0 EIADRP C[C@H]1CC([NH2+]CCCC(F)(F)F)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168026914 1044721908 /nfs/dbraw/zinc/72/19/08/1044721908.db2.gz MFIUOLWXAVQICU-GJZGRUSLSA-N 2 0 328.422 4.360 20 0 EIADRP c1ccc([C@H]2CC[N@H+]2Cc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000676413569 1044735733 /nfs/dbraw/zinc/73/57/33/1044735733.db2.gz DDUUUPNWQMLPSV-JOCHJYFZSA-N 2 0 336.479 4.108 20 0 EIADRP CCC1(C[NH2+]Cc2ccc(C)nc2)CC[NH+](Cc2ccccc2)CC1 ZINC000360701567 1044768748 /nfs/dbraw/zinc/76/87/48/1044768748.db2.gz QCPNVRQTXSECTQ-UHFFFAOYSA-N 2 0 337.511 4.172 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H]2CCSc3c(F)cccc32)ccc1F ZINC000178300872 1044802246 /nfs/dbraw/zinc/80/22/46/1044802246.db2.gz BHAVOENOQPYLFC-GOSISDBHSA-N 2 0 348.462 4.353 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+]C[C@H](C)C[NH+]2CCCC2)cc1 ZINC000237339064 1044910145 /nfs/dbraw/zinc/91/01/45/1044910145.db2.gz ZLGYPENPJZGJLS-SFHVURJKSA-N 2 0 338.495 4.184 20 0 EIADRP CCC[C@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1cccnc1 ZINC000544570186 1044944320 /nfs/dbraw/zinc/94/43/20/1044944320.db2.gz WPZYJFSKSXZZKF-RXVVDRJESA-N 2 0 325.500 4.423 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2csc(-c3ccsc3)n2)CC1 ZINC000922847625 1044994648 /nfs/dbraw/zinc/99/46/48/1044994648.db2.gz BOTMEDGYPYAFAQ-UHFFFAOYSA-N 2 0 347.553 4.368 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2csc(-c3cccs3)n2)CC1 ZINC000922847179 1044995686 /nfs/dbraw/zinc/99/56/86/1044995686.db2.gz LFVDGGVTTVLAEV-UHFFFAOYSA-N 2 0 347.553 4.368 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)CC1 ZINC000922844824 1044997194 /nfs/dbraw/zinc/99/71/94/1044997194.db2.gz HOOVMZDSJCTKMO-RCKXYERXSA-N 2 0 327.516 4.104 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+][C@H]2CCC[C@H](c3cccnc3)C2)CC1 ZINC000922844650 1044997909 /nfs/dbraw/zinc/99/79/09/1044997909.db2.gz HOOVMZDSJCTKMO-AFVILVPDSA-N 2 0 327.516 4.104 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CCN1CCCC[C@@H]1C ZINC000474479564 1045021466 /nfs/dbraw/zinc/02/14/66/1045021466.db2.gz YFBHHQZIWDXNKF-XHSDSOJGSA-N 2 0 331.529 4.252 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)CC1 ZINC000495415805 1045067715 /nfs/dbraw/zinc/06/77/15/1045067715.db2.gz UGVBWSRKAXXYGE-HXUWFJFHSA-N 2 0 330.491 4.472 20 0 EIADRP COC1(C[C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CCC1 ZINC000429443340 1045142987 /nfs/dbraw/zinc/14/29/87/1045142987.db2.gz CQKFREACEJJMMX-QKNQBKEWSA-N 2 0 344.543 4.224 20 0 EIADRP CCCCc1noc([C@@H](C)N(CC)Cc2ccc(C[NH+](C)C)cc2)n1 ZINC000626062260 1045165702 /nfs/dbraw/zinc/16/57/02/1045165702.db2.gz MXYXMYUQCJVJQE-MRXNPFEDSA-N 2 0 344.503 4.057 20 0 EIADRP CCCCCC/C(=C/c1ccccc1)C[NH2+]CC1(O)CC[NH+](C)CC1 ZINC000740899156 1045241544 /nfs/dbraw/zinc/24/15/44/1045241544.db2.gz USBUVZILBKEFPG-FXBPSFAMSA-N 2 0 344.543 4.087 20 0 EIADRP Cc1nccn1CCCC[N@@H+]1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000429124230 1045255962 /nfs/dbraw/zinc/25/59/62/1045255962.db2.gz ZFVOIVFRMWIZOG-GOSISDBHSA-N 2 0 349.931 4.492 20 0 EIADRP CCCCCOc1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC000236786116 1045366708 /nfs/dbraw/zinc/36/67/08/1045366708.db2.gz INEIOCKBDAJECZ-IHWFROFDSA-N 2 0 330.516 4.361 20 0 EIADRP c1csc(CC[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000762928016 1045417009 /nfs/dbraw/zinc/41/70/09/1045417009.db2.gz YNYATCFWZZZYMM-UHFFFAOYSA-N 2 0 340.536 4.279 20 0 EIADRP COc1ccccc1[C@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000397620186 1045696851 /nfs/dbraw/zinc/69/68/51/1045696851.db2.gz VSNSIXVYSNPANC-SFHVURJKSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H]3CCOC4(CCCC4)C3)CC2)C1 ZINC000246890765 1045833795 /nfs/dbraw/zinc/83/37/95/1045833795.db2.gz MATZZTSUOAOGQV-HOJAQTOUSA-N 2 0 334.548 4.111 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1cncc(F)c1 ZINC000247004115 1045836726 /nfs/dbraw/zinc/83/67/26/1045836726.db2.gz KVWHHRTWTGHHJN-DLBZAZTESA-N 2 0 341.474 4.303 20 0 EIADRP Cc1cncc([C@H](C)[NH2+]C[C@@H]2CCCN(C)[C@H]2c2cccs2)c1 ZINC000248770291 1045884346 /nfs/dbraw/zinc/88/43/46/1045884346.db2.gz XWSXSZJHONLGCA-TXPKVOOTSA-N 2 0 329.513 4.185 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccc(OC(F)F)cc1 ZINC000658354972 1045960063 /nfs/dbraw/zinc/96/00/63/1045960063.db2.gz AEUZWWYPMQKBEK-AWEZNQCLSA-N 2 0 338.442 4.061 20 0 EIADRP C[C@@H](Cc1ccccc1Cl)[NH+]1CCC([NH3+])(c2ccccc2)CC1 ZINC001170264122 1045961662 /nfs/dbraw/zinc/96/16/62/1045961662.db2.gz UNMMERMNVOEYDX-INIZCTEOSA-N 2 0 328.887 4.221 20 0 EIADRP CCc1noc(C)c1[C@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000769871848 1046100271 /nfs/dbraw/zinc/10/02/71/1046100271.db2.gz ZVRLCWVXZPOYOS-HNNXBMFYSA-N 2 0 329.488 4.236 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[N@H+](C)CC2CC[NH2+]CC2)cc1 ZINC000261738893 1046139637 /nfs/dbraw/zinc/13/96/37/1046139637.db2.gz MMROLPSXEYMKCW-QGZVFWFLSA-N 2 0 338.495 4.355 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CCc2ccc(-c3csc(C)n3)s2)[C@H](C)C1 ZINC000164467484 1046150359 /nfs/dbraw/zinc/15/03/59/1046150359.db2.gz UPSCYLKKUSDFQV-CJNGLKHVSA-N 2 0 349.569 4.042 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCC2CC[NH+](C)CC2)c2ccccc12 ZINC000125328516 1046300530 /nfs/dbraw/zinc/30/05/30/1046300530.db2.gz QXOONVDZECAQOY-MRXNPFEDSA-N 2 0 326.484 4.231 20 0 EIADRP CC[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(OC(F)F)cc1 ZINC000125440323 1046307861 /nfs/dbraw/zinc/30/78/61/1046307861.db2.gz ZQAYSLFKIJRMER-KRWDZBQOSA-N 2 0 326.431 4.061 20 0 EIADRP COc1ccc2cc([C@H](C)[NH2+]CCC3CC[NH+](C)CC3)ccc2c1 ZINC000125472626 1046310331 /nfs/dbraw/zinc/31/03/31/1046310331.db2.gz LDUYMKNRFQOHOU-INIZCTEOSA-N 2 0 326.484 4.231 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cccc(Cl)c1 ZINC000162567714 1046351758 /nfs/dbraw/zinc/35/17/58/1046351758.db2.gz ZZWWCHLGXPIXKF-HNNXBMFYSA-N 2 0 332.875 4.131 20 0 EIADRP C[C@H](Cc1ccccc1Cl)[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000916834722 1046376920 /nfs/dbraw/zinc/37/69/20/1046376920.db2.gz VVOSHQQTAGVBBI-MRXNPFEDSA-N 2 0 346.902 4.001 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]CC1CC[NH2+]CC1 ZINC000455633291 1046385067 /nfs/dbraw/zinc/38/50/67/1046385067.db2.gz CJGQMJFAKFYWLX-GFCCVEGCSA-N 2 0 349.931 4.422 20 0 EIADRP C[NH+]1C(C)(C)CC(Nc2cc(N3CCCCC3)cc[nH+]2)CC1(C)C ZINC001170453546 1046552720 /nfs/dbraw/zinc/55/27/20/1046552720.db2.gz MYOHMSJACSEFTO-UHFFFAOYSA-N 2 0 330.520 4.135 20 0 EIADRP COc1ccccc1[C@@H](C)[NH2+]C[C@H]1CCCN(Cc2cccs2)C1 ZINC000126815993 1046564739 /nfs/dbraw/zinc/56/47/39/1046564739.db2.gz HBSGMMGTHLUOLE-IAGOWNOFSA-N 2 0 344.524 4.320 20 0 EIADRP CCOc1ccccc1[C@H](CC)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459400674 1046596847 /nfs/dbraw/zinc/59/68/47/1046596847.db2.gz NAICUZXUJLTZDA-FQEVSTJZSA-N 2 0 339.483 4.190 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cnc(-c3ccsc3)s2)[C@@H](C)C1 ZINC000536661017 1046628175 /nfs/dbraw/zinc/62/81/75/1046628175.db2.gz VBTAQFGTOSWVRH-BBRMVZONSA-N 2 0 335.542 4.034 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC)c3ccccc23)[C@H](C)C1 ZINC000536682577 1046646705 /nfs/dbraw/zinc/64/67/05/1046646705.db2.gz YTJIHQCDTSXIMP-OXQOHEQNSA-N 2 0 326.484 4.011 20 0 EIADRP c1cnc2ccc(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)cc2c1 ZINC000536697864 1046697821 /nfs/dbraw/zinc/69/78/21/1046697821.db2.gz SPKGEDJWHVMYKL-UHFFFAOYSA-N 2 0 337.511 4.323 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CCCOc2ccccc2)CCN1Cc1ccccc1 ZINC000379624695 1046713921 /nfs/dbraw/zinc/71/39/21/1046713921.db2.gz JRDUVMUTZSYSOT-TZIWHRDSSA-N 2 0 338.495 4.098 20 0 EIADRP C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc2ncsc2c1 ZINC000459499076 1046726728 /nfs/dbraw/zinc/72/67/28/1046726728.db2.gz LWFLZEVDXSPSNB-AWEZNQCLSA-N 2 0 338.480 4.011 20 0 EIADRP Cc1ccc(SC[C@@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459542279 1046763628 /nfs/dbraw/zinc/76/36/28/1046763628.db2.gz XOHSOAJLPFEPHE-QGZVFWFLSA-N 2 0 341.524 4.129 20 0 EIADRP Cc1cccc(C[C@@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C2CC2)c1 ZINC000536825075 1046807964 /nfs/dbraw/zinc/80/79/64/1046807964.db2.gz DUXOHMNQZYGNTR-HSZRJFAPSA-N 2 0 349.522 4.217 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cc1 ZINC000536833042 1046810290 /nfs/dbraw/zinc/81/02/90/1046810290.db2.gz MFSKYBUCJVGBQM-KKXNLOMOSA-N 2 0 330.516 4.389 20 0 EIADRP C[C@@H]1C[N@@H+](CCCC[NH2+]C2CCC(c3ccccc3)CC2)C[C@H](C)O1 ZINC000536858420 1046826523 /nfs/dbraw/zinc/82/65/23/1046826523.db2.gz PAMQFKQKVYGUHK-IVCWUUCSSA-N 2 0 344.543 4.192 20 0 EIADRP CC(C)[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(F)cn1 ZINC000497868099 1047142726 /nfs/dbraw/zinc/14/27/26/1047142726.db2.gz NCHZGTDXJKDSPA-HLIPFELVSA-N 2 0 335.511 4.266 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCc3nc(Cl)ccc32)c1 ZINC000806131011 1047156101 /nfs/dbraw/zinc/15/61/01/1047156101.db2.gz GJCXVVCPACYAER-GOSISDBHSA-N 2 0 343.902 4.354 20 0 EIADRP C(CCC[NH2+][C@@H]1CCCC[C@@H]1[C@H]1CCOC1)CCC[NH+]1CCCC1 ZINC000788988569 1047343846 /nfs/dbraw/zinc/34/38/46/1047343846.db2.gz SAOZNISVIULIRL-PWRODBHTSA-N 2 0 336.564 4.218 20 0 EIADRP CC1(C)C[C@@H]([NH2+][C@H]2CCN(Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000897793516 1047482911 /nfs/dbraw/zinc/48/29/11/1047482911.db2.gz NYKKORCOSLZHGD-OALUTQOASA-N 2 0 344.568 4.447 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]C[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000556238287 1047604117 /nfs/dbraw/zinc/60/41/17/1047604117.db2.gz IJXZORJHTHZLMA-FXYMYOKYSA-N 2 0 341.326 4.415 20 0 EIADRP C[C@H]([NH2+][C@@H](c1ccncc1)C1CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000898322423 1047616085 /nfs/dbraw/zinc/61/60/85/1047616085.db2.gz KZRGPLZIMLCPAU-MTNREXPMSA-N 2 0 335.495 4.033 20 0 EIADRP C[N@H+](CCCN[C@@H]1CC[NH+](C)[C@H](c2ccccc2)C1)C1CCCCC1 ZINC000550608678 1047757924 /nfs/dbraw/zinc/75/79/24/1047757924.db2.gz LGJMVKAZCANWIW-IRLDBZIGSA-N 2 0 343.559 4.066 20 0 EIADRP Cc1cccc(O[C@H](C)C[NH2+][C@@H]2CCN(C)[C@H](c3ccccc3)C2)c1 ZINC000550666093 1047810599 /nfs/dbraw/zinc/81/05/99/1047810599.db2.gz UQPDQSWAOYQUKT-UZKOGDIHSA-N 2 0 338.495 4.187 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2ccc3nc(-c4ccccc4)oc3c2)CC1 ZINC001168311779 1047821629 /nfs/dbraw/zinc/82/16/29/1047821629.db2.gz ACOWEVYCFHHKSO-UHFFFAOYSA-N 2 0 349.478 4.457 20 0 EIADRP C[NH+]1CCC(CC[NH2+][C@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171060375 1047891015 /nfs/dbraw/zinc/89/10/15/1047891015.db2.gz RNUDNWHNWPCHEK-INIZCTEOSA-N 2 0 341.326 4.172 20 0 EIADRP CC[NH+]1CCC(CC2CC[NH+](Cc3ccc(Cl)cn3)CC2)CC1 ZINC001136932927 1047904713 /nfs/dbraw/zinc/90/47/13/1047904713.db2.gz YHVLTEZNQZCHPL-UHFFFAOYSA-N 2 0 335.923 4.069 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171063617 1047914783 /nfs/dbraw/zinc/91/47/83/1047914783.db2.gz NBOYKXWLAUAYCU-INIZCTEOSA-N 2 0 341.326 4.172 20 0 EIADRP CC1(C)[C@@H]2C[C@@H]([N@H+](Cc3ccc(F)cc3)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170736419 1047922609 /nfs/dbraw/zinc/92/26/09/1047922609.db2.gz MFKIEMXTVLUVBN-DHUDUYKCSA-N 2 0 330.491 4.332 20 0 EIADRP C[N@H+](CC1CC[NH+](C)CC1)[C@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171082941 1048068848 /nfs/dbraw/zinc/06/88/48/1048068848.db2.gz PJFYHSZBFQHLOH-INIZCTEOSA-N 2 0 341.326 4.124 20 0 EIADRP Clc1ccc2c(c1)CC[C@@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)C2 ZINC001171109599 1048218528 /nfs/dbraw/zinc/21/85/28/1048218528.db2.gz KODATQUUEZLYDJ-OAQYLSRUSA-N 2 0 346.946 4.442 20 0 EIADRP CCC(CC)[NH+]1CCC([NH2+][C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171113060 1048249491 /nfs/dbraw/zinc/24/94/91/1048249491.db2.gz ZKCBHWKJZVSIDO-LJQANCHMSA-N 2 0 334.935 4.440 20 0 EIADRP FC1(F)C[C@@]12CCC[NH+](CCCC[N@H+]1CCC[C@@]3(CC3(F)F)C1)C2 ZINC000844437049 1048334549 /nfs/dbraw/zinc/33/45/49/1048334549.db2.gz KUQCXMLMZFCPOB-HZPDHXFCSA-N 2 0 348.428 4.009 20 0 EIADRP FC1(F)C[C@]12CC[NH+](CCCCCC[N@H+]1CC[C@]3(CC3(F)F)C1)C2 ZINC000844470872 1048354185 /nfs/dbraw/zinc/35/41/85/1048354185.db2.gz MCXCVOUUDILSJK-HOTGVXAUSA-N 2 0 348.428 4.009 20 0 EIADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H]2CCc3cc(Cl)c(Cl)cc3C2)C1 ZINC001171139219 1048415547 /nfs/dbraw/zinc/41/55/47/1048415547.db2.gz JWYUFSRSEDCNHS-CZUORRHYSA-N 2 0 341.326 4.172 20 0 EIADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@H]2CCc3cc(Cl)c(Cl)cc3C2)C1 ZINC001171139217 1048416145 /nfs/dbraw/zinc/41/61/45/1048416145.db2.gz JWYUFSRSEDCNHS-BBRMVZONSA-N 2 0 341.326 4.172 20 0 EIADRP [NH3+]CCC1CCC([NH2+][C@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171146260 1048459029 /nfs/dbraw/zinc/45/90/29/1048459029.db2.gz ALOHRMATWQFZRW-MOQPWLNLSA-N 2 0 341.326 4.348 20 0 EIADRP CCCCCC[C@H](CC)[NH2+]CC1CC[NH+](CC2CCOCC2)CC1 ZINC001170589707 1048565006 /nfs/dbraw/zinc/56/50/06/1048565006.db2.gz ZLIAVQZMXXIGEX-NRFANRHFSA-N 2 0 338.580 4.464 20 0 EIADRP Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3ccc([C@H]4CCC[NH2+]4)cc3)c2c1 ZINC001171169623 1048619916 /nfs/dbraw/zinc/61/99/16/1048619916.db2.gz QMKMZAYAFHTIJW-HRAATJIYSA-N 2 0 333.479 4.253 20 0 EIADRP Clc1ncccc1CNC[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000810178713 1048669272 /nfs/dbraw/zinc/66/92/72/1048669272.db2.gz YUTNICHYVKOBRG-GOSISDBHSA-N 2 0 343.902 4.127 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccncc2Cl)CC1 ZINC000075685585 1048755100 /nfs/dbraw/zinc/75/51/00/1048755100.db2.gz IDDQWGUHTLJPNX-UHFFFAOYSA-N 2 0 343.902 4.079 20 0 EIADRP Cc1ccc(C[N@H+]2C[C@@H]3C[NH+](Cc4cccc5cc[nH]c54)C[C@@H]3C2)cc1 ZINC001144712433 1048813400 /nfs/dbraw/zinc/81/34/00/1048813400.db2.gz XLAYIONMLXJDRA-SZPZYZBQSA-N 2 0 345.490 4.040 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Cl)c(N)c(Cl)c1 ZINC000817585491 1049013948 /nfs/dbraw/zinc/01/39/48/1049013948.db2.gz FHCBMNXDXJPBOW-QFWMXSHPSA-N 2 0 330.303 4.099 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1nc(-c2ccccc2)cs1 ZINC000817947345 1049064961 /nfs/dbraw/zinc/06/49/61/1049064961.db2.gz CPALKJPUVWCKIT-HNNXBMFYSA-N 2 0 337.492 4.162 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@@H]2CCc3cccc(Cl)c3C2)C[C@](C)(C[NH3+])C1 ZINC001170901556 1049150675 /nfs/dbraw/zinc/15/06/75/1049150675.db2.gz FCERWBKLJRSPNM-GUXCAODWSA-N 2 0 334.935 4.331 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170909317 1049175764 /nfs/dbraw/zinc/17/57/64/1049175764.db2.gz SVGFFPWVVAYPCK-ADKAHSJRSA-N 2 0 334.935 4.440 20 0 EIADRP Clc1cccc2c1C[C@@H]([NH2+]CC1CC[NH+](C3CCC3)CC1)CC2 ZINC001170910583 1049182175 /nfs/dbraw/zinc/18/21/75/1049182175.db2.gz KZVVZWLXIKZNAA-KRWDZBQOSA-N 2 0 332.919 4.051 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+][C@H]1CCc2c(F)cc(F)cc2C1)c1ccccc1 ZINC001171335785 1049356118 /nfs/dbraw/zinc/35/61/18/1049356118.db2.gz ATQNHPUSZQFFND-RXVVDRJESA-N 2 0 344.449 4.105 20 0 EIADRP CCOc1cc(C)ccc1C[NH2+][C@@H](C)c1cccc(C[NH+](C)C)c1 ZINC000820812257 1049557043 /nfs/dbraw/zinc/55/70/43/1049557043.db2.gz GWXMSJLTNYRCGQ-KRWDZBQOSA-N 2 0 326.484 4.306 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c3cccnc23)[C@H](C)C1 ZINC000081095565 1049623914 /nfs/dbraw/zinc/62/39/14/1049623914.db2.gz LMOVSLVEFVKZSF-KDOFPFPSSA-N 2 0 331.891 4.050 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)[C@@H]2CCc3c(F)cccc3C2)CC1 ZINC001171414184 1049644931 /nfs/dbraw/zinc/64/49/31/1049644931.db2.gz OGBPCZBZGAZSPS-VAMGGRTRSA-N 2 0 344.518 4.445 20 0 EIADRP Fc1cc(F)c2c(c1)CC[C@@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001170701563 1049736634 /nfs/dbraw/zinc/73/66/34/1049736634.db2.gz PQEJIBXULGSKRW-RBUKOAKNSA-N 2 0 348.481 4.163 20 0 EIADRP Clc1cccc(CN2CCCN(c3cc[nH+]cc3)CC2)c1Cl ZINC001171554901 1049753599 /nfs/dbraw/zinc/75/35/99/1049753599.db2.gz SVWILJLPZYQHIH-UHFFFAOYSA-N 2 0 336.266 4.101 20 0 EIADRP Cc1cccc2c1CC[C@@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001171570846 1049757577 /nfs/dbraw/zinc/75/75/77/1049757577.db2.gz PAUANLCZQMZWKG-LEWJYISDSA-N 2 0 326.528 4.193 20 0 EIADRP Cc1cccc2c1CC[C@@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001171570847 1049758538 /nfs/dbraw/zinc/75/85/38/1049758538.db2.gz PAUANLCZQMZWKG-NHCUHLMSSA-N 2 0 326.528 4.193 20 0 EIADRP COc1cccc(CC(C)(C)[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)c1 ZINC001171630318 1049762333 /nfs/dbraw/zinc/76/23/33/1049762333.db2.gz MHXGOFVKDNEGFO-UHFFFAOYSA-N 2 0 332.532 4.257 20 0 EIADRP Cc1c(CC[NH3+])c2ccccc2n1C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171618785 1049766875 /nfs/dbraw/zinc/76/68/75/1049766875.db2.gz CDPLTDYJIWVUMU-UHFFFAOYSA-N 2 0 327.516 4.275 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH+]2CCC([NH3+])(c3ccc(F)cc3)CC2)cc1 ZINC001171666006 1049772877 /nfs/dbraw/zinc/77/28/77/1049772877.db2.gz KRYZFMIUICYYFD-SFHVURJKSA-N 2 0 340.486 4.405 20 0 EIADRP Cc1ccc(CC[C@@H](C)[N@H+](C2CCOCC2)[C@H]2CC[C@H]([NH3+])CC2)cc1 ZINC001171666487 1049773016 /nfs/dbraw/zinc/77/30/16/1049773016.db2.gz YBVCCKNMIKVGNG-HMXCVIKNSA-N 2 0 344.543 4.067 20 0 EIADRP Cc1ccc2c(c1)c1c(n2C2CC(C)(C)[NH+](C)C(C)(C)C2)CC[NH2+]C1 ZINC001171638153 1049779894 /nfs/dbraw/zinc/77/98/94/1049779894.db2.gz UOUIXNJKGVYOIB-UHFFFAOYSA-N 2 0 339.527 4.419 20 0 EIADRP Cc1c(CC[NH3+])c2ccccc2n1[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171727255 1049784635 /nfs/dbraw/zinc/78/46/35/1049784635.db2.gz TXZBBCIPFWARSQ-YLJYHZDGSA-N 2 0 347.506 4.286 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001171958824 1049822759 /nfs/dbraw/zinc/82/27/59/1049822759.db2.gz JAMBPGAAXOWCIP-AWEZNQCLSA-N 2 0 328.422 4.099 20 0 EIADRP C[C@H](NC1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cncs1 ZINC000813881357 1049830668 /nfs/dbraw/zinc/83/06/68/1049830668.db2.gz OXOAUVKFXLQOGL-UXDRXVOSSA-N 2 0 341.524 4.379 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2occc2C)ccc1OC ZINC000813882854 1049830948 /nfs/dbraw/zinc/83/09/48/1049830948.db2.gz MXPHLDBCVVPFCN-MRXNPFEDSA-N 2 0 330.472 4.289 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CCCc2ccccn2)CC[N@@H+]1Cc1ccccc1 ZINC001171971917 1049834881 /nfs/dbraw/zinc/83/48/81/1049834881.db2.gz LEVBAVDLKOXTKC-NRFANRHFSA-N 2 0 337.511 4.047 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1ccc(O)cc1 ZINC001171971534 1049835124 /nfs/dbraw/zinc/83/51/24/1049835124.db2.gz JDRIVNBEWDAMGT-FXAWDEMLSA-N 2 0 338.495 4.486 20 0 EIADRP CCCCOCCC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171973320 1049835599 /nfs/dbraw/zinc/83/55/99/1049835599.db2.gz XOFCXGQHVURNQG-HXUWFJFHSA-N 2 0 332.532 4.226 20 0 EIADRP Cc1cc2c(cn1)[C@@H]([NH2+][C@@H]1CC[N@H+](Cc3ccccc3)C(C)(C)C1)CC2 ZINC001171980591 1049838702 /nfs/dbraw/zinc/83/87/02/1049838702.db2.gz RTFVZJFWPPLRQZ-IRLDBZIGSA-N 2 0 349.522 4.410 20 0 EIADRP CC1(C)C[C@@H]([NH+]2CC[C@H](C(F)(F)F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171987847 1049839760 /nfs/dbraw/zinc/83/97/60/1049839760.db2.gz KOOYREGVYRUNKH-IRXDYDNUSA-N 2 0 340.433 4.314 20 0 EIADRP CCCO[C@@H]1CC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172076488 1049845508 /nfs/dbraw/zinc/84/55/08/1049845508.db2.gz ZOQFPJVFVLRDEC-CLAROIROSA-N 2 0 342.527 4.073 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@@H]1CCc3ccc(Br)cc31)C2 ZINC001172100727 1049849371 /nfs/dbraw/zinc/84/93/71/1049849371.db2.gz SAJLWFITLYEEDK-XLMAVXFVSA-N 2 0 349.316 4.041 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+]CC2CCSCC2)C3)cc1 ZINC001172066915 1049851295 /nfs/dbraw/zinc/85/12/95/1049851295.db2.gz DFUWDAPQFONQJH-MZADTFQBSA-N 2 0 344.568 4.305 20 0 EIADRP FC1(F)C[C@@H]2C[N@@H+]([C@@H]3C[C@H]4CCC[C@@H](C3)[NH+]4Cc3ccccc3)C[C@@H]21 ZINC001172068505 1049852610 /nfs/dbraw/zinc/85/26/10/1049852610.db2.gz JFWVPBFSZWNNEP-OBKDMQGPSA-N 2 0 346.465 4.159 20 0 EIADRP CC1(F)CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172070155 1049853842 /nfs/dbraw/zinc/85/38/42/1049853842.db2.gz XJEQHRUFXQWENX-PMOLBWCYSA-N 2 0 330.491 4.396 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC[C@]3(CCc4c3cccc4F)C1)C2 ZINC001172133609 1049854331 /nfs/dbraw/zinc/85/43/31/1049854331.db2.gz UACFFLSCCOQYKS-FBAVSBLXSA-N 2 0 342.502 4.121 20 0 EIADRP c1ccc2c(c1)C[C@@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CS2 ZINC001172200149 1049869751 /nfs/dbraw/zinc/86/97/51/1049869751.db2.gz IBVXGHQXVJWWPK-GOSISDBHSA-N 2 0 330.541 4.090 20 0 EIADRP CC(C)(C)C[NH+]1CCC([NH2+][C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171024707 1049870260 /nfs/dbraw/zinc/87/02/60/1049870260.db2.gz GTZJALLRKUPIAJ-KRWDZBQOSA-N 2 0 334.935 4.297 20 0 EIADRP CC[C@@H](C)OCC[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172317331 1049876499 /nfs/dbraw/zinc/87/64/99/1049876499.db2.gz BLJRQWGABSLJAU-XRYRHKQGSA-N 2 0 344.543 4.365 20 0 EIADRP CC[C@H](C)OCC[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172317329 1049876757 /nfs/dbraw/zinc/87/67/57/1049876757.db2.gz BLJRQWGABSLJAU-RXRQOCSWSA-N 2 0 344.543 4.365 20 0 EIADRP CC[C@@H](C)OCC[C@@H](C)[NH+]1CCC(CC2CC[NH+](CC)CC2)CC1 ZINC001172347307 1049890377 /nfs/dbraw/zinc/89/03/77/1049890377.db2.gz LZDUTGQYFFCSLE-RTBURBONSA-N 2 0 338.580 4.414 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3ccnc(Cl)c3F)CC2)CC1 ZINC000824023053 1049895857 /nfs/dbraw/zinc/89/58/57/1049895857.db2.gz GZZWEUCRUCRCHS-UHFFFAOYSA-N 2 0 339.886 4.007 20 0 EIADRP CC(C)COCC[C@@H](C)[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001172475935 1049908320 /nfs/dbraw/zinc/90/83/20/1049908320.db2.gz NQPXAQNTCOGMRU-IFMALSPDSA-N 2 0 344.543 4.036 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CCC[NH+]1CCCC1 ZINC001172564561 1049935944 /nfs/dbraw/zinc/93/59/44/1049935944.db2.gz IYNPPGYPQVTRDS-ZDUSSCGKSA-N 2 0 330.850 4.015 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H](C)CCc2c(F)cc(Cl)cc2F)CC1 ZINC001172568443 1049937883 /nfs/dbraw/zinc/93/78/83/1049937883.db2.gz QWINRGYQODGORG-ZDUSSCGKSA-N 2 0 344.877 4.261 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC001172568175 1049938451 /nfs/dbraw/zinc/93/84/51/1049938451.db2.gz OXUPDLNJZHBXJM-OCCSQVGLSA-N 2 0 330.850 4.013 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]C1CCC(CC[NH3+])CC1 ZINC001172574600 1049942009 /nfs/dbraw/zinc/94/20/09/1049942009.db2.gz FAASKTJWMOYTNN-OPFPJEHXSA-N 2 0 344.877 4.437 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001172578990 1049951457 /nfs/dbraw/zinc/95/14/57/1049951457.db2.gz TYZPFXSKYOZBLH-VHDGCEQUSA-N 2 0 344.877 4.402 20 0 EIADRP C(C[NH+]1CCCC1)OCC1CC[NH+](C2CCC3(CCCC3)CC2)CC1 ZINC001172726156 1049967173 /nfs/dbraw/zinc/96/71/73/1049967173.db2.gz CFDLWBYTBJGJJD-UHFFFAOYSA-N 2 0 348.575 4.314 20 0 EIADRP CC(C)[C@@H]1CCC[C@H]([NH2+][C@H]2CCN(Cc3ccccn3)C[C@@H]2C)C1 ZINC000246940932 1050006466 /nfs/dbraw/zinc/00/64/66/1050006466.db2.gz HQWWCOATECSGQT-JTJHWIPRSA-N 2 0 329.532 4.096 20 0 EIADRP COc1ccc(-c2csc(C[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@@H]3C)c2)cc1 ZINC000247090478 1050013669 /nfs/dbraw/zinc/01/36/69/1050013669.db2.gz NYURUBODSGXAKA-AUSJPIAWSA-N 2 0 344.524 4.242 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1N(C)C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248394302 1050052753 /nfs/dbraw/zinc/05/27/53/1050052753.db2.gz FPTWWGJFYBMTKI-IKGGRYGDSA-N 2 0 347.522 4.195 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000249163591 1050093288 /nfs/dbraw/zinc/09/32/88/1050093288.db2.gz ZXQGROWEKLXDSQ-RCCFBDPRSA-N 2 0 340.433 4.219 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000249188530 1050094470 /nfs/dbraw/zinc/09/44/70/1050094470.db2.gz MGBXCGXGFDUUGO-CAOSSQGBSA-N 2 0 332.454 4.350 20 0 EIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cc2ccccc2o1 ZINC000089215209 1050112042 /nfs/dbraw/zinc/11/20/42/1050112042.db2.gz WYRQKURFOQENSY-MRXNPFEDSA-N 2 0 335.451 4.395 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCc1nc(C2CCCCC2)cs1 ZINC000090046551 1050152329 /nfs/dbraw/zinc/15/23/29/1050152329.db2.gz MALQIVZUPVOWJJ-INMHGKMJSA-N 2 0 335.561 4.052 20 0 EIADRP CC[NH+](CC)[C@@H](CNCc1[nH+]c(C(C)C)n2ccccc12)CC(C)C ZINC001177209253 1050161287 /nfs/dbraw/zinc/16/12/87/1050161287.db2.gz KKRWIOLVMRXDEQ-GOSISDBHSA-N 2 0 344.547 4.304 20 0 EIADRP CC[NH+](CC)[C@H](CNC1CC[NH+](C2CCCCC2)CC1)CC(C)C ZINC001177209085 1050161473 /nfs/dbraw/zinc/16/14/73/1050161473.db2.gz HKCSSNUQYNTZEU-NRFANRHFSA-N 2 0 337.596 4.130 20 0 EIADRP CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC001177191133 1050166228 /nfs/dbraw/zinc/16/62/28/1050166228.db2.gz LMWYGZZUIBWSQQ-CTNGQTDRSA-N 2 0 330.516 4.220 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccc(Cl)nc3)cc2)C1 ZINC001177256642 1050175682 /nfs/dbraw/zinc/17/56/82/1050175682.db2.gz KIPRVWUNWUHNCM-MRXNPFEDSA-N 2 0 343.902 4.257 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+][C@@H]1CC2(CCCC2)Oc2ccccc21 ZINC000090461158 1050179235 /nfs/dbraw/zinc/17/92/35/1050179235.db2.gz NYCFYHUGMNNSSP-PSBWJHGTSA-N 2 0 328.500 4.141 20 0 EIADRP COc1cc(C[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc2ccccc21 ZINC001177298399 1050180721 /nfs/dbraw/zinc/18/07/21/1050180721.db2.gz BDYKUTIKMTYHOY-GOSISDBHSA-N 2 0 340.511 4.450 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)[N@@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001172849776 1050188306 /nfs/dbraw/zinc/18/83/06/1050188306.db2.gz PNGUXNBKNGAPCJ-GJZGRUSLSA-N 2 0 326.887 4.251 20 0 EIADRP Cc1coc(C[NH2+]Cc2ccc(C[NH+]3C[C@@H](C)C[C@H](C)C3)cc2)c1 ZINC001177282845 1050188517 /nfs/dbraw/zinc/18/85/17/1050188517.db2.gz OCSPKTWVOLTSER-IRXDYDNUSA-N 2 0 326.484 4.356 20 0 EIADRP C[C@@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1CC[C@@H]([NH+](C)C)CC1 ZINC001172873593 1050211426 /nfs/dbraw/zinc/21/14/26/1050211426.db2.gz NOFHXXCMFZSXDX-CWRNSKLLSA-N 2 0 326.937 4.283 20 0 EIADRP C[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000090963485 1050217627 /nfs/dbraw/zinc/21/76/27/1050217627.db2.gz ZNBNKCSLDIFSJP-HUUCEWRRSA-N 2 0 348.437 4.317 20 0 EIADRP C[C@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cccc2ccccc21 ZINC000090937009 1050218553 /nfs/dbraw/zinc/21/85/53/1050218553.db2.gz DWLNEXKWRAEDOR-KRWDZBQOSA-N 2 0 349.478 4.026 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001172878123 1050220612 /nfs/dbraw/zinc/22/06/12/1050220612.db2.gz INEYFFBTCPOGGA-BMFZPTHFSA-N 2 0 326.937 4.283 20 0 EIADRP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)CC1 ZINC001177528798 1050241299 /nfs/dbraw/zinc/24/12/99/1050241299.db2.gz HSNAFYHONXEQSJ-FGZHOGPDSA-N 2 0 344.543 4.500 20 0 EIADRP CC(C)[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccccc1 ZINC000091287606 1050251446 /nfs/dbraw/zinc/25/14/46/1050251446.db2.gz CUGFTJAYGVNKEN-OAQYLSRUSA-N 2 0 326.484 4.114 20 0 EIADRP C1=CC[C@@H](C[NH+]2CCC([NH2+]C3CCC4(CCOCC4)CC3)CC2)CC1 ZINC001173045675 1050270065 /nfs/dbraw/zinc/27/00/65/1050270065.db2.gz KVRGPQVDHSYNCN-LJQANCHMSA-N 2 0 346.559 4.136 20 0 EIADRP Cc1cc(C[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)sn1 ZINC001177693170 1050283459 /nfs/dbraw/zinc/28/34/59/1050283459.db2.gz LDHAWAFJAAMTCU-UHFFFAOYSA-N 2 0 349.931 4.107 20 0 EIADRP CCCOC1CCC([NH2+]CC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001173091144 1050283954 /nfs/dbraw/zinc/28/39/54/1050283954.db2.gz OPBPYQDOCGFJPA-UHFFFAOYSA-N 2 0 344.543 4.226 20 0 EIADRP CCCOC1CCC([NH2+]C2CC[NH+](C[C@@H]3CC=CCC3)CC2)CC1 ZINC001173095288 1050287322 /nfs/dbraw/zinc/28/73/22/1050287322.db2.gz BIWSQJHIKFVOCL-LWEYNCJUSA-N 2 0 334.548 4.135 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCCOc2ccc(Cl)cc2)CC1 ZINC001173102120 1050301281 /nfs/dbraw/zinc/30/12/81/1050301281.db2.gz SKCFLRJSDPRBLJ-UHFFFAOYSA-N 2 0 338.923 4.352 20 0 EIADRP CCCOC1CCC([N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)CC1 ZINC001173100358 1050302771 /nfs/dbraw/zinc/30/27/71/1050302771.db2.gz ILAYRMMZKLMZLD-HWELCPFYSA-N 2 0 344.543 4.178 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccccc2Br)CC1 ZINC001173101606 1050303142 /nfs/dbraw/zinc/30/31/42/1050303142.db2.gz LDQFQEMWWJZAEA-UHFFFAOYSA-N 2 0 339.321 4.192 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)cc(C)n1 ZINC001177803839 1050304499 /nfs/dbraw/zinc/30/44/99/1050304499.db2.gz IRDYYICUURIGJN-UHFFFAOYSA-N 2 0 337.511 4.364 20 0 EIADRP CCO[C@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)C1 ZINC001177803801 1050304655 /nfs/dbraw/zinc/30/46/55/1050304655.db2.gz HKQKTKXNFPBOJV-YADHBBJMSA-N 2 0 344.543 4.500 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCCCCCCCCCO)CC1 ZINC001173104772 1050305399 /nfs/dbraw/zinc/30/53/99/1050305399.db2.gz VGTKSYMHPPTEGT-UHFFFAOYSA-N 2 0 326.569 4.342 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccc(-c3ncco3)cc2)CC1 ZINC001173110189 1050307391 /nfs/dbraw/zinc/30/73/91/1050307391.db2.gz KZFFXXPNNWMGAM-UHFFFAOYSA-N 2 0 327.472 4.084 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CC2(Cc3ccc(OC)cc3)CC2)CC1 ZINC001173109920 1050307547 /nfs/dbraw/zinc/30/75/47/1050307547.db2.gz KCAZJCOPVMYUQI-UHFFFAOYSA-N 2 0 344.543 4.261 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H]2CCOc3ccc(Cl)cc32)CC1 ZINC001173108553 1050307865 /nfs/dbraw/zinc/30/78/65/1050307865.db2.gz MUSNMFHDRNPSCI-HTWSVDAQSA-N 2 0 336.907 4.406 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC(Oc3ccccc3C)CC2)CC1 ZINC001173108462 1050308394 /nfs/dbraw/zinc/30/83/94/1050308394.db2.gz LLKSURVXSXRPKA-UHFFFAOYSA-N 2 0 344.543 4.491 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CC2(COC)CCC(F)(F)CC2)CC1 ZINC001173106704 1050308405 /nfs/dbraw/zinc/30/84/05/1050308405.db2.gz QIDVHRLPGBZVOV-UHFFFAOYSA-N 2 0 346.506 4.071 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2(c3ccc(F)cc3)CCOCC2)CC1 ZINC001173109800 1050308555 /nfs/dbraw/zinc/30/85/55/1050308555.db2.gz HCEBAUUOPUTNHG-UHFFFAOYSA-N 2 0 348.506 4.074 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC(COc3ccccc3)CC2)CC1 ZINC001173111268 1050309504 /nfs/dbraw/zinc/30/95/04/1050309504.db2.gz AGLGNVKKUZIPPJ-UHFFFAOYSA-N 2 0 344.543 4.430 20 0 EIADRP CC[NH+](CC)C1CCC(n2cc(C[NH2+]C)c3cc(C)ccc32)CC1 ZINC001173113517 1050309630 /nfs/dbraw/zinc/30/96/30/1050309630.db2.gz RVRPHSGCMUTBAI-UHFFFAOYSA-N 2 0 327.516 4.495 20 0 EIADRP CC[NH+](CC)C1CCC(n2c3ccc(C)cc3c3c2CC[NH2+]C3)CC1 ZINC001173111481 1050310329 /nfs/dbraw/zinc/31/03/29/1050310329.db2.gz FYKVLDYRVWSBJX-UHFFFAOYSA-N 2 0 339.527 4.421 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@H](C)CC2CCCCC2)[C@H](C)C1 ZINC001177843947 1050312914 /nfs/dbraw/zinc/31/29/14/1050312914.db2.gz ICRPCABPNQPXQC-SBHAEUEKSA-N 2 0 338.580 4.320 20 0 EIADRP COC1CC[NH+](C2CC[NH+](C3CCC4(CCCCC4)CC3)CC2)CC1 ZINC001173122139 1050318148 /nfs/dbraw/zinc/31/81/48/1050318148.db2.gz ZVXQXBVFOLCYNQ-UHFFFAOYSA-N 2 0 348.575 4.455 20 0 EIADRP CCCC[C@@H](CC(C)C)[NH2+]CC1CC[NH+](Cc2cccnc2)CC1 ZINC001173258049 1050380733 /nfs/dbraw/zinc/38/07/33/1050380733.db2.gz YWTKGFNMEBXHBA-NRFANRHFSA-N 2 0 331.548 4.488 20 0 EIADRP CCCC[C@H](CC(C)C)[NH2+]CC1CC[NH+](Cc2ccccn2)CC1 ZINC001173258047 1050381171 /nfs/dbraw/zinc/38/11/71/1050381171.db2.gz YVUQREHYBMPWRD-HXUWFJFHSA-N 2 0 331.548 4.488 20 0 EIADRP C[C@H]1C[C@H](CC[NH2+]Cc2cccc(F)c2F)C[N@@H+]1Cc1ccccc1 ZINC001178208291 1050406175 /nfs/dbraw/zinc/40/61/75/1050406175.db2.gz KYQLEIDDVKHLAH-WMZOPIPTSA-N 2 0 344.449 4.355 20 0 EIADRP CCOc1ccccc1C[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC001178280475 1050426058 /nfs/dbraw/zinc/42/60/58/1050426058.db2.gz FIXUZXULLUWPFN-UHFFFAOYSA-N 2 0 330.516 4.218 20 0 EIADRP c1ccc(C[N@H+]2CC[C@@H](C[NH2+][C@H]3CCSc4ccccc43)C2)cc1 ZINC000253355640 1050453916 /nfs/dbraw/zinc/45/39/16/1050453916.db2.gz UIUPMCIFKFYCKM-ICSRJNTNSA-N 2 0 338.520 4.335 20 0 EIADRP COc1cccc2c(C[NH2+]CC3(C[NH+](C)C)CCCC3)cccc12 ZINC001178449953 1050462075 /nfs/dbraw/zinc/46/20/75/1050462075.db2.gz ZYUKPJQEOOMZBT-UHFFFAOYSA-N 2 0 326.484 4.060 20 0 EIADRP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@H]1CCC[N@H+](C)CC1 ZINC001173541804 1050475891 /nfs/dbraw/zinc/47/58/91/1050475891.db2.gz DAOQWMZFJIOVAQ-ZFWWWQNUSA-N 2 0 329.315 4.388 20 0 EIADRP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1CCC([NH+](C)C)CC1 ZINC001173546613 1050478839 /nfs/dbraw/zinc/47/88/39/1050478839.db2.gz KTGJTYUHFSDKPM-ZDUSSCGKSA-N 2 0 329.315 4.341 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1CCC([NH+](C)C)CC1 ZINC001173546610 1050479414 /nfs/dbraw/zinc/47/94/14/1050479414.db2.gz KTGJTYUHFSDKPM-CYBMUJFWSA-N 2 0 329.315 4.341 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001173548494 1050486218 /nfs/dbraw/zinc/48/62/18/1050486218.db2.gz CGMKKNLJRZBNCQ-RDTXWAMCSA-N 2 0 341.326 4.342 20 0 EIADRP CCC[NH+]1CCC([NH2+]C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173685773 1050537539 /nfs/dbraw/zinc/53/75/39/1050537539.db2.gz DKWRBKIYGPAUJN-UHFFFAOYSA-N 2 0 326.528 4.277 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccccn2)ccc1OC ZINC000182194263 1050538201 /nfs/dbraw/zinc/53/82/01/1050538201.db2.gz DSVNDUSNPXTJJO-IAGOWNOFSA-N 2 0 341.499 4.344 20 0 EIADRP [NH3+]C1(CC2CC2)CC[NH+](C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173685173 1050538405 /nfs/dbraw/zinc/53/84/05/1050538405.db2.gz LIAILWBLTKEMCA-UHFFFAOYSA-N 2 0 338.539 4.407 20 0 EIADRP C[NH+](C)[C@H]1CC[C@H]([NH2+]C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173685064 1050538852 /nfs/dbraw/zinc/53/88/52/1050538852.db2.gz GULQJLPJBSHHPQ-JUWDIMJDSA-N 2 0 326.528 4.276 20 0 EIADRP C[NH+](C)CC1CC[NH+](C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173689272 1050542824 /nfs/dbraw/zinc/54/28/24/1050542824.db2.gz IPHBCGKIAPTFLK-UHFFFAOYSA-N 2 0 326.528 4.087 20 0 EIADRP CC(C)[C@H](C[NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1ccccc1 ZINC001179015937 1050613967 /nfs/dbraw/zinc/61/39/67/1050613967.db2.gz RKSWAKXMCWGYHH-VJBWXMMDSA-N 2 0 336.523 4.361 20 0 EIADRP CC[C@H]1C[C@H](C[NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC001179277889 1050669504 /nfs/dbraw/zinc/66/95/04/1050669504.db2.gz OZQRCNBBARYZPF-YADHBBJMSA-N 2 0 344.543 4.084 20 0 EIADRP CC(C)[C@H](C[NH2+][C@H](CC[NH+](C)C)c1cccnc1)c1ccccc1 ZINC001179636700 1050744780 /nfs/dbraw/zinc/74/47/80/1050744780.db2.gz KLKVFUZTLXWNQM-LEWJYISDSA-N 2 0 325.500 4.104 20 0 EIADRP COc1ccc(CN2CC[C@H](C[NH+]3CCCCC3)C2)cc1C(C)(C)C ZINC001179877579 1050813700 /nfs/dbraw/zinc/81/37/00/1050813700.db2.gz HQRCMDVOPLUTFI-LJQANCHMSA-N 2 0 344.543 4.301 20 0 EIADRP c1ccc(C[NH+]2CCC[C@@H]3C[N@H+](CC4CCSCC4)CC[C@@H]32)cc1 ZINC001179918364 1050834775 /nfs/dbraw/zinc/83/47/75/1050834775.db2.gz BOCCNQXXYRCCIC-RTWAWAEBSA-N 2 0 344.568 4.116 20 0 EIADRP CCOc1ccc(C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)o1 ZINC001180053531 1050868252 /nfs/dbraw/zinc/86/82/52/1050868252.db2.gz ZFBLHLYYGWCEIQ-UHFFFAOYSA-N 2 0 342.483 4.022 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CC2Cc3ccccc3C2)CC1 ZINC001180052354 1050868634 /nfs/dbraw/zinc/86/86/34/1050868634.db2.gz PYIHYCUZVJWVBU-UHFFFAOYSA-N 2 0 348.534 4.245 20 0 EIADRP CCCc1nccn1CCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC001188987723 1050878145 /nfs/dbraw/zinc/87/81/45/1050878145.db2.gz BYTHSAFRCVSDRK-UHFFFAOYSA-N 2 0 325.500 4.180 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc3c(n2)CCC3)CC1 ZINC001180225306 1050921726 /nfs/dbraw/zinc/92/17/26/1050921726.db2.gz QDSYIINWSJOSGH-SFHVURJKSA-N 2 0 341.543 4.047 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000152994955 1050923269 /nfs/dbraw/zinc/92/32/69/1050923269.db2.gz HWNZODOSUZOXCJ-QKPAOTATSA-N 2 0 340.433 4.414 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(SC)o2)CC1)CC1CC1 ZINC001180322596 1050967512 /nfs/dbraw/zinc/96/75/12/1050967512.db2.gz KFKQAVZIZGJVSK-UHFFFAOYSA-N 2 0 336.545 4.336 20 0 EIADRP Clc1ccc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)c2ncccc12 ZINC000150977832 1050975881 /nfs/dbraw/zinc/97/58/81/1050975881.db2.gz ZNFOPMWEKSBWKL-UHFFFAOYSA-N 2 0 343.902 4.385 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C2CCSCC2)ccc1OC ZINC000183200620 1051012739 /nfs/dbraw/zinc/01/27/39/1051012739.db2.gz ZGGZKLCEDXTNJD-HNNXBMFYSA-N 2 0 336.545 4.083 20 0 EIADRP C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)C1 ZINC001180793780 1051077598 /nfs/dbraw/zinc/07/75/98/1051077598.db2.gz LSICUFGLZVUXTF-KRWDZBQOSA-N 2 0 328.887 4.391 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000153535395 1051190957 /nfs/dbraw/zinc/19/09/57/1051190957.db2.gz SJKMZIWNLFBRTP-CABCVRRESA-N 2 0 348.437 4.317 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@H]2CCO[C@H](C)C2)ccc1OC ZINC000775398528 1051229161 /nfs/dbraw/zinc/22/91/61/1051229161.db2.gz AKWVPSSFMLKQPC-SQNIBIBYSA-N 2 0 348.531 4.003 20 0 EIADRP CC[C@H](C)[C@@H](C[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)OC ZINC001181458726 1051231673 /nfs/dbraw/zinc/23/16/73/1051231673.db2.gz ZEBCWCWZTVDILK-GHTZIAJQSA-N 2 0 332.532 4.069 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H]2CC=CCC2)cc1C[NH+]1CCCCC1 ZINC000775412106 1051274254 /nfs/dbraw/zinc/27/42/54/1051274254.db2.gz RXHHUVYEUOGOEK-FXAWDEMLSA-N 2 0 328.500 4.440 20 0 EIADRP COc1ccccc1CCC[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001190826522 1051285109 /nfs/dbraw/zinc/28/51/09/1051285109.db2.gz HRIVAMYJLKUNSL-HXUWFJFHSA-N 2 0 344.543 4.216 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc[nH]2)ccc1OC ZINC000775425328 1051317705 /nfs/dbraw/zinc/31/77/05/1051317705.db2.gz XTDBTCFPNWNQAY-CVEARBPZSA-N 2 0 329.488 4.277 20 0 EIADRP CC(C)(C)c1cccc(OCCC[N@@H+]2CC[C@H](C[NH+]3CCCC3)C2)c1 ZINC001191122418 1051359176 /nfs/dbraw/zinc/35/91/76/1051359176.db2.gz QMHJYWSMSPJNQC-LJQANCHMSA-N 2 0 344.543 4.171 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@H]3CCCCC3(F)F)CC2)C1 ZINC001182054102 1051385256 /nfs/dbraw/zinc/38/52/56/1051385256.db2.gz SDNQLPCNFSABMC-NUJGCVRESA-N 2 0 328.491 4.445 20 0 EIADRP CS[C@H]1CC[N@H+](C[C@@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)C1 ZINC001182063339 1051388657 /nfs/dbraw/zinc/38/86/57/1051388657.db2.gz TXTZABLRTDWYBG-FPOVZHCZSA-N 2 0 346.584 4.362 20 0 EIADRP C/C=C\COc1ccc(CC[C@H](C)[NH2+]CC[C@@H]2CCC[N@H+](C)C2)cc1 ZINC001182248547 1051441297 /nfs/dbraw/zinc/44/12/97/1051441297.db2.gz ACTTZACVUAOEKS-GVZHBMFQSA-N 2 0 344.543 4.284 20 0 EIADRP C[C@@H]1C[C@H](C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)C[C@H](C)O1 ZINC001191549590 1051485500 /nfs/dbraw/zinc/48/55/00/1051485500.db2.gz FANKXXQEBVUQQN-CTAFRAEOSA-N 2 0 336.564 4.167 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](C[C@@H]2CCCC(C)(C)O2)CC1 ZINC001191549314 1051486880 /nfs/dbraw/zinc/48/68/80/1051486880.db2.gz AVAYVDYVVYEWAD-ICSRJNTNSA-N 2 0 336.564 4.311 20 0 EIADRP [NH3+]CCC1CC[NH+](Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC001206500874 1051510090 /nfs/dbraw/zinc/51/00/90/1051510090.db2.gz SHQHTVPUXISKQK-UHFFFAOYSA-N 2 0 335.904 4.024 20 0 EIADRP CCc1ccc(C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)s1 ZINC000156279806 1051514207 /nfs/dbraw/zinc/51/42/07/1051514207.db2.gz DVOFYKLKTOGIOR-HNNXBMFYSA-N 2 0 332.513 4.102 20 0 EIADRP C[N@@H+]1CCc2ccc(Nc3ccc(C[NH+]4CCCCC4)cc3)cc2C1 ZINC001175365355 1051555263 /nfs/dbraw/zinc/55/52/63/1051555263.db2.gz IXFDUZHXDKRZCG-UHFFFAOYSA-N 2 0 335.495 4.404 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CCOCc2ccccc2)cc1 ZINC000156949893 1051583931 /nfs/dbraw/zinc/58/39/31/1051583931.db2.gz JPZRGPCUNDWKHJ-QGZVFWFLSA-N 2 0 335.451 4.048 20 0 EIADRP CC(C)C[N@@H+](Cc1cccc(OC(F)F)c1)CC1CC[NH+](C)CC1 ZINC001175601874 1051667690 /nfs/dbraw/zinc/66/76/90/1051667690.db2.gz WBWMEARNHKRDCX-UHFFFAOYSA-N 2 0 340.458 4.088 20 0 EIADRP CC(C)Sc1ccc(Nc2c[nH+]ccc2N2CC[NH+](C)CC2)cc1 ZINC001175624260 1051679887 /nfs/dbraw/zinc/67/98/87/1051679887.db2.gz WHQMPXCYFAWZRD-UHFFFAOYSA-N 2 0 342.512 4.078 20 0 EIADRP C[C@@H]1SCC[C@H]1[NH2+]C[C@]1(C(C)(C)C)CC[N@H+](Cc2ccccc2)C1 ZINC001182726494 1051688081 /nfs/dbraw/zinc/68/80/81/1051688081.db2.gz UBWVZDNFWOZPGK-FBBABVLZSA-N 2 0 346.584 4.408 20 0 EIADRP C[C@]1(C[NH3+])CCCC[N@H+](CCCc2ccc(Cl)c(Cl)c2)C1 ZINC001206541194 1051706875 /nfs/dbraw/zinc/70/68/75/1051706875.db2.gz FUAYOHCHQWJMIK-QGZVFWFLSA-N 2 0 329.315 4.377 20 0 EIADRP C[C@]1(C[NH3+])CCCC[N@H+](CCCc2ccc(C(F)(F)F)cc2)C1 ZINC001206541394 1051710500 /nfs/dbraw/zinc/71/05/00/1051710500.db2.gz HAVZFMFMTAXHHW-QGZVFWFLSA-N 2 0 328.422 4.089 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]C[C@H]3CCC[N@H+](C)C3)cs2)cs1 ZINC000158173021 1051722827 /nfs/dbraw/zinc/72/28/27/1051722827.db2.gz QRAPHEGZORWBNI-GXTWGEPZSA-N 2 0 335.542 4.172 20 0 EIADRP Fc1cccc2c1CC[C@H]2[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC001192402039 1051723233 /nfs/dbraw/zinc/72/32/33/1051723233.db2.gz RKDBYOSCGUANFP-OAQYLSRUSA-N 2 0 330.491 4.401 20 0 EIADRP Cc1ccc(C[C@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC001183281082 1051812081 /nfs/dbraw/zinc/81/20/81/1051812081.db2.gz LQUNGGYLYYEMQN-QTEQDKRBSA-N 2 0 336.523 4.284 20 0 EIADRP CC[NH+](CC)CCC[NH2+][C@@H](COc1c(C)cccc1C)C(C)(C)C ZINC001192849300 1051823458 /nfs/dbraw/zinc/82/34/58/1051823458.db2.gz RZKOPKONMBCNEA-IBGZPJMESA-N 2 0 334.548 4.418 20 0 EIADRP CC(C)CCC[C@H](C)[NH2+]CCC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC001183533351 1051864232 /nfs/dbraw/zinc/86/42/32/1051864232.db2.gz KBHBJNWXTCZOJP-FQEVSTJZSA-N 2 0 346.559 4.208 20 0 EIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]C[C@@H]1CCCC(C)(C)O1 ZINC001193092251 1051873788 /nfs/dbraw/zinc/87/37/88/1051873788.db2.gz CHHHBLITYURQBB-GGPKGHCWSA-N 2 0 344.543 4.080 20 0 EIADRP C[C@@H]1CCCC[C@@H]1C[N@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176263195 1051987093 /nfs/dbraw/zinc/98/70/93/1051987093.db2.gz QYJJLQWTRJERCO-NMIHRBCNSA-N 2 0 326.528 4.267 20 0 EIADRP Cc1ccc(N2CCC([NH2+][C@@H](C)c3cc4c(s3)CCC4)CC2)nc1 ZINC000163495859 1051992054 /nfs/dbraw/zinc/99/20/54/1051992054.db2.gz NKRLTRWBEVYATR-HNNXBMFYSA-N 2 0 341.524 4.260 20 0 EIADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@@H](CCc3ccccc3)Cc3ccccc3)[C@@H]2C1 ZINC001184389487 1052001691 /nfs/dbraw/zinc/00/16/91/1052001691.db2.gz XKFWUXZHWNYIKD-XQUALCHDSA-N 2 0 348.534 4.160 20 0 EIADRP Cc1ccc(C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)c(C)c1 ZINC000164484724 1052031125 /nfs/dbraw/zinc/03/11/25/1052031125.db2.gz MXEYLOPSFDUDIN-SFHVURJKSA-N 2 0 326.484 4.095 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCCc2ccccc2)CC1 ZINC000060377507 1052079989 /nfs/dbraw/zinc/07/99/89/1052079989.db2.gz VWBKLEVELNXIOC-UHFFFAOYSA-N 2 0 336.523 4.463 20 0 EIADRP C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000298151759 1052108836 /nfs/dbraw/zinc/10/88/36/1052108836.db2.gz RREYFBVZMAYISE-CQSZACIVSA-N 2 0 349.400 4.420 20 0 EIADRP CC(C)O[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)C1(C)C ZINC001194458347 1052148351 /nfs/dbraw/zinc/14/83/51/1052148351.db2.gz RIRSWRTXQVVTGO-NHCUHLMSSA-N 2 0 344.543 4.354 20 0 EIADRP C[C@@]1(C[NH3+])CCC[N@H+](CCCc2ccc(Cl)c(Cl)c2)CC1 ZINC001206295269 1052233641 /nfs/dbraw/zinc/23/36/41/1052233641.db2.gz LURHAFVXERVNIE-QGZVFWFLSA-N 2 0 329.315 4.377 20 0 EIADRP Cc1ccc2cc(C[NH2+]C[C@@H]3CC[N@H+](Cc4ccccc4)C3)ccc2n1 ZINC000336810983 1052520911 /nfs/dbraw/zinc/52/09/11/1052520911.db2.gz KLCUPSCENCKCKM-NRFANRHFSA-N 2 0 345.490 4.155 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)C1 ZINC000339069036 1052552119 /nfs/dbraw/zinc/55/21/19/1052552119.db2.gz QMTQCNBNPDQVNN-KCZVDYSFSA-N 2 0 344.543 4.256 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+]CCC2CC[NH+](C)CC2)cc1 ZINC000174351970 1052565210 /nfs/dbraw/zinc/56/52/10/1052565210.db2.gz PCQDBUBZNBPLLO-UHFFFAOYSA-N 2 0 338.495 4.184 20 0 EIADRP CC(C)Oc1ccc(CC[C@H](C)[NH2+][C@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623363355 1052635713 /nfs/dbraw/zinc/63/57/13/1052635713.db2.gz PTOYWPKJNXCLKN-HKUYNNGSSA-N 2 0 332.532 4.257 20 0 EIADRP COc1cc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)ccc1Cl ZINC000623379857 1052641605 /nfs/dbraw/zinc/64/16/05/1052641605.db2.gz LGEOROSBSNNXSR-UHFFFAOYSA-N 2 0 346.902 4.479 20 0 EIADRP Cc1sc(CC[NH2+][C@H]2CC[N@@H+](C)C(C)(C)C2)nc1-c1ccccc1 ZINC000623446405 1052657852 /nfs/dbraw/zinc/65/78/52/1052657852.db2.gz BGGPEXPZSRPRSD-KRWDZBQOSA-N 2 0 343.540 4.123 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(Oc2cccnc2)cc1 ZINC000623526035 1052672870 /nfs/dbraw/zinc/67/28/70/1052672870.db2.gz HTSDRMDCLTWKJB-WMZOPIPTSA-N 2 0 339.483 4.397 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ncc(Br)s1 ZINC000179188264 1052726033 /nfs/dbraw/zinc/72/60/33/1052726033.db2.gz ZFPKRJWWROMTIG-NEPJUHHUSA-N 2 0 348.354 4.067 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ncc(Br)s1 ZINC000179188287 1052726165 /nfs/dbraw/zinc/72/61/65/1052726165.db2.gz ZFPKRJWWROMTIG-NWDGAFQWSA-N 2 0 348.354 4.067 20 0 EIADRP FC1(F)CCCC[C@@H]1C[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12 ZINC000381796052 1053096409 /nfs/dbraw/zinc/09/64/09/1053096409.db2.gz BNLINQCEQLABKV-UAFMIMERSA-N 2 0 348.481 4.312 20 0 EIADRP Cc1cc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(C)s1 ZINC000381862491 1053105730 /nfs/dbraw/zinc/10/57/30/1053105730.db2.gz JAUMRKJKSPTQCJ-VQIMIIECSA-N 2 0 328.525 4.365 20 0 EIADRP C[C@@H]([NH2+]Cc1cc(Cl)cs1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000382062858 1053136062 /nfs/dbraw/zinc/13/60/62/1053136062.db2.gz PYXCHVBJSWHZOZ-ZBFHGGJFSA-N 2 0 334.916 4.402 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc3c(c2)CCCO3)c1 ZINC000850432239 1053207938 /nfs/dbraw/zinc/20/79/38/1053207938.db2.gz VGLIMPMFCIXDMP-QGZVFWFLSA-N 2 0 338.495 4.314 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]C[C@]2(C)CC2(F)F)ccc1OC ZINC000850536861 1053301699 /nfs/dbraw/zinc/30/16/99/1053301699.db2.gz OIFQRZBCIHYKGG-KDOFPFPSSA-N 2 0 340.458 4.233 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000383365058 1053329539 /nfs/dbraw/zinc/32/95/39/1053329539.db2.gz UXUUVOAWPQDXLT-WIYYLYMNSA-N 2 0 326.459 4.389 20 0 EIADRP C[C@@H](NC1CC[NH+](C2CCC2)CC1)c1cc2c(ccnc2Cl)o1 ZINC000866248624 1053664099 /nfs/dbraw/zinc/66/40/99/1053664099.db2.gz FPCYQRHBPFCQTN-GFCCVEGCSA-N 2 0 333.863 4.149 20 0 EIADRP C[C@@H](CCc1cncc2ccccc21)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000866349632 1053700525 /nfs/dbraw/zinc/70/05/25/1053700525.db2.gz LFMASZIULVYMML-KRWDZBQOSA-N 2 0 337.511 4.020 20 0 EIADRP C[C@H](CCc1cncc2ccccc21)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000866378511 1053710696 /nfs/dbraw/zinc/71/06/96/1053710696.db2.gz SRJBRZZFFNSOKD-PBPGXSGUSA-N 2 0 325.500 4.018 20 0 EIADRP Cc1c([C@@H](C)[NH2+]CCC2CC[NH+](C(C)C)CC2)cnn1C(C)(C)C ZINC000866468654 1053741001 /nfs/dbraw/zinc/74/10/01/1053741001.db2.gz HIWNWUBYKLSEFK-MRXNPFEDSA-N 2 0 334.552 4.108 20 0 EIADRP CCOc1cccc(Cl)c1C[NH+]1CCC2(CC[NH+](C)CC2)CC1 ZINC001196788947 1053754565 /nfs/dbraw/zinc/75/45/65/1053754565.db2.gz FVECQZKRCZUXAL-UHFFFAOYSA-N 2 0 336.907 4.047 20 0 EIADRP CC[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1cccc(OC)c1OC ZINC000866517812 1053765728 /nfs/dbraw/zinc/76/57/28/1053765728.db2.gz NULVHWBNVQMRPJ-RYZJOYRSSA-N 2 0 334.504 4.007 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)cc1 ZINC000866517078 1053765776 /nfs/dbraw/zinc/76/57/76/1053765776.db2.gz WAROPZHTIJWHND-YLZJTPGZSA-N 2 0 340.515 4.094 20 0 EIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+]C[C@H]2CCCC2(C)C)CC1 ZINC001202528789 1054031166 /nfs/dbraw/zinc/03/11/66/1054031166.db2.gz RJGXETCIIGVZMN-MRXNPFEDSA-N 2 0 349.950 4.008 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CC[C@@H]3CC3(Cl)Cl)CC2)C1 ZINC000857065403 1054170057 /nfs/dbraw/zinc/17/00/57/1054170057.db2.gz NUACRKIZOJEBRT-IIAWOOMASA-N 2 0 333.347 4.203 20 0 EIADRP CCC[N@H+](C[C@H](OC)C1CCC1)C1CCN(Cc2ccccc2)CC1 ZINC001198641156 1054215154 /nfs/dbraw/zinc/21/51/54/1054215154.db2.gz NFVHSENJYDYGAV-QFIPXVFZSA-N 2 0 344.543 4.178 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H]2CC(C)(C)Sc3ccccc32)CC1 ZINC000872030333 1054347030 /nfs/dbraw/zinc/34/70/30/1054347030.db2.gz DAJMBWUMJPBVKW-SFHVURJKSA-N 2 0 348.556 4.093 20 0 EIADRP CC[C@H](CCC(F)(F)F)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000872066302 1054374411 /nfs/dbraw/zinc/37/44/11/1054374411.db2.gz GWMCKXHFCUYFPH-IAGOWNOFSA-N 2 0 328.422 4.219 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCOC(C)(C)C1 ZINC001199267681 1054379401 /nfs/dbraw/zinc/37/94/01/1054379401.db2.gz QJGWWHLOXFOBHG-YLJYHZDGSA-N 2 0 330.516 4.108 20 0 EIADRP Clc1ccc2c(n1)[C@@H]([NH2+]C1CCC([NH+]3CCCCC3)CC1)CC2 ZINC000857906651 1054382441 /nfs/dbraw/zinc/38/24/41/1054382441.db2.gz FQASJMRRXTYBDA-JCYILVPMSA-N 2 0 333.907 4.109 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(COc3ccccc3)cc2)CC1(C)C ZINC001199309423 1054386676 /nfs/dbraw/zinc/38/66/76/1054386676.db2.gz IJLOAXQYGIJPOP-FQEVSTJZSA-N 2 0 338.495 4.228 20 0 EIADRP C[C@@H](C[NH2+]C[C@H](C)C[NH+]1CCCC1)Cc1ccc(C(C)(C)C)cc1 ZINC001199403017 1054406713 /nfs/dbraw/zinc/40/67/13/1054406713.db2.gz CPARZYLOOUFSPJ-MOPGFXCFSA-N 2 0 330.560 4.484 20 0 EIADRP C[C@@]1(CN[C@H]2CCCc3scnc32)CC[N@H+](Cc2ccccc2)C1 ZINC000858414665 1054485192 /nfs/dbraw/zinc/48/51/92/1054485192.db2.gz FWWSCRMYXDMFKV-PXNSSMCTSA-N 2 0 341.524 4.022 20 0 EIADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H](c2ccccc2Cl)c2cc(F)ccc2F)C1 ZINC000873249670 1054514502 /nfs/dbraw/zinc/51/45/02/1054514502.db2.gz BXABBKLAKAQCFZ-SUFBMKPHSA-N 2 0 336.813 4.035 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873271775 1054520686 /nfs/dbraw/zinc/52/06/86/1054520686.db2.gz LARJONVFBVMMNO-STQMWFEESA-N 2 0 347.503 4.296 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1cccc(C)c1C ZINC000061069870 1054741006 /nfs/dbraw/zinc/74/10/06/1054741006.db2.gz ZJFMBIRMNWNHPI-UHFFFAOYSA-N 2 0 340.511 4.314 20 0 EIADRP COc1cccc(C[NH+]2CCC3(CC2)CC[NH+](CC(C)C)CC3)c1 ZINC001201470834 1054825416 /nfs/dbraw/zinc/82/54/16/1054825416.db2.gz MPKNQPVWMAECJK-UHFFFAOYSA-N 2 0 330.516 4.029 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(F)c3ccccc23)C1 ZINC001201566523 1054850375 /nfs/dbraw/zinc/85/03/75/1054850375.db2.gz JHYRYDIQIJKFEY-KRWDZBQOSA-N 2 0 328.475 4.437 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@H]3C[NH+](Cc4ccccc4)CC[C@H]3C2)cc1 ZINC001201609244 1054863335 /nfs/dbraw/zinc/86/33/35/1054863335.db2.gz FEKULCPALOKNJL-GOTSBHOMSA-N 2 0 334.507 4.073 20 0 EIADRP CSCCC[N@@H+]1C[C@@H]2CCC[C@@H]([NH+](C)Cc3cccs3)[C@H]2C1 ZINC001201680824 1054875030 /nfs/dbraw/zinc/87/50/30/1054875030.db2.gz ODLXIDZCYDFOOY-RYQLBKOJSA-N 2 0 338.586 4.034 20 0 EIADRP CCCCC[NH+]1CCC2(CC[N@H+](Cc3cccc(OC)c3)C2)CC1 ZINC001201730732 1054887048 /nfs/dbraw/zinc/88/70/48/1054887048.db2.gz LENXSEYCBCICIO-UHFFFAOYSA-N 2 0 330.516 4.173 20 0 EIADRP C[C@@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccncc1 ZINC000671750050 1054962003 /nfs/dbraw/zinc/96/20/03/1054962003.db2.gz OENDJDXHKZOCNO-XTWGIRIWSA-N 2 0 337.511 4.218 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cccc(Cl)c2N)c1 ZINC000876942687 1054986061 /nfs/dbraw/zinc/98/60/61/1054986061.db2.gz BOBNNDZBFOHUPZ-UHFFFAOYSA-N 2 0 331.891 4.054 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2cc3nc(Cl)ccc3s2)c1 ZINC000877144770 1055025938 /nfs/dbraw/zinc/02/59/38/1055025938.db2.gz VOZIEQOUDBKSKX-UHFFFAOYSA-N 2 0 345.899 4.301 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc3ncccc3c2)c1 ZINC000067450066 1055037434 /nfs/dbraw/zinc/03/74/34/1055037434.db2.gz JBNMLTDYPGCSMR-UHFFFAOYSA-N 2 0 333.479 4.365 20 0 EIADRP Cc1c(C[NH2+]Cc2ccccc2C[N@H+]2CCCC[C@H]2C)ccnc1F ZINC000862271370 1055042150 /nfs/dbraw/zinc/04/21/50/1055042150.db2.gz MKXYCSHATAEJIV-MRXNPFEDSA-N 2 0 341.474 4.193 20 0 EIADRP CCO[P@](C)(=O)CC[C@H](C)[NH2+]C[C@@H]1CCC[N@@H+]1C1CCCCC1 ZINC000877495655 1055065551 /nfs/dbraw/zinc/06/55/51/1055065551.db2.gz GQOIFDCLTZLKMR-CEXJFXJFSA-N 2 0 344.480 4.096 20 0 EIADRP c1ccc([C@@H]2C[C@H]([NH2+]CC[C@@H]3CCSC3)CCN2C2CC2)cc1 ZINC000877661546 1055100909 /nfs/dbraw/zinc/10/09/09/1055100909.db2.gz DTLXRJAVMCMWGO-POAQFYNOSA-N 2 0 330.541 4.087 20 0 EIADRP C[N@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+](CCCC(F)(F)F)CC2 ZINC001202395587 1055171117 /nfs/dbraw/zinc/17/11/17/1055171117.db2.gz NQIVOYYEHSQCMP-MRXNPFEDSA-N 2 0 344.421 4.299 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]C[C@H]2CCCC[N@H+](C)C2)sc1Br ZINC000623657312 1055531920 /nfs/dbraw/zinc/53/19/20/1055531920.db2.gz NKFOECRTFJJQEL-CHWSQXEVSA-N 2 0 345.350 4.202 20 0 EIADRP Cc1cc([C@H](C)[NH2+]C[C@@H]2CCCC[N@H+](C)C2)sc1Br ZINC000623657315 1055532375 /nfs/dbraw/zinc/53/23/75/1055532375.db2.gz NKFOECRTFJJQEL-STQMWFEESA-N 2 0 345.350 4.202 20 0 EIADRP C[C@H](Cc1ccccn1)[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000655834520 1055702220 /nfs/dbraw/zinc/70/22/20/1055702220.db2.gz PHQMRUPKEOVFJT-YJSIEXFISA-N 2 0 349.522 4.045 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H]2CCc3ccccc3OC2)CC1 ZINC000511007817 1056391065 /nfs/dbraw/zinc/39/10/65/1056391065.db2.gz CMXYHWUMGOULEM-JRGCBEDISA-N 2 0 342.527 4.013 20 0 EIADRP C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)C1CCC(C(F)(F)F)CC1 ZINC000475575212 1056497453 /nfs/dbraw/zinc/49/74/53/1056497453.db2.gz QMUVYPGREILRCJ-CWJHNBGESA-N 2 0 332.454 4.350 20 0 EIADRP [NH3+]CC1CC[NH+](Cc2ccc(NCCC3=CCCCC3)cc2)CC1 ZINC001168775354 1059823110 /nfs/dbraw/zinc/82/31/10/1059823110.db2.gz OGEIFXGNXBYMFW-UHFFFAOYSA-N 2 0 327.516 4.160 20 0 EIADRP CC[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc2c(c1)CCO2 ZINC000766409156 1060332722 /nfs/dbraw/zinc/33/27/22/1060332722.db2.gz MJLJDAHAKGFTMA-NRFANRHFSA-N 2 0 342.527 4.459 20 0 EIADRP CCc1nc(C)c([C@@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)s1 ZINC000766511313 1060427940 /nfs/dbraw/zinc/42/79/40/1060427940.db2.gz OWBKLORNPUIPFX-ODIFPOPNSA-N 2 0 335.561 4.462 20 0 EIADRP CC(C)C[C@@H](Cc1ccccc1)[NH2+]CC1CC[NH+](C2CCC2)CC1 ZINC001169068854 1060624863 /nfs/dbraw/zinc/62/48/63/1060624863.db2.gz XHSATDYRUVHUAV-NRFANRHFSA-N 2 0 328.544 4.498 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC(Cc3cccc(Cl)c3)CC1)C2 ZINC001169125579 1060651350 /nfs/dbraw/zinc/65/13/50/1060651350.db2.gz JILBOPVWCAUKEM-ACDBMABISA-N 2 0 332.919 4.220 20 0 EIADRP CC1(C)C[C@@H](Nc2ccc([C@@H]3CCC[NH2+]C3)cc2)C[C@@](C)(C[NH3+])C1 ZINC001169145233 1060665763 /nfs/dbraw/zinc/66/57/63/1060665763.db2.gz DGPYIKWOCHAIDI-YFVAEKQCSA-N 2 0 329.532 4.109 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H](n1cc(C3CC[NH2+]CC3)c3cc(F)ccc31)C2 ZINC001169153606 1060669964 /nfs/dbraw/zinc/66/99/64/1060669964.db2.gz KHGWPUQTKRBMRS-BCDXTJNWSA-N 2 0 341.474 4.045 20 0 EIADRP C[C@@H](c1ccc(Br)cc1)[N@H+](C)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169160466 1060673038 /nfs/dbraw/zinc/67/30/38/1060673038.db2.gz GHKCVAMGKXBLSQ-KKBVYLPWSA-N 2 0 337.305 4.067 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC(Cc3cnc4ccccc4c3)CC1)C2 ZINC001169160034 1060673640 /nfs/dbraw/zinc/67/36/40/1060673640.db2.gz AKXPXKUMCRCEOF-KOUNCHBCSA-N 2 0 349.522 4.115 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc(C(C)(C)C)c2)[C@H](C)C1 ZINC001169555159 1060855172 /nfs/dbraw/zinc/85/51/72/1060855172.db2.gz NQRBEKGDIJDOAC-NQIIRXRSSA-N 2 0 346.559 4.211 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1cc[nH+]c(N2CCCCC2)c1 ZINC001169695614 1060905276 /nfs/dbraw/zinc/90/52/76/1060905276.db2.gz IPBUPYVIWQWAJK-IBGZPJMESA-N 2 0 336.483 4.312 20 0 EIADRP C[N@@H+]1CCC[C@@H]1CCN1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000767370734 1061214864 /nfs/dbraw/zinc/21/48/64/1061214864.db2.gz DTVZWJPXPHGDJA-RHSMWYFYSA-N 2 0 326.406 4.327 20 0 EIADRP c1nc(C2CCCCC2)sc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000536630665 1032089314 /nfs/dbraw/zinc/08/93/14/1032089314.db2.gz JRJCDKHFOQPNEU-UHFFFAOYSA-N 2 0 347.572 4.499 20 0 EIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000532226265 1032107939 /nfs/dbraw/zinc/10/79/39/1032107939.db2.gz RQZGUQQWKHFPKP-OALUTQOASA-N 2 0 328.525 4.272 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCNCc1ccc(Sc2ccccn2)o1 ZINC000509672644 1032259274 /nfs/dbraw/zinc/25/92/74/1032259274.db2.gz KXBOBEIZUUTGKE-INIZCTEOSA-N 2 0 345.512 4.180 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(F)cc1F ZINC000120924509 1032474721 /nfs/dbraw/zinc/47/47/21/1032474721.db2.gz CUTZZWKATPOIAL-LJQANCHMSA-N 2 0 336.401 4.406 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2cc(Cl)c(N)c(Cl)c2)CC1 ZINC000760167701 1032516661 /nfs/dbraw/zinc/51/66/61/1032516661.db2.gz KVGGRODHPLMMRS-GFCCVEGCSA-N 2 0 344.330 4.348 20 0 EIADRP C[C@@H]1C[NH+](CCCC[NH2+]Cc2ccc(C(C)(C)C)s2)C[C@@H](C)O1 ZINC000533200163 1032543864 /nfs/dbraw/zinc/54/38/64/1032543864.db2.gz MSLORNNIHLLARD-HZPDHXFCSA-N 2 0 338.561 4.025 20 0 EIADRP CC[N@H+](CCC1CC[NH+](C[C@@H]2CCCCN2C(C)C)CC1)CC1CC1 ZINC000450656844 1032624892 /nfs/dbraw/zinc/62/48/92/1032624892.db2.gz WXKLPKSAXVKNFD-QFIPXVFZSA-N 2 0 349.607 4.083 20 0 EIADRP C[N@@H+]1CC[C@]2(CC[NH+](CCCCc3ccc(Cl)c(Cl)c3)C2)C1 ZINC000430148404 1018868059 /nfs/dbraw/zinc/86/80/59/1018868059.db2.gz RTZXWENHQVQJRB-SFHVURJKSA-N 2 0 341.326 4.344 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)o2)CC[NH+](C)CC1 ZINC000579780004 1018896412 /nfs/dbraw/zinc/89/64/12/1018896412.db2.gz YCLLHHWZBOMKMA-INIZCTEOSA-N 2 0 344.524 4.425 20 0 EIADRP Cc1cnc([C@H](C)C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000274752178 1019189231 /nfs/dbraw/zinc/18/92/31/1019189231.db2.gz HTZQEHKJOKIWON-AYBZRNKSSA-N 2 0 343.540 4.055 20 0 EIADRP Cc1cnc([C@H](C)C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000274752181 1019189873 /nfs/dbraw/zinc/18/98/73/1019189873.db2.gz HTZQEHKJOKIWON-HHXXYDBFSA-N 2 0 343.540 4.055 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](CCc2c(F)cccc2Cl)CC1 ZINC001167077778 1019567344 /nfs/dbraw/zinc/56/73/44/1019567344.db2.gz NOTRMROPGMGWDU-UHFFFAOYSA-N 2 0 340.914 4.466 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+](CCc1ccc(C(F)(F)F)cc1)CC2 ZINC001209124501 1020030843 /nfs/dbraw/zinc/03/08/43/1020030843.db2.gz AHRKZJIRKUZFKP-UHFFFAOYSA-N 2 0 340.433 4.056 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccc2cnccc2c1 ZINC000327718171 1020167559 /nfs/dbraw/zinc/16/75/59/1020167559.db2.gz DDEZYKQJEGJOAO-UHFFFAOYSA-N 2 0 333.479 4.366 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000655805438 1020972197 /nfs/dbraw/zinc/97/21/97/1020972197.db2.gz OBVYUNFJRJXSLM-RNJTYBCJSA-N 2 0 340.433 4.271 20 0 EIADRP CC[C@H]([NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)[C@H]1CCCCO1 ZINC000655846807 1021010852 /nfs/dbraw/zinc/01/08/52/1021010852.db2.gz LZNVEOHGIYKVDN-YUXAGFNASA-N 2 0 344.543 4.019 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCCc3c(O)cccc32)c1 ZINC000340476168 1021098015 /nfs/dbraw/zinc/09/80/15/1021098015.db2.gz UVZXZCXPLIWCKH-NRFANRHFSA-N 2 0 338.495 4.401 20 0 EIADRP c1ccc(C[N@H+]2CCC[C@@H](C[NH2+][C@@H]3CCCNc4ccccc43)C2)cc1 ZINC000683690501 1021098636 /nfs/dbraw/zinc/09/86/36/1021098636.db2.gz LXCNRXJQOCVLDR-NZQKXSOJSA-N 2 0 349.522 4.435 20 0 EIADRP C([C@@H]1CCC[N@H+](CC2([C@@H]3CCCCO3)CCC2)C1)[NH+]1CCCCCC1 ZINC001167326743 1021130299 /nfs/dbraw/zinc/13/02/99/1021130299.db2.gz PZNQJMKXBZEGJD-SFTDATJTSA-N 2 0 348.575 4.314 20 0 EIADRP Cc1nccn1CCCCN1CCc2ccc(Cl)c(Cl)c2C1 ZINC000661373197 1021526388 /nfs/dbraw/zinc/52/63/88/1021526388.db2.gz LSBGOWFWNGNBNP-UHFFFAOYSA-N 2 0 338.282 4.337 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2cc(Cl)ccc2OC(F)F)CC1 ZINC000580389428 1021957740 /nfs/dbraw/zinc/95/77/40/1021957740.db2.gz FQIADPOYYBHHLW-LBPRGKRZSA-N 2 0 346.849 4.324 20 0 EIADRP CC[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccccc1OC(F)F ZINC000414172931 1022029862 /nfs/dbraw/zinc/02/98/62/1022029862.db2.gz FUCDELJDGFKITB-GOEBONIOSA-N 2 0 326.431 4.061 20 0 EIADRP C[NH+](C)Cc1ccc(CN[C@H](c2ccc(F)cc2)c2ccccn2)cc1 ZINC000340693199 1022040079 /nfs/dbraw/zinc/04/00/79/1022040079.db2.gz ZQQNTRKWFJFMET-JOCHJYFZSA-N 2 0 349.453 4.162 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000398053773 1022053248 /nfs/dbraw/zinc/05/32/48/1022053248.db2.gz YTONRPZHVFJZJR-YWZLYKJASA-N 2 0 346.877 4.479 20 0 EIADRP COc1ccc([C@H]([NH2+]CC[C@@H]2CCC[N@H+](C)C2)c2ccccc2)cc1 ZINC000414199432 1022107336 /nfs/dbraw/zinc/10/73/36/1022107336.db2.gz XAUHQFMPDFKMPA-PGRDOPGGSA-N 2 0 338.495 4.106 20 0 EIADRP Cc1cc(OCCC[C@@H](C)[NH2+]C[C@H]2CCC[N@H+](C)C2)ccc1Cl ZINC000549041204 1022247653 /nfs/dbraw/zinc/24/76/53/1022247653.db2.gz FVLSDSUTFTYVOX-IAGOWNOFSA-N 2 0 338.923 4.127 20 0 EIADRP Cc1cc(F)ncc1C[NH2+]Cc1ccc(C[N@H+]2CCC[C@@H](C)C2)cc1 ZINC000892574011 1022253843 /nfs/dbraw/zinc/25/38/43/1022253843.db2.gz HNKVCEKTAQSMQH-MRXNPFEDSA-N 2 0 341.474 4.051 20 0 EIADRP CSc1ccc(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)s1 ZINC000580604568 1022292790 /nfs/dbraw/zinc/29/27/90/1022292790.db2.gz XPCYEPKKAHWCOO-QGZVFWFLSA-N 2 0 346.565 4.124 20 0 EIADRP C[C@@H](C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)CC(F)(F)F ZINC000414278994 1022390570 /nfs/dbraw/zinc/39/05/70/1022390570.db2.gz IPGHZFJQVORJMU-DDBAPUKQSA-N 2 0 340.433 4.360 20 0 EIADRP Cc1n[nH]cc1[C@@H](C)[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000180072777 1022426036 /nfs/dbraw/zinc/42/60/36/1022426036.db2.gz KWEMRMGXQSVATM-MRXNPFEDSA-N 2 0 348.494 4.298 20 0 EIADRP Oc1cccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1Cl ZINC000397506136 1022536880 /nfs/dbraw/zinc/53/68/80/1022536880.db2.gz JFFJQPOEXOFNFG-UHFFFAOYSA-N 2 0 344.886 4.047 20 0 EIADRP c1nc(C2CCCC2)sc1C[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647544383 1022787907 /nfs/dbraw/zinc/78/79/07/1022787907.db2.gz ZQMGYVMKVYWLFK-IAGOWNOFSA-N 2 0 333.545 4.012 20 0 EIADRP C[C@H](CC[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1cccc(C(F)(F)F)c1 ZINC000647548784 1022808174 /nfs/dbraw/zinc/80/81/74/1022808174.db2.gz UAIZCGJBNHEPJF-GRZALLJUSA-N 2 0 340.433 4.177 20 0 EIADRP C[C@H](CC[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1)c1cccc(C(F)(F)F)c1 ZINC000647548786 1022809226 /nfs/dbraw/zinc/80/92/26/1022809226.db2.gz UAIZCGJBNHEPJF-NYCLONFESA-N 2 0 340.433 4.177 20 0 EIADRP Cc1nc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@H]4CCC[C@H]43)cc2)cs1 ZINC000581326325 1023024103 /nfs/dbraw/zinc/02/41/03/1023024103.db2.gz TWKUHOPVVGUNGE-NSHGMRRFSA-N 2 0 341.524 4.081 20 0 EIADRP CCCN(Cc1nc2ccccc2c(C)c1Cl)C1CC[NH2+]CC1 ZINC000261742422 1023083956 /nfs/dbraw/zinc/08/39/56/1023083956.db2.gz OEGCCFJOAGHFFJ-UHFFFAOYSA-N 2 0 331.891 4.161 20 0 EIADRP C[C@]1(C[NH2+]Cc2ccc3ncccc3c2)CC[N@H+](Cc2ccccc2)C1 ZINC000311410431 1023155866 /nfs/dbraw/zinc/15/58/66/1023155866.db2.gz BUIIHIBKCVSXQC-HSZRJFAPSA-N 2 0 345.490 4.237 20 0 EIADRP CCC[C@@H]([NH2+]CC1CCN(Cc2nc(C)c(C)o2)CC1)[C@@H]1CC1(C)C ZINC000417300620 1023249175 /nfs/dbraw/zinc/24/91/75/1023249175.db2.gz APGZBZMGTMJZCR-RBUKOAKNSA-N 2 0 347.547 4.308 20 0 EIADRP CCC[C@H]([NH2+]CC1CCN(Cc2nc(C)c(C)o2)CC1)[C@H]1CC1(C)C ZINC000417300612 1023249217 /nfs/dbraw/zinc/24/92/17/1023249217.db2.gz APGZBZMGTMJZCR-MOPGFXCFSA-N 2 0 347.547 4.308 20 0 EIADRP c1csc([C@H](Cc2ccccc2)[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)c1 ZINC000090015596 1023264750 /nfs/dbraw/zinc/26/47/50/1023264750.db2.gz XZKIXSHNOMYCNU-OTWHNJEPSA-N 2 0 326.509 4.248 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417347041 1023274296 /nfs/dbraw/zinc/27/42/96/1023274296.db2.gz VOFFRVCFZYDUPB-MQOOWTBDSA-N 2 0 332.557 4.483 20 0 EIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc2c(c1)CCC2 ZINC000537936483 1023276645 /nfs/dbraw/zinc/27/66/45/1023276645.db2.gz UFFVRLCUOBVDRG-QGZVFWFLSA-N 2 0 335.495 4.138 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1cccc(OCc2ccc(F)cc2)c1 ZINC000415016947 1023391179 /nfs/dbraw/zinc/39/11/79/1023391179.db2.gz QXGQWZGWZXKPDY-MRXNPFEDSA-N 2 0 330.447 4.012 20 0 EIADRP CC(C)Sc1cc(Br)ccc1C[NH2+][C@@H](C)CCC[NH3+] ZINC000415024344 1023394341 /nfs/dbraw/zinc/39/43/41/1023394341.db2.gz OTQJTZBNXWDPNA-LBPRGKRZSA-N 2 0 345.350 4.167 20 0 EIADRP Cc1ccc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1Br ZINC000415058121 1023410870 /nfs/dbraw/zinc/41/08/70/1023410870.db2.gz SMMXTEUSOJDBMD-SFHVURJKSA-N 2 0 347.300 4.327 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+]C2C[C@H]3CC[C@@H](C2)S3)C[N@@H+]1Cc1ccccc1 ZINC000925617567 1023410952 /nfs/dbraw/zinc/41/09/52/1023410952.db2.gz XGNRCHOAPCEBGI-VZHSDHNVSA-N 2 0 344.568 4.303 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cnc(C2CCCC2)s1)c1ccccc1 ZINC000415054951 1023411966 /nfs/dbraw/zinc/41/19/66/1023411966.db2.gz OEQKDWFESSYITO-GOSISDBHSA-N 2 0 329.513 4.371 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1nc2ccc(F)cc2s1)c1ccccc1 ZINC000415055808 1023412182 /nfs/dbraw/zinc/41/21/82/1023412182.db2.gz OVHSENMYCYZVPL-HNNXBMFYSA-N 2 0 329.444 4.005 20 0 EIADRP c1ccc([C@@H]2C[C@H](NCc3ccccc3OC3CCC3)CC[NH2+]2)cc1 ZINC000415090442 1023432959 /nfs/dbraw/zinc/43/29/59/1023432959.db2.gz OUKHZILLHDSRJB-CTNGQTDRSA-N 2 0 336.479 4.201 20 0 EIADRP C[C@H](CC[NH2+]C[C@H]1CC[NH2+][C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000415085921 1023434443 /nfs/dbraw/zinc/43/44/43/1023434443.db2.gz IZHGWLHZDSOXBZ-KFWWJZLASA-N 2 0 328.422 4.177 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccc1Cl ZINC000656682574 1023434584 /nfs/dbraw/zinc/43/45/84/1023434584.db2.gz DKOPWYWXZPEKCS-INIZCTEOSA-N 2 0 343.902 4.298 20 0 EIADRP C[C@@H](NCC1(C[NH+](C)C)CCCC1)c1ccccc1OC(F)F ZINC000545519477 1023470530 /nfs/dbraw/zinc/47/05/30/1023470530.db2.gz MGWLLLPIHPIBQY-CQSZACIVSA-N 2 0 326.431 4.061 20 0 EIADRP C[C@H](C[N@H+](C)C[C@@H]1CCC[NH+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500078112 1023490747 /nfs/dbraw/zinc/49/07/47/1023490747.db2.gz ZUTLUDNOUHBORZ-HUUCEWRRSA-N 2 0 328.422 4.083 20 0 EIADRP C[C@H](C[N@H+](C)[C@@H]1CCN(C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097670 1023499964 /nfs/dbraw/zinc/49/99/64/1023499964.db2.gz MWQQZHXQQMZTDO-JKIFEVAISA-N 2 0 328.422 4.223 20 0 EIADRP Cc1ccccc1[C@@H](C(C)C)[N@H+](C)CCCN1CC[NH+](C(C)C)CC1 ZINC000500099867 1023501564 /nfs/dbraw/zinc/50/15/64/1023501564.db2.gz VPSMDBVCALKHLV-JOCHJYFZSA-N 2 0 345.575 4.040 20 0 EIADRP c1nc(C[NH+]2CCC([C@@H]3CCC[NH2+]C3)CC2)sc1-c1ccccc1 ZINC000656786160 1023526724 /nfs/dbraw/zinc/52/67/24/1023526724.db2.gz LJSJOVQSZUQFHQ-GOSISDBHSA-N 2 0 341.524 4.022 20 0 EIADRP Clc1cc2cccnc2c(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)c1 ZINC000656784451 1023530264 /nfs/dbraw/zinc/53/02/64/1023530264.db2.gz DFWAMTQJEURUNL-QGZVFWFLSA-N 2 0 343.902 4.100 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2[nH]ccc2c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311138179 1023584383 /nfs/dbraw/zinc/58/43/83/1023584383.db2.gz YESBTBOHVFOTRS-LAUBAEHRSA-N 2 0 333.479 4.168 20 0 EIADRP C[C@H](c1ccccc1C(F)(F)F)[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000377629038 1023643512 /nfs/dbraw/zinc/64/35/12/1023643512.db2.gz PBABHVVHQHQAEG-JKXDFHQYSA-N 2 0 326.406 4.323 20 0 EIADRP C[C@H](N[C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1ccc(F)cn1 ZINC000390564568 1023681399 /nfs/dbraw/zinc/68/13/99/1023681399.db2.gz ALDANMRGYVSNQA-JXFKEZNVSA-N 2 0 341.474 4.172 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCCC4)cc1 ZINC000581825088 1023737675 /nfs/dbraw/zinc/73/76/75/1023737675.db2.gz YMWDTJHKOYBDHW-OAQYLSRUSA-N 2 0 336.479 4.028 20 0 EIADRP C[C@H]1C[C@H](CC[NH2+]C2CCC(F)(F)CC2)C[N@@H+]1Cc1ccccc1 ZINC000647196191 1023851496 /nfs/dbraw/zinc/85/14/96/1023851496.db2.gz RSAXFDRKKHQWMB-WMZOPIPTSA-N 2 0 336.470 4.455 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)c2ccc(F)cc2Cl)[C@@H](C)C1 ZINC000468804212 1023876506 /nfs/dbraw/zinc/87/65/06/1023876506.db2.gz CJUPQWHIIUQGDY-GUYCJALGSA-N 2 0 326.887 4.077 20 0 EIADRP Fc1ccc(/C=C\C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000511784736 1023882014 /nfs/dbraw/zinc/88/20/14/1023882014.db2.gz HTRSVHHRMMMBJK-OCTSTCLRSA-N 2 0 342.433 4.090 20 0 EIADRP c1ccc(CN2CC[C@@H]([NH2+]CCC[C@@H]3CCCCO3)CC23CC3)cc1 ZINC000647201802 1023885359 /nfs/dbraw/zinc/88/53/59/1023885359.db2.gz ANVBJSKPENWUDH-RTWAWAEBSA-N 2 0 342.527 4.123 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1csc(C(F)(F)F)c1)c1ccccc1 ZINC000925720599 1024102668 /nfs/dbraw/zinc/10/26/68/1024102668.db2.gz YORJLCQCXACMKN-CQSZACIVSA-N 2 0 328.403 4.337 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000301216789 1033192107 /nfs/dbraw/zinc/19/21/07/1033192107.db2.gz ZGYBRBIMGYDIHW-ICSRJNTNSA-N 2 0 338.495 4.258 20 0 EIADRP Cc1c([C@@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)cnn1C(C)(C)C ZINC000468889759 1024203875 /nfs/dbraw/zinc/20/38/75/1024203875.db2.gz JXMHIHBFPKQUGA-QGZVFWFLSA-N 2 0 348.579 4.355 20 0 EIADRP FCCC[C@@H]1CCC[C@H]1[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000510699592 1024252374 /nfs/dbraw/zinc/25/23/74/1024252374.db2.gz CDTQHSACKKRAJB-PKOBYXMFSA-N 2 0 338.536 4.468 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cc(O)cc(F)c2)CC1 ZINC000473130218 1024336673 /nfs/dbraw/zinc/33/66/73/1024336673.db2.gz ASEWDGVCSKIOGU-MRXNPFEDSA-N 2 0 334.479 4.008 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2cc3ccnc(Cl)c3s2)CC1 ZINC000893969951 1033209061 /nfs/dbraw/zinc/20/90/61/1033209061.db2.gz UYPKTAUIYRDGMX-UHFFFAOYSA-N 2 0 337.920 4.113 20 0 EIADRP Cc1nccn1CCCN1C[C@@H](c2cccc(Cl)c2)OCC1(C)C ZINC000661740760 1024428845 /nfs/dbraw/zinc/42/88/45/1024428845.db2.gz RVLCAHAPUTXEEE-SFHVURJKSA-N 2 0 347.890 4.087 20 0 EIADRP C[C@H](c1cccc2ccccc21)[N@@H+]1CCC[C@H]([C@@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000652347473 1024696939 /nfs/dbraw/zinc/69/69/39/1024696939.db2.gz BLQMXDKCZYWXMM-ONZODILHSA-N 2 0 338.495 4.119 20 0 EIADRP C[C@H](c1cccc2ccccc21)[N@@H+]1CCC[C@H]([C@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000652347474 1024697347 /nfs/dbraw/zinc/69/73/47/1024697347.db2.gz BLQMXDKCZYWXMM-PGVBMLAISA-N 2 0 338.495 4.119 20 0 EIADRP COc1ccccc1-c1ccc(C[N@H+](C)C[C@H]2CCC[NH+](C)C2)cc1 ZINC000092253698 1024762014 /nfs/dbraw/zinc/76/20/14/1024762014.db2.gz MUHOICKYTPWBRQ-IBGZPJMESA-N 2 0 338.495 4.136 20 0 EIADRP Fc1cccc(F)c1C[N@H+]1C[C@@H]2CC[NH+](C3CCCC3)CC[C@@H]2C1 ZINC001279210393 1024790740 /nfs/dbraw/zinc/79/07/40/1024790740.db2.gz ILBANQPDLVRHJZ-IYBDPMFKSA-N 2 0 334.454 4.051 20 0 EIADRP c1sc(C2CCCC2)nc1C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662293743 1025044785 /nfs/dbraw/zinc/04/47/85/1025044785.db2.gz MURINDYQGGDRFJ-QGZVFWFLSA-N 2 0 333.545 4.012 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3F)s2)C1 ZINC000062426933 1025056345 /nfs/dbraw/zinc/05/63/45/1025056345.db2.gz GLFQYZUUDZNAHB-HNNXBMFYSA-N 2 0 332.488 4.374 20 0 EIADRP CC(C)c1cccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000663328010 1025095263 /nfs/dbraw/zinc/09/52/63/1025095263.db2.gz NCAZXCAFYLINMW-UHFFFAOYSA-N 2 0 337.511 4.207 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H](C)c2ccccc2C(C)(C)C)CC1 ZINC000535838445 1025104523 /nfs/dbraw/zinc/10/45/23/1025104523.db2.gz RWOXDENBKJNLGX-QGZVFWFLSA-N 2 0 332.532 4.136 20 0 EIADRP c1ccc2c(c1)[nH]c1c2CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663466123 1025391554 /nfs/dbraw/zinc/39/15/54/1025391554.db2.gz OGPKONRAAXYPMH-UWJYYQICSA-N 2 0 337.511 4.257 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)C1 ZINC000663466307 1025393453 /nfs/dbraw/zinc/39/34/53/1025393453.db2.gz QWSPOIUYEAHDQO-NJDAHSKKSA-N 2 0 341.543 4.128 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2occc2c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000511985599 1025396080 /nfs/dbraw/zinc/39/60/80/1025396080.db2.gz AQDRCOCJWSSLRC-DYESRHJHSA-N 2 0 334.463 4.433 20 0 EIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc(SC(F)(F)F)c1 ZINC000925777233 1025420547 /nfs/dbraw/zinc/42/05/47/1025420547.db2.gz CLDBZYMYKCINEZ-RAQOOLMWSA-N 2 0 330.419 4.232 20 0 EIADRP CCCCc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)cc1 ZINC000537959591 1025447294 /nfs/dbraw/zinc/44/72/94/1025447294.db2.gz MZKKXUYPYUABST-WTOYTKOKSA-N 2 0 344.543 4.058 20 0 EIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2ncc(Cl)s2)C[N@@H+]1Cc1ccccc1 ZINC000472037150 1025461226 /nfs/dbraw/zinc/46/12/26/1025461226.db2.gz HQRSXQKRRPEMEJ-GOEBONIOSA-N 2 0 349.931 4.187 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1C[C@@H](c2ccc(C)cc2)C[C@H]1C ZINC000426539584 1025490797 /nfs/dbraw/zinc/49/07/97/1025490797.db2.gz NEHVQJLHHAYKKK-XLIONFOSSA-N 2 0 346.478 4.262 20 0 EIADRP C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)o1 ZINC000066973467 1025622794 /nfs/dbraw/zinc/62/27/94/1025622794.db2.gz YNZCPCWBIXTZNS-OXQOHEQNSA-N 2 0 342.483 4.023 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@@H](Oc2ccccc2OC)C1 ZINC001167827188 1025634095 /nfs/dbraw/zinc/63/40/95/1025634095.db2.gz UMYFNHCHSMEUCU-RTBURBONSA-N 2 0 348.531 4.049 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC2(CC1)OCc1ccccc12 ZINC001167827542 1025656037 /nfs/dbraw/zinc/65/60/37/1025656037.db2.gz XJQDYSIFLWPVIR-GOSISDBHSA-N 2 0 330.516 4.018 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(c2ccc(OC)cc2)CC1 ZINC001167827922 1025678857 /nfs/dbraw/zinc/67/88/57/1025678857.db2.gz ZMUBFNJVHHXYJL-GOSISDBHSA-N 2 0 332.532 4.385 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cc3ccncc3s2)cc1 ZINC000657297357 1025783143 /nfs/dbraw/zinc/78/31/43/1025783143.db2.gz MHFYJHWZCQMYSU-UHFFFAOYSA-N 2 0 339.508 4.428 20 0 EIADRP CN(CCCC[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccc1 ZINC000132437475 1025791354 /nfs/dbraw/zinc/79/13/54/1025791354.db2.gz ZUKPOYVGLJIFMH-UHFFFAOYSA-N 2 0 343.559 4.290 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000415010692 1025825550 /nfs/dbraw/zinc/82/55/50/1025825550.db2.gz GPEIWXWSJJBFFU-KBRIMQKVSA-N 2 0 328.422 4.449 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+][C@H](CC[NH+](C)C)C(C)(C)C ZINC000511045029 1025831300 /nfs/dbraw/zinc/83/13/00/1025831300.db2.gz RMTHQWIIJXLHSZ-NMIWIPSGSA-N 2 0 332.532 4.192 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC2(CC(=O)c3ccccc32)CC1 ZINC001167835859 1025839831 /nfs/dbraw/zinc/83/98/31/1025839831.db2.gz USYGBDJFDSODEV-SFHVURJKSA-N 2 0 342.527 4.117 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCO[C@](C)(c2ccc(C)cc2)C1 ZINC001167837433 1025848758 /nfs/dbraw/zinc/84/87/58/1025848758.db2.gz KBKWXNQPJWVJCD-CTNGQTDRSA-N 2 0 332.532 4.053 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(C(C)=O)(c2ccccc2)CC1 ZINC001167838337 1025849698 /nfs/dbraw/zinc/84/96/98/1025849698.db2.gz TVRUEDBDNSHIIK-LJQANCHMSA-N 2 0 344.543 4.120 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@@H](OCc2ccccc2)C1 ZINC001167837910 1025849786 /nfs/dbraw/zinc/84/97/86/1025849786.db2.gz NSONGBWXQUSDOW-PZJWPPBQSA-N 2 0 332.532 4.178 20 0 EIADRP C[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(OC(C)(C)C)cc1 ZINC000432409159 1025877972 /nfs/dbraw/zinc/87/79/72/1025877972.db2.gz FGQFWCAWVCEDBS-QZTJIDSGSA-N 2 0 348.531 4.015 20 0 EIADRP CC(C)[C@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(Cl)cc1 ZINC000432412232 1025882940 /nfs/dbraw/zinc/88/29/40/1025882940.db2.gz FSAQSRXSGVXEEL-APWZRJJASA-N 2 0 338.923 4.128 20 0 EIADRP CCO[C@@H]1C[C@H]([NH2+]Cc2ccc(Cn3ccnc3)cc2)C1(CC)CC ZINC000344033679 1025889395 /nfs/dbraw/zinc/88/93/95/1025889395.db2.gz LPXHNRVSHVIAFV-VQTJNVASSA-N 2 0 341.499 4.005 20 0 EIADRP Clc1cccc2c1CC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167968282 1025893767 /nfs/dbraw/zinc/89/37/67/1025893767.db2.gz ORNUMDWIBACICN-CIUFUOKISA-N 2 0 330.903 4.322 20 0 EIADRP c1ccc(-c2ccc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)cc2)nc1 ZINC001167968181 1025894808 /nfs/dbraw/zinc/89/48/08/1025894808.db2.gz NSMBGCQTQGLMKI-FRIKZZABSA-N 2 0 347.506 4.244 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cc(COC)cs2)c1 ZINC000657315148 1025956873 /nfs/dbraw/zinc/95/68/73/1025956873.db2.gz MLODFROETDYUHQ-UHFFFAOYSA-N 2 0 332.513 4.026 20 0 EIADRP OCCCCCCCCCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167970978 1026049620 /nfs/dbraw/zinc/04/96/20/1026049620.db2.gz RGGOSVQXVQDRAS-SEJPIABJSA-N 2 0 336.564 4.095 20 0 EIADRP CO[C@@H](C[NH2+]Cc1cc(-n2ccnc2)cs1)c1ccc(Cl)cc1 ZINC000344201883 1026128194 /nfs/dbraw/zinc/12/81/94/1026128194.db2.gz YPZNSTZAKDMZSS-KRWDZBQOSA-N 2 0 347.871 4.065 20 0 EIADRP FC1(F)CCC(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167972766 1026131138 /nfs/dbraw/zinc/13/11/38/1026131138.db2.gz BHPRXEOGTBXACO-AYHJJNSGSA-N 2 0 326.475 4.197 20 0 EIADRP CC(C)SCC[N@H+](C)[C@@H]1CCC[NH+](CCSC(C)C)CC1 ZINC000514096019 1026133812 /nfs/dbraw/zinc/13/38/12/1026133812.db2.gz RDIIMZRSETXYSV-QGZVFWFLSA-N 2 0 332.623 4.056 20 0 EIADRP C[C@H]1Cc2ccccc2[C@@H]1[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000111410888 1026160632 /nfs/dbraw/zinc/16/06/32/1026160632.db2.gz NFMPXXPDUHIVOB-HTAPYJJXSA-N 2 0 338.495 4.040 20 0 EIADRP CC(C)(C)Oc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167974278 1026173062 /nfs/dbraw/zinc/17/30/62/1026173062.db2.gz UCGNUXZDNDDDKH-IHWFROFDSA-N 2 0 342.527 4.359 20 0 EIADRP COc1ccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CCC2)cc1 ZINC001167975799 1026295127 /nfs/dbraw/zinc/29/51/27/1026295127.db2.gz WFUWPMAATANJGL-IHWFROFDSA-N 2 0 340.511 4.069 20 0 EIADRP COCc1csc(C[NH2+]C2CCN([C@H](C)c3ccccc3)CC2)c1 ZINC000657367578 1026333322 /nfs/dbraw/zinc/33/33/22/1026333322.db2.gz QWGJNAUVYPIZOI-MRXNPFEDSA-N 2 0 344.524 4.210 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cc1 ZINC000657377242 1026372451 /nfs/dbraw/zinc/37/24/51/1026372451.db2.gz NVICYYZGFMVBGW-YQQQUEKLSA-N 2 0 341.524 4.223 20 0 EIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+]C1CCN([C@@H](C)c2ccccc2)CC1 ZINC000511095821 1026390192 /nfs/dbraw/zinc/39/01/92/1026390192.db2.gz XHRJHKSRFHVXPO-ROUUACIJSA-N 2 0 338.495 4.138 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000559898759 1026492570 /nfs/dbraw/zinc/49/25/70/1026492570.db2.gz FPLSUPOMJPKOGM-XJABCFGWSA-N 2 0 338.495 4.081 20 0 EIADRP C[C@H]1CCC[C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000344727618 1026564141 /nfs/dbraw/zinc/56/41/41/1026564141.db2.gz TXNPLRQIFYMZTI-FPOVZHCZSA-N 2 0 344.543 4.226 20 0 EIADRP c1cc(C[NH2+][C@H]2CCC[C@H](c3ccccc3)C2)n(-c2cc[nH+]cc2)n1 ZINC000657448441 1026742790 /nfs/dbraw/zinc/74/27/90/1026742790.db2.gz ZIYBFXYUBXVLHR-OALUTQOASA-N 2 0 332.451 4.083 20 0 EIADRP COc1ccccc1[C@H](CNc1cc[nH+]c2cc(F)ccc12)[NH+](C)C ZINC000500469267 1026775979 /nfs/dbraw/zinc/77/59/79/1026775979.db2.gz POYAANXGJBHKKN-IBGZPJMESA-N 2 0 339.414 4.097 20 0 EIADRP CCOc1cccc2cc([C@H](C)[NH2+]CC3(C)CC[NH+](C)CC3)oc21 ZINC000507483457 1026812860 /nfs/dbraw/zinc/81/28/60/1026812860.db2.gz RQJHDJWYKIXZDP-HNNXBMFYSA-N 2 0 330.472 4.214 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cccc3cnccc32)cc1 ZINC000236935183 1026814839 /nfs/dbraw/zinc/81/48/39/1026814839.db2.gz DFZWCTMVRYIYFM-UHFFFAOYSA-N 2 0 333.479 4.366 20 0 EIADRP C[NH+](C)CC1CCC([NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)CC1 ZINC000749823817 1026937061 /nfs/dbraw/zinc/93/70/61/1026937061.db2.gz RJBXHGFQYWTYCJ-UHFFFAOYSA-N 2 0 330.516 4.000 20 0 EIADRP CC[NH+](CC)CCO[C@H]1CC[N@@H+]([C@H](C)c2c(C)cc(C)cc2C)C1 ZINC001167603779 1026994209 /nfs/dbraw/zinc/99/42/09/1026994209.db2.gz ZQDGHSMBHIROQW-UXHICEINSA-N 2 0 332.532 4.106 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000519818968 1027014465 /nfs/dbraw/zinc/01/44/65/1027014465.db2.gz FSPUSGGCZZAEDC-QPJICYPMSA-N 2 0 349.453 4.180 20 0 EIADRP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000582726342 1027016323 /nfs/dbraw/zinc/01/63/23/1027016323.db2.gz XRZUSKMUBSEXMU-XJKSGUPXSA-N 2 0 326.406 4.088 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)[C@@H](C)C1 ZINC000342810184 1027094203 /nfs/dbraw/zinc/09/42/03/1027094203.db2.gz PDDILRIQBHIENG-WWMYMODYSA-N 2 0 330.516 4.074 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+]CCCCc2ccc(Cl)c(Cl)c2)C1 ZINC000474484970 1027122632 /nfs/dbraw/zinc/12/26/32/1027122632.db2.gz BWUCKXSDKXVMCA-OAHLLOKOSA-N 2 0 329.315 4.248 20 0 EIADRP C[C@@H]1CC([NH2+]C[C@@H]2CCOC(C)(C)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168036128 1027130941 /nfs/dbraw/zinc/13/09/41/1027130941.db2.gz UBGWQLGWIYNOKQ-QWFCFKBJSA-N 2 0 344.543 4.223 20 0 EIADRP CC[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cccc(F)c1 ZINC000188167254 1027161865 /nfs/dbraw/zinc/16/18/65/1027161865.db2.gz VDGQRSFFJCABKD-FQEVSTJZSA-N 2 0 327.447 4.178 20 0 EIADRP Cc1cc(N2CCC[N@H+](Cc3ccc(C(F)(F)F)cc3)CC2)cc[nH+]1 ZINC000302221426 1027266988 /nfs/dbraw/zinc/26/69/88/1027266988.db2.gz NRTZASMZHMXKHH-UHFFFAOYSA-N 2 0 349.400 4.121 20 0 EIADRP Cc1cc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)ccc1Cl ZINC000657613625 1027301359 /nfs/dbraw/zinc/30/13/59/1027301359.db2.gz OMGHCXASCYJDAQ-UHFFFAOYSA-N 2 0 343.902 4.045 20 0 EIADRP c1ccc2cc(C[NH2+]CC3CC[NH+](Cc4ccncc4)CC3)ccc2c1 ZINC000657612759 1027303225 /nfs/dbraw/zinc/30/32/25/1027303225.db2.gz RFDVZFXVLHZZNH-UHFFFAOYSA-N 2 0 345.490 4.237 20 0 EIADRP COc1ccc(CNC[C@@H]2CCC[N@H+](C)[C@H]2c2cccs2)c(F)c1 ZINC000520238419 1027342923 /nfs/dbraw/zinc/34/29/23/1027342923.db2.gz IONOEQAHQIQFGQ-HNAYVOBHSA-N 2 0 348.487 4.069 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CCC(F)(F)[C@@H](C)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168041207 1027433384 /nfs/dbraw/zinc/43/33/84/1027433384.db2.gz QZIAUKFOONSEBV-BMFAXAFESA-N 2 0 336.470 4.405 20 0 EIADRP CCO[P@](C)(=O)CC[C@H](C)[NH2+]C1CCC(C)([NH+]2CCCC2)CC1 ZINC000896387992 1027448286 /nfs/dbraw/zinc/44/82/86/1027448286.db2.gz PFPJYOXPWZBTQZ-LYHSWCNTSA-N 2 0 344.480 4.096 20 0 EIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000152449700 1027557550 /nfs/dbraw/zinc/55/75/50/1027557550.db2.gz LGWNCVYBXKCSMZ-AZUAARDMSA-N 2 0 340.536 4.414 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(F)c(F)c1 ZINC000112524283 1027581804 /nfs/dbraw/zinc/58/18/04/1027581804.db2.gz MAYVXVCZWWKPNB-HNNXBMFYSA-N 2 0 330.422 4.411 20 0 EIADRP c1ccc(C[NH+]2CCC[C@H]3C[N@H+](CCCc4cccnc4)CC[C@@H]32)cc1 ZINC001167646333 1027828761 /nfs/dbraw/zinc/82/87/61/1027828761.db2.gz AUFPPRKHFPYAQU-GOTSBHOMSA-N 2 0 349.522 4.001 20 0 EIADRP c1csc(-c2ccc(C[N@H+]3CC[C@@H](C[NH+]4CCCC4)C3)cc2)c1 ZINC000444651471 1027920507 /nfs/dbraw/zinc/92/05/07/1027920507.db2.gz GQRUOJNZVHHCIR-SFHVURJKSA-N 2 0 326.509 4.333 20 0 EIADRP C(=C/C[N@@H+]1CCC[C@@H]1c1ccncc1)\C[NH+]1CCC[C@@H]1c1ccncc1 ZINC000153968069 1028069532 /nfs/dbraw/zinc/06/95/32/1028069532.db2.gz MMSJPTZXSMTSFJ-HSMZSTHASA-N 2 0 348.494 4.007 20 0 EIADRP Cc1ccc2cc(C[NH2+][C@H](C)[C@@H]3CCC[N@@H+](C4CCC4)C3)ccc2n1 ZINC000189427153 1028136027 /nfs/dbraw/zinc/13/60/27/1028136027.db2.gz CAJGRTOOAQKREW-YLJYHZDGSA-N 2 0 337.511 4.286 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](CCSC(F)(F)F)CC1 ZINC001167658854 1028224585 /nfs/dbraw/zinc/22/45/85/1028224585.db2.gz LKTRRRWTRJOXHM-CQSZACIVSA-N 2 0 338.483 4.216 20 0 EIADRP C[N@H+](CCCCC(F)(F)F)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000154724895 1028275354 /nfs/dbraw/zinc/27/53/54/1028275354.db2.gz MCLNJUGGFQEWCA-KRWDZBQOSA-N 2 0 328.422 4.173 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@H]1c1ccc(C)cc1 ZINC000346138783 1028276655 /nfs/dbraw/zinc/27/66/55/1028276655.db2.gz TZMHDYNLLVZOCU-OAQYLSRUSA-N 2 0 332.451 4.221 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](Cc1ccccc1)[C@H](C)C1CC1 ZINC000346225040 1028331459 /nfs/dbraw/zinc/33/14/59/1028331459.db2.gz VNBFPQDQCMTRRJ-GOSISDBHSA-N 2 0 346.478 4.376 20 0 EIADRP [NH3+]C1CC[NH+](Cc2ccc(-c3ccc(C(F)(F)F)cc3)cc2)CC1 ZINC000629695137 1028628854 /nfs/dbraw/zinc/62/88/54/1028628854.db2.gz FQTXLGNCPOYGIB-UHFFFAOYSA-N 2 0 334.385 4.296 20 0 EIADRP CC[C@H]([NH2+][C@H]1CCN(Cc2ccccn2)C[C@@H]1C)c1cccs1 ZINC000156377148 1028719299 /nfs/dbraw/zinc/71/92/99/1028719299.db2.gz OTQPRYZSKQVZED-SZMVWBNQSA-N 2 0 329.513 4.094 20 0 EIADRP CC[C@H]([NH2+]CC[C@H](C)[NH+]1CCCCC1)c1ccc(OC)c(OC)c1 ZINC000346860196 1028797798 /nfs/dbraw/zinc/79/77/98/1028797798.db2.gz JASNXCIVUBDZEX-WMZOPIPTSA-N 2 0 334.504 4.009 20 0 EIADRP CC[C@@H]([NH2+]CC[C@@H](C)[NH+]1CCCCC1)c1ccc(OC)c(OC)c1 ZINC000346860195 1028798609 /nfs/dbraw/zinc/79/86/09/1028798609.db2.gz JASNXCIVUBDZEX-SJLPKXTDSA-N 2 0 334.504 4.009 20 0 EIADRP Clc1ccc([C@H]2C[C@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)C2)cc1Cl ZINC000281643337 1028821018 /nfs/dbraw/zinc/82/10/18/1028821018.db2.gz PEJBTUTTXLYPJY-FPCVCCKLSA-N 2 0 339.310 4.456 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650716687 1028870074 /nfs/dbraw/zinc/87/00/74/1028870074.db2.gz GWFDSHMDXQUECK-GFCCVEGCSA-N 2 0 340.364 4.024 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cccc(-c2ccncc2)c1 ZINC000278406745 1029133014 /nfs/dbraw/zinc/13/30/14/1029133014.db2.gz HGXHHTZEGILWAJ-QGZVFWFLSA-N 2 0 335.495 4.274 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cccc(OC(F)(F)F)c1 ZINC000650753813 1029159619 /nfs/dbraw/zinc/15/96/19/1029159619.db2.gz VUKZEGBHNXRQDX-LLVKDONJSA-N 2 0 342.336 4.034 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCSCc1cccc2ccccc21 ZINC000151160644 1029208771 /nfs/dbraw/zinc/20/87/71/1029208771.db2.gz FCQMNYNJJPNSKN-UZLBHIALSA-N 2 0 328.525 4.003 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1ccc(Br)cc1 ZINC000650760142 1029234175 /nfs/dbraw/zinc/23/41/75/1029234175.db2.gz XKNKQAJMZIUKAA-ZDUSSCGKSA-N 2 0 333.273 4.019 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)CCS2 ZINC000343494395 1029369080 /nfs/dbraw/zinc/36/90/80/1029369080.db2.gz FIHMCEFVRORSJR-QFBILLFUSA-N 2 0 348.556 4.334 20 0 EIADRP C[C@@H](C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000475225688 1029447852 /nfs/dbraw/zinc/44/78/52/1029447852.db2.gz UKSZVOXBXAGXMW-HKUYNNGSSA-N 2 0 326.459 4.041 20 0 EIADRP Cc1ccc2[nH]c(C[NH2+]C[C@H]3CC[N@H+](Cc4ccccc4)C3)cc2c1C ZINC000475225764 1029448279 /nfs/dbraw/zinc/44/82/79/1029448279.db2.gz VJEQLMXRAWTJLB-HXUWFJFHSA-N 2 0 347.506 4.396 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@@H]3CC[C@@H](c4ccccc4)C3)C2)cc1 ZINC000475276621 1029482924 /nfs/dbraw/zinc/48/29/24/1029482924.db2.gz PHGFMRLCTISBTC-YMPZKCBVSA-N 2 0 334.507 4.434 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(C(F)F)nc1 ZINC000657824633 1029583011 /nfs/dbraw/zinc/58/30/11/1029583011.db2.gz RTDKECVTUQULHA-HNNXBMFYSA-N 2 0 345.437 4.466 20 0 EIADRP Cc1nc(-c2ccc(CN[C@@H]3CC[N@@H+](C)C(C)(C)C3)cc2)cs1 ZINC000623379223 1029622461 /nfs/dbraw/zinc/62/24/61/1029622461.db2.gz DPULMEAXKYTTPC-QGZVFWFLSA-N 2 0 329.513 4.081 20 0 EIADRP C[C@@H](Cc1c(Cl)cccc1Cl)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446887257 1029631442 /nfs/dbraw/zinc/63/14/42/1029631442.db2.gz QBMPHKODPAQSAQ-ZDUSSCGKSA-N 2 0 341.326 4.388 20 0 EIADRP Clc1ccc([C@@H]2CCC[C@@H]2[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446887697 1029631637 /nfs/dbraw/zinc/63/16/37/1029631637.db2.gz XIRYYRJFKMFDON-PMACEKPBSA-N 2 0 332.919 4.440 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCc3c2cccc3F)cc1 ZINC000325282989 1029633778 /nfs/dbraw/zinc/63/37/78/1029633778.db2.gz PDSDQNJIQHXNNW-OAQYLSRUSA-N 2 0 326.459 4.445 20 0 EIADRP Cc1c([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2)cnn1-c1cc(C)ccc1C ZINC000584173262 1029657433 /nfs/dbraw/zinc/65/74/33/1029657433.db2.gz HNTPYTIPDUJEPZ-KRWDZBQOSA-N 2 0 348.494 4.107 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C2CC(CF)(CF)C2)cc1 ZINC000657836351 1029684086 /nfs/dbraw/zinc/68/40/86/1029684086.db2.gz KOTZOCDZRNHMSB-INIZCTEOSA-N 2 0 336.470 4.238 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(Br)c(Cl)c2)C1 ZINC000657840428 1029748233 /nfs/dbraw/zinc/74/82/33/1029748233.db2.gz GHSFFXIHYYXJAN-NWDGAFQWSA-N 2 0 345.712 4.095 20 0 EIADRP Cc1ccnc(N[C@H]2CC[N@H+](Cc3ccc(C(F)(F)F)cc3)C2)c1 ZINC000301632376 1029777770 /nfs/dbraw/zinc/77/77/70/1029777770.db2.gz JQKSMMRSCSKSNB-INIZCTEOSA-N 2 0 335.373 4.095 20 0 EIADRP FC(F)Oc1ccc(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)cc1Cl ZINC000092073917 1029898517 /nfs/dbraw/zinc/89/85/17/1029898517.db2.gz NMLJQVHCWHLZHB-GFCCVEGCSA-N 2 0 341.789 4.044 20 0 EIADRP c1c[nH]c([C@@H]2CCC[N@@H+](Cc3cccc(OC4CCCC4)c3)C2)n1 ZINC000092071786 1029898729 /nfs/dbraw/zinc/89/87/29/1029898729.db2.gz BCQXMTYGFARYCR-QGZVFWFLSA-N 2 0 325.456 4.111 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](C[C@H]2CCCCN2C(C)C)CC1 ZINC000450722133 1029914584 /nfs/dbraw/zinc/91/45/84/1029914584.db2.gz ZGLGKRSIXXCLBP-OAQYLSRUSA-N 2 0 337.596 4.083 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1ccc(F)cn1 ZINC000092739140 1029929298 /nfs/dbraw/zinc/92/92/98/1029929298.db2.gz FAVFYQFERZQTQI-IRXDYDNUSA-N 2 0 341.474 4.303 20 0 EIADRP COc1cc(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)ccc1Cl ZINC000450728073 1029933482 /nfs/dbraw/zinc/93/34/82/1029933482.db2.gz NYJVSADYNSVNNL-GOEBONIOSA-N 2 0 336.907 4.091 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(Br)c(Cl)c1 ZINC000657874204 1030133191 /nfs/dbraw/zinc/13/31/91/1030133191.db2.gz YHRKKVQYFPCNQU-LLVKDONJSA-N 2 0 345.712 4.095 20 0 EIADRP FCC1(CF)CC([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)C1 ZINC000657880506 1030157578 /nfs/dbraw/zinc/15/75/78/1030157578.db2.gz SHYICOFFXZFYHI-UHFFFAOYSA-N 2 0 336.470 4.240 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(Cl)ccc1OC ZINC000447559107 1030168968 /nfs/dbraw/zinc/16/89/68/1030168968.db2.gz RQSQZFBIEKUFQI-SFHVURJKSA-N 2 0 336.907 4.264 20 0 EIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@@H]1CCCSCC1 ZINC000657886231 1030195894 /nfs/dbraw/zinc/19/58/94/1030195894.db2.gz DAPARUZNSYJASG-LJQANCHMSA-N 2 0 344.524 4.287 20 0 EIADRP CCOc1cccc2cc([C@H](C)[NH2+]CC3CC[NH+](C4CC4)CC3)oc21 ZINC000447576885 1030203131 /nfs/dbraw/zinc/20/31/31/1030203131.db2.gz DCYDFMSANMXBAE-HNNXBMFYSA-N 2 0 342.483 4.357 20 0 EIADRP Cc1[nH]c2ccc(F)cc2c1CC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000530221300 1030215289 /nfs/dbraw/zinc/21/52/89/1030215289.db2.gz OWOYZLQOHLVMQA-YSIASYRMSA-N 2 0 343.490 4.058 20 0 EIADRP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2C[N@H+](C)C[C@H]2c2ccccc2)cc1 ZINC000647344347 1030224935 /nfs/dbraw/zinc/22/49/35/1030224935.db2.gz ORNJGPBDNFQWMI-ZNLUXHQJSA-N 2 0 338.495 4.081 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc3cc(OC)ccc3c2)CC1 ZINC000391965504 1030233411 /nfs/dbraw/zinc/23/34/11/1030233411.db2.gz FOPHICXFAAESIH-INIZCTEOSA-N 2 0 326.484 4.231 20 0 EIADRP Cc1ccc2[nH+]ccc(N3CCC(Oc4ccncc4C)CC3)c2c1 ZINC000447682153 1030273330 /nfs/dbraw/zinc/27/33/30/1030273330.db2.gz VZOINHGELIQROT-UHFFFAOYSA-N 2 0 333.435 4.294 20 0 EIADRP C/C=C/COc1ccc(CC[C@H](C)[NH2+]C[C@H]2CC[N@@H+](C(C)C)C2)cc1 ZINC000685455688 1030340529 /nfs/dbraw/zinc/34/05/29/1030340529.db2.gz LFXUHYOGVFTFRB-FZUCFXCGSA-N 2 0 344.543 4.283 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)CC1 ZINC000121759825 1030370676 /nfs/dbraw/zinc/37/06/76/1030370676.db2.gz PABLGBPLCDTWKS-IBGZPJMESA-N 2 0 328.500 4.145 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H](C)c2cc3cnccc3o2)CC1 ZINC000657902241 1030409999 /nfs/dbraw/zinc/40/99/99/1030409999.db2.gz XXSWUFZMQGMEKH-INIZCTEOSA-N 2 0 329.488 4.237 20 0 EIADRP CCOC1CCC([NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000657907437 1030456971 /nfs/dbraw/zinc/45/69/71/1030456971.db2.gz LUOSNXNSQHMMSV-IGBVOLGGSA-N 2 0 344.543 4.080 20 0 EIADRP CCC[NH+]1CCC([NH2+]C/C(C)=C/c2ccccc2OC(F)F)CC1 ZINC000685612448 1030561370 /nfs/dbraw/zinc/56/13/70/1030561370.db2.gz SXBYKIVUINEXMW-FYWRMAATSA-N 2 0 338.442 4.155 20 0 EIADRP CSc1ccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)s1 ZINC000685614101 1030565049 /nfs/dbraw/zinc/56/50/49/1030565049.db2.gz HAHMKBMUZGRERF-QGZVFWFLSA-N 2 0 346.565 4.472 20 0 EIADRP COC[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cccc(Cl)c1 ZINC000685645167 1030613509 /nfs/dbraw/zinc/61/35/09/1030613509.db2.gz KLIOHYXLUTZTLB-VQIMIIECSA-N 2 0 338.923 4.129 20 0 EIADRP C[C@H]1C[C@H]([N@H+](C)CCCOc2cccc3ccccc32)CCN1C ZINC000530666369 1030617958 /nfs/dbraw/zinc/61/79/58/1030617958.db2.gz UVVGMLFIWSWFHE-PKOBYXMFSA-N 2 0 326.484 4.023 20 0 EIADRP CCOC1CCC([NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000657933748 1030630299 /nfs/dbraw/zinc/63/02/99/1030630299.db2.gz VFCDYNUWTHIUGV-UBHSMVFVSA-N 2 0 344.543 4.224 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2CCCSCC2)C[N@@H+]1Cc1ccccc1 ZINC000657934217 1030634223 /nfs/dbraw/zinc/63/42/23/1030634223.db2.gz ZZRLTWMYIHHYPQ-YZGWKJHDSA-N 2 0 332.557 4.162 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)cc1 ZINC000527348868 1030638153 /nfs/dbraw/zinc/63/81/53/1030638153.db2.gz BSHMWCCXLXWXSK-LEWJYISDSA-N 2 0 338.495 4.053 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1cc[n+](C[C@@H]2CCC3(CCCCC3)O2)cc1 ZINC000191699569 1030653488 /nfs/dbraw/zinc/65/34/88/1030653488.db2.gz UEPZIYZFRQBTPZ-FPOVZHCZSA-N 2 0 343.535 4.230 20 0 EIADRP COCC1(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CCCCC1 ZINC000685665273 1030665124 /nfs/dbraw/zinc/66/51/24/1030665124.db2.gz QERVGKLNGHBMDL-FPOVZHCZSA-N 2 0 344.543 4.084 20 0 EIADRP CN1CCC[C@H](C[NH2+]Cc2ccc3cc[nH]c3c2)[C@H]1c1cccs1 ZINC000527669032 1030807107 /nfs/dbraw/zinc/80/71/07/1030807107.db2.gz WSPZSNIJISZGCE-XLIONFOSSA-N 2 0 339.508 4.402 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21)c1ccccn1 ZINC000658066538 1030813871 /nfs/dbraw/zinc/81/38/71/1030813871.db2.gz MJXQFIANKRHLSJ-URHOCTSQSA-N 2 0 349.522 4.218 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)c2ccccc21 ZINC000658070001 1030815471 /nfs/dbraw/zinc/81/54/71/1030815471.db2.gz SNSVLWCDJBTGDT-VGSWGCGISA-N 2 0 342.527 4.106 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)[C@@H]1CCCC[C@H]1C ZINC000658164163 1030860816 /nfs/dbraw/zinc/86/08/16/1030860816.db2.gz MUAAOPDCAGWDCV-LVCYWYKZSA-N 2 0 329.532 4.098 20 0 EIADRP Cc1ccc([C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C2CC2)cc1 ZINC000658165440 1030862142 /nfs/dbraw/zinc/86/21/42/1030862142.db2.gz JQKRLMJYUKRXSN-QHCPKHFHSA-N 2 0 349.522 4.343 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c(C)c1 ZINC000658164482 1030862467 /nfs/dbraw/zinc/86/24/67/1030862467.db2.gz DRAQXNMPOQRMNO-LJQANCHMSA-N 2 0 337.511 4.261 20 0 EIADRP Cc1cc(C)cc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000658168808 1030863737 /nfs/dbraw/zinc/86/37/37/1030863737.db2.gz ZELSEUJFOBSYHK-LJQANCHMSA-N 2 0 337.511 4.261 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c2ccccc21 ZINC000658168408 1030865504 /nfs/dbraw/zinc/86/55/04/1030865504.db2.gz WVNFJHVNUUIYHA-HTAPYJJXSA-N 2 0 335.495 4.132 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC[C@@]2(C)CC2(F)F)CC1 ZINC000658220206 1030885607 /nfs/dbraw/zinc/88/56/07/1030885607.db2.gz KNETZZVOTAPNIG-LPHOPBHVSA-N 2 0 336.470 4.107 20 0 EIADRP Cc1cccc([C@H]([NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)C(C)C)c1 ZINC000527874633 1030890231 /nfs/dbraw/zinc/89/02/31/1030890231.db2.gz XIKGNLLSGSCFIK-BHDDXSALSA-N 2 0 344.543 4.050 20 0 EIADRP C[C@H]([NH2+]C1CCC2(CC2(F)F)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000658265790 1030922027 /nfs/dbraw/zinc/92/20/27/1030922027.db2.gz PXOAUMDXURDDIG-FVPXHTFXSA-N 2 0 348.481 4.455 20 0 EIADRP C[C@H]([NH2+]C(CCC(F)(F)F)CCC(F)(F)F)C1CC[NH+](C)CC1 ZINC000658252614 1030924602 /nfs/dbraw/zinc/92/46/02/1030924602.db2.gz FSMQWNWRQNDULQ-NSHDSACASA-N 2 0 348.375 4.360 20 0 EIADRP Cc1c[nH+]ccc1N([C@H](C)Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001168191049 1030930076 /nfs/dbraw/zinc/93/00/76/1030930076.db2.gz FBSBLSSYDQSMKB-MRXNPFEDSA-N 2 0 343.902 4.233 20 0 EIADRP C[C@H](Cc1ccoc1)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658317266 1030980712 /nfs/dbraw/zinc/98/07/12/1030980712.db2.gz KBPMAQSBOBACFD-NQIIRXRSSA-N 2 0 338.495 4.103 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cccnc1 ZINC000658320505 1030983899 /nfs/dbraw/zinc/98/38/99/1030983899.db2.gz YWLGNKGGFLMZFN-GHTZIAJQSA-N 2 0 335.495 4.035 20 0 EIADRP C[C@H]([NH2+][C@@H](c1ccccn1)C1CCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000527964486 1031006807 /nfs/dbraw/zinc/00/68/07/1031006807.db2.gz KSCRHKLTRJXPFS-QTGUNEKASA-N 2 0 349.522 4.423 20 0 EIADRP Fc1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](CC3CC3)CC1)CCS2 ZINC000658356257 1031023723 /nfs/dbraw/zinc/02/37/23/1031023723.db2.gz NCRCXDLKQBLNFA-SFHVURJKSA-N 2 0 334.504 4.074 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cccc(OC(F)F)c1 ZINC000658356883 1031026508 /nfs/dbraw/zinc/02/65/08/1031026508.db2.gz PZYVJOHKVQREPD-AWEZNQCLSA-N 2 0 338.442 4.061 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)s1 ZINC000171130331 1031192063 /nfs/dbraw/zinc/19/20/63/1031192063.db2.gz ITGLLYZRZQTZSV-INIZCTEOSA-N 2 0 332.513 4.238 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)C1CCOCC1 ZINC000532485240 1031218774 /nfs/dbraw/zinc/21/87/74/1031218774.db2.gz SSISJOGOKSNCJK-JOCHJYFZSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCOC3(CCC3)C2)C1 ZINC000449082167 1031437798 /nfs/dbraw/zinc/43/77/98/1031437798.db2.gz LFFHJTMAZISQNL-GHTZIAJQSA-N 2 0 342.527 4.110 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2cc3cccnc3o2)C1 ZINC000449081957 1031438643 /nfs/dbraw/zinc/43/86/43/1031438643.db2.gz JEHKNPJIMDAVFH-QGZVFWFLSA-N 2 0 349.478 4.350 20 0 EIADRP COc1cccc2c(C[NH2+]C3CC[NH+](C(C)(C)C)CC3)cccc12 ZINC000449093659 1031455082 /nfs/dbraw/zinc/45/50/82/1031455082.db2.gz WVNAHLOLOXPPJZ-UHFFFAOYSA-N 2 0 326.484 4.201 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C)C1CCOCC1 ZINC000531682143 1031475086 /nfs/dbraw/zinc/47/50/86/1031475086.db2.gz HNOMNZUCSCQWCA-XMSQKQJNSA-N 2 0 344.543 4.356 20 0 EIADRP CC[C@H]([NH2+]CC1(N[C@H](C)c2ccccc2)CCOCC1)C1CCC1 ZINC000449155197 1031485353 /nfs/dbraw/zinc/48/53/53/1031485353.db2.gz KNYXFAHVINABJS-XLIONFOSSA-N 2 0 330.516 4.055 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000531705062 1031490777 /nfs/dbraw/zinc/49/07/77/1031490777.db2.gz YZMWSDQJKPJMRE-NRFANRHFSA-N 2 0 344.474 4.397 20 0 EIADRP C[C@H](Cc1ccncc1)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449171458 1031491524 /nfs/dbraw/zinc/49/15/24/1031491524.db2.gz KOCXTUILDTVHOL-QGZVFWFLSA-N 2 0 331.548 4.281 20 0 EIADRP Cc1noc(C)c1C[C@H](C)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449164153 1031504262 /nfs/dbraw/zinc/50/42/62/1031504262.db2.gz YEWHEYGESHBXOM-HNNXBMFYSA-N 2 0 349.563 4.491 20 0 EIADRP CCC[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)C1CCCC1 ZINC000449177864 1031515567 /nfs/dbraw/zinc/51/55/67/1031515567.db2.gz RACORIWICBHMCS-JOCHJYFZSA-N 2 0 344.543 4.092 20 0 EIADRP CCO[C@H](CC[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1)C(C)C ZINC000449180792 1031520220 /nfs/dbraw/zinc/52/02/20/1031520220.db2.gz CCTVAUJPHYYWEH-DENIHFKCSA-N 2 0 346.559 4.123 20 0 EIADRP CC(C)OCCCC[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449236072 1031550234 /nfs/dbraw/zinc/55/02/34/1031550234.db2.gz WVDNTHCDUUDFGB-UHFFFAOYSA-N 2 0 326.569 4.460 20 0 EIADRP C[C@H](CCCc1cccnc1)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000453075291 1031556554 /nfs/dbraw/zinc/55/65/54/1031556554.db2.gz HJWKZVIZIPVOQU-LJQANCHMSA-N 2 0 337.511 4.178 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC(NC2CC([NH+]3CCCCC3)C2)CC1 ZINC000449297097 1031604957 /nfs/dbraw/zinc/60/49/57/1031604957.db2.gz DZCHFOGFRWULRD-UHFFFAOYSA-N 2 0 349.607 4.272 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H](C)CCCc2cccnc2)CC1 ZINC000453134437 1031638998 /nfs/dbraw/zinc/63/89/98/1031638998.db2.gz RXXDQTCIKTWWIQ-IBGZPJMESA-N 2 0 331.548 4.141 20 0 EIADRP C[C@H](c1ccncc1)N1CCC([NH2+]C2CCc3ccccc3CC2)CC1 ZINC000453174809 1031646981 /nfs/dbraw/zinc/64/69/81/1031646981.db2.gz PCWJSJOEUBWCAK-GOSISDBHSA-N 2 0 349.522 4.144 20 0 EIADRP FC(F)C1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)CC1 ZINC000453228678 1031747733 /nfs/dbraw/zinc/74/77/33/1031747733.db2.gz UTBGRQFFYXVERG-KURKYZTESA-N 2 0 334.454 4.065 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+][C@@H]3CCc4ccccc43)CC2)c1 ZINC000531950209 1031864458 /nfs/dbraw/zinc/86/44/58/1031864458.db2.gz IBQIRCZLMZMMSE-HXUWFJFHSA-N 2 0 326.509 4.237 20 0 EIADRP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]C1CCN(c2ccccc2)CC1 ZINC000531979746 1031921725 /nfs/dbraw/zinc/92/17/25/1031921725.db2.gz OPTABOOIXBGRHC-KNQAVFIVSA-N 2 0 343.559 4.146 20 0 EIADRP Cc1cccc([C@H](NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2cccc(F)c2)c1 ZINC000453376692 1031926659 /nfs/dbraw/zinc/92/66/59/1031926659.db2.gz YRFNHFSVELKRSZ-KBRMVUAJSA-N 2 0 338.470 4.438 20 0 EIADRP CCN(c1ccccc1)c1ccc(C[NH2+][C@H]2CC[N@H+](C)C[C@@H]2C)cc1 ZINC000531980181 1031928601 /nfs/dbraw/zinc/92/86/01/1031928601.db2.gz AOEPSNZGRMTPHM-AVRDEDQJSA-N 2 0 337.511 4.274 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(Br)c(F)c1 ZINC000453401359 1031935884 /nfs/dbraw/zinc/93/58/84/1031935884.db2.gz MSIRZNWMLDXLNR-LBPRGKRZSA-N 2 0 343.284 4.113 20 0 EIADRP Cc1cccc([C@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)c1 ZINC000453408962 1031944762 /nfs/dbraw/zinc/94/47/62/1031944762.db2.gz WDWORXQOQJFWLT-ROUUACIJSA-N 2 0 326.484 4.347 20 0 EIADRP C[C@H]1Cc2ccc(F)cc2[C@H]1[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000531993865 1031960392 /nfs/dbraw/zinc/96/03/92/1031960392.db2.gz CLAQBNDNXQCGCH-BTYIYWSLSA-N 2 0 330.491 4.446 20 0 EIADRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]CCCC[N@H+](C)C2CC2)c1 ZINC000453397433 1031964482 /nfs/dbraw/zinc/96/44/82/1031964482.db2.gz JLUHOZONFVCWPQ-AWEZNQCLSA-N 2 0 326.431 4.121 20 0 EIADRP Clc1ccc2c(c1Cl)CC[C@@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000152482700 1031985069 /nfs/dbraw/zinc/98/50/69/1031985069.db2.gz VEJXYTHYOAXBBJ-BZNIZROVSA-N 2 0 325.283 4.055 20 0 EIADRP C[C@@H](CCN[C@@H](C)c1ccc(Cl)nc1)[N@H+](C)Cc1ccccc1 ZINC000179135341 1032015398 /nfs/dbraw/zinc/01/53/98/1032015398.db2.gz ZMHJBOORUBZAJO-HOTGVXAUSA-N 2 0 331.891 4.296 20 0 EIADRP CCO[C@H](C[NH2+][C@@H](C)c1ccc(-n2ccnc2)cc1)c1ccccc1 ZINC000193431116 1032048267 /nfs/dbraw/zinc/04/82/67/1032048267.db2.gz SCQMKIKEOFCBHW-LAUBAEHRSA-N 2 0 335.451 4.301 20 0 EIADRP [NH2+]=C(Nc1ccc(-c2ccc(C(F)(F)F)cc2)cc1)SCC[NH3+] ZINC001167912268 1033328466 /nfs/dbraw/zinc/32/84/66/1033328466.db2.gz LYLYOLYFYPABIE-UHFFFAOYSA-N 2 0 339.386 4.411 20 0 EIADRP Brc1ccccc1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC000500889925 1033952323 /nfs/dbraw/zinc/95/23/23/1033952323.db2.gz MJSAUGDIPRSCPU-UHFFFAOYSA-N 2 0 339.321 4.195 20 0 EIADRP FC(F)(F)c1cccc(C[NH2+]CCCCC[NH+]2CCCCC2)c1 ZINC000500901258 1034015873 /nfs/dbraw/zinc/01/58/73/1034015873.db2.gz UGOUZHDVWQFINS-UHFFFAOYSA-N 2 0 328.422 4.451 20 0 EIADRP c1cc(C[NH+]2CCC(OC3CCC3)CC2)ccc1C[NH+]1CCCCC1 ZINC000419298677 1034106424 /nfs/dbraw/zinc/10/64/24/1034106424.db2.gz GSWHTZUBSIJSIQ-UHFFFAOYSA-N 2 0 342.527 4.206 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2nccc3ccccc32)cc1 ZINC000894153486 1034378358 /nfs/dbraw/zinc/37/83/58/1034378358.db2.gz JFLUJSLJLZZCJC-UHFFFAOYSA-N 2 0 333.479 4.366 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000333303412 1034627767 /nfs/dbraw/zinc/62/77/67/1034627767.db2.gz QLCMFRXPUSOVPY-XJKCOSOUSA-N 2 0 345.487 4.186 20 0 EIADRP Cc1cc(NC2CC[NH+](CCc3ccccc3)CC2)c2ccccc2[nH+]1 ZINC000513155072 1034694105 /nfs/dbraw/zinc/69/41/05/1034694105.db2.gz OFDCKZIDDZSLIU-UHFFFAOYSA-N 2 0 345.490 4.084 20 0 EIADRP CCC(CC)[C@@H]1C[C@@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)CCO1 ZINC000513414547 1034932604 /nfs/dbraw/zinc/93/26/04/1034932604.db2.gz OHAVKTNDUUTKGT-FPOVZHCZSA-N 2 0 336.564 4.357 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+]Cc2cc3ccnc(Cl)c3s2)C1 ZINC000894242021 1035307889 /nfs/dbraw/zinc/30/78/89/1035307889.db2.gz QSHBQICFSUEPQO-CYBMUJFWSA-N 2 0 337.920 4.160 20 0 EIADRP CCC(CC)[C@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccccc1 ZINC000501008008 1035342966 /nfs/dbraw/zinc/34/29/66/1035342966.db2.gz OUOILPPHOBXNQC-QFIPXVFZSA-N 2 0 345.575 4.170 20 0 EIADRP C[C@H](c1ccc(F)cc1F)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501025552 1035353298 /nfs/dbraw/zinc/35/32/98/1035353298.db2.gz ZCJNWSGJTFBVJI-OAHLLOKOSA-N 2 0 345.437 4.269 20 0 EIADRP CCC[N@H+](CCCN1CC[NH+](C(C)C)CC1)[C@@H](CC)c1ccccc1 ZINC000501103161 1035378191 /nfs/dbraw/zinc/37/81/91/1035378191.db2.gz FXSMZVADRBDRNR-QFIPXVFZSA-N 2 0 345.575 4.266 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000501427109 1035443471 /nfs/dbraw/zinc/44/34/71/1035443471.db2.gz VSRGTVVKGNWPIA-INIZCTEOSA-N 2 0 344.449 4.028 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)CC[N@@H+]1C ZINC000501465713 1035449250 /nfs/dbraw/zinc/44/92/50/1035449250.db2.gz GLQWXKQJLVHTFW-YWZLYKJASA-N 2 0 344.449 4.169 20 0 EIADRP CC[C@@H]([NH2+]C1CC[NH+](C(C)C)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000513717753 1035483470 /nfs/dbraw/zinc/48/34/70/1035483470.db2.gz RMMFHLQOYNNGQP-QGZVFWFLSA-N 2 0 344.421 4.499 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[N@H+](C)CC[C@@H]2CC[NH2+]C2)cc1 ZINC000420294553 1035492621 /nfs/dbraw/zinc/49/26/21/1035492621.db2.gz BBEGUNNBGNMCFG-ROUUACIJSA-N 2 0 338.495 4.355 20 0 EIADRP Cc1cc(C)c(CN(Cc2ccccn2)[C@H]2CCC[NH2+]CC2)c(C)c1 ZINC000420315546 1035508354 /nfs/dbraw/zinc/50/83/54/1035508354.db2.gz RXONFSSLNVFCKM-NRFANRHFSA-N 2 0 337.511 4.151 20 0 EIADRP Cc1sc([C@H](C)[NH2+]CC[C@H]2CC[NH2+]C2)nc1-c1ccc(Cl)cc1 ZINC000420402241 1035576016 /nfs/dbraw/zinc/57/60/16/1035576016.db2.gz JXTADDPLBLRPPL-GXTWGEPZSA-N 2 0 349.931 4.422 20 0 EIADRP CCSC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000595100648 1035587840 /nfs/dbraw/zinc/58/78/40/1035587840.db2.gz TZVMMMIWIGCNDQ-LDLYASANSA-N 2 0 330.541 4.057 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)c1ccc2ccccc2c1OC(F)F ZINC000575114927 1035705825 /nfs/dbraw/zinc/70/58/25/1035705825.db2.gz MEXKHGGGSCSKCL-CYBMUJFWSA-N 2 0 334.410 4.091 20 0 EIADRP CCOc1cc(C[NH2+]C2CCC([NH+](C)C)CC2)ccc1OCC(C)C ZINC000421376624 1036325249 /nfs/dbraw/zinc/32/52/49/1036325249.db2.gz RTKBROMGVMYBTJ-UHFFFAOYSA-N 2 0 348.531 4.083 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2ccc(F)cc2F)CCCC1 ZINC000486079827 1036465055 /nfs/dbraw/zinc/46/50/55/1036465055.db2.gz QGLMYQLUFRVJFR-SPYBWZPUSA-N 2 0 336.470 4.095 20 0 EIADRP CCc1cccc2c(C3CC[NH+](CC[C@@H]4CCC[N@@H+]4C)CC3)c[nH]c21 ZINC000502690547 1036488110 /nfs/dbraw/zinc/48/81/10/1036488110.db2.gz VCMZQHYAALZGDH-IBGZPJMESA-N 2 0 339.527 4.394 20 0 EIADRP COCC[C@H]1CCC[C@H]1[NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000502697629 1036513467 /nfs/dbraw/zinc/51/34/67/1036513467.db2.gz PHMFSEYJZSACGQ-FGZHOGPDSA-N 2 0 344.543 4.213 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)c2cc(C)c(C)o2)cc1 ZINC000502700730 1036528183 /nfs/dbraw/zinc/52/81/83/1036528183.db2.gz RIFUQVQELWPWDS-QGZVFWFLSA-N 2 0 344.499 4.468 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000502710997 1036569378 /nfs/dbraw/zinc/56/93/78/1036569378.db2.gz ZSXSMSZQCHJROS-UGKGYDQZSA-N 2 0 344.543 4.357 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccncc1Cl ZINC000421825259 1036783217 /nfs/dbraw/zinc/78/32/17/1036783217.db2.gz MQHCXRRUIRMLFN-CQSZACIVSA-N 2 0 349.931 4.359 20 0 EIADRP C[C@@H]1CN(C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000572526519 1036786722 /nfs/dbraw/zinc/78/67/22/1036786722.db2.gz HHOKKCMPDOCUNR-KDOFPFPSSA-N 2 0 332.488 4.326 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccncc2Cl)c1 ZINC000421818759 1036804204 /nfs/dbraw/zinc/80/42/04/1036804204.db2.gz CIJKMLXPQSLUGC-HNNXBMFYSA-N 2 0 331.891 4.428 20 0 EIADRP COc1cc(Cl)ccc1[C@@H](C)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000421820219 1036804212 /nfs/dbraw/zinc/80/42/12/1036804212.db2.gz LJVVGLGIDWWJTC-CQSZACIVSA-N 2 0 332.875 4.261 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)cc1 ZINC000613259559 1036810656 /nfs/dbraw/zinc/81/06/56/1036810656.db2.gz IDWWLSJWMUCYDL-SLFFLAALSA-N 2 0 330.516 4.076 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000572712714 1036812160 /nfs/dbraw/zinc/81/21/60/1036812160.db2.gz YJJHZLRJULOQAC-QANKJYHBSA-N 2 0 343.902 4.489 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000572712713 1036812174 /nfs/dbraw/zinc/81/21/74/1036812174.db2.gz YJJHZLRJULOQAC-OWQGQXMQSA-N 2 0 343.902 4.489 20 0 EIADRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]C2CCC([NH+](C)C)CC2)c1 ZINC000421879070 1036828135 /nfs/dbraw/zinc/82/81/35/1036828135.db2.gz OKTWBNUJFHZCIE-NFOMZHRRSA-N 2 0 326.431 4.120 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(F)cc1Br ZINC000421877815 1036828835 /nfs/dbraw/zinc/82/88/35/1036828835.db2.gz MMGQNMJUWPVIHC-XGNXJENSSA-N 2 0 343.284 4.112 20 0 EIADRP CC[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cccc(Br)c1 ZINC000421886119 1036832384 /nfs/dbraw/zinc/83/23/84/1036832384.db2.gz UZTAPEOOTIUVAV-JCYILVPMSA-N 2 0 339.321 4.363 20 0 EIADRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421869840 1036840031 /nfs/dbraw/zinc/84/00/31/1036840031.db2.gz DREYOAVTPNBLTI-IGEOTXOUSA-N 2 0 344.528 4.037 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+]C(C)(C)c2ccc(Cl)cc2)cc1 ZINC000589651349 1036860408 /nfs/dbraw/zinc/86/04/08/1036860408.db2.gz IWTVYVYNTNWCTD-UHFFFAOYSA-N 2 0 346.902 4.305 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CCc2cccc3[nH]ccc32)CCN1Cc1ccccc1 ZINC000503123232 1036923000 /nfs/dbraw/zinc/92/30/00/1036923000.db2.gz RMWSXKGBFUCZLY-RXVVDRJESA-N 2 0 347.506 4.353 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]C/C=C\c3ccncc3)cc2)C1 ZINC000486989683 1036937732 /nfs/dbraw/zinc/93/77/32/1036937732.db2.gz UUVHQLXZIUMBGJ-PYSGZSLQSA-N 2 0 349.522 4.363 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)C(C)(C)c1ccccc1 ZINC000590302444 1037038240 /nfs/dbraw/zinc/03/82/40/1037038240.db2.gz CWSJONKZVSJXFJ-SFHVURJKSA-N 2 0 340.511 4.083 20 0 EIADRP CCC(CC)[NH+]1CCC(C[NH2+][C@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168416433 1037243912 /nfs/dbraw/zinc/24/39/12/1037243912.db2.gz YBFWUZJJGMQLBZ-FQEVSTJZSA-N 2 0 332.507 4.173 20 0 EIADRP Cc1cnc([C@H](C)C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)s1 ZINC000273508582 1037487683 /nfs/dbraw/zinc/48/76/83/1037487683.db2.gz ZZDNCGACKAIKLA-JTDSTZFVSA-N 2 0 343.540 4.055 20 0 EIADRP [NH3+]C[C@H]1CC[N@H+](Cc2ccc(-c3ccc(C(F)(F)F)cc3)s2)C1 ZINC000414652227 1037673967 /nfs/dbraw/zinc/67/39/67/1037673967.db2.gz GRXVTSFACPKPTG-GFCCVEGCSA-N 2 0 340.414 4.215 20 0 EIADRP C[C@H](C[NH+]1CCC([NH2+]CC2CC2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000414656218 1037687824 /nfs/dbraw/zinc/68/78/24/1037687824.db2.gz IBFGERGGWSJRFX-CQSZACIVSA-N 2 0 340.433 4.273 20 0 EIADRP C[C@@H]([NH3+])C1CC[NH+](Cc2ccc(-c3nc4ccccc4s3)o2)CC1 ZINC000414673637 1037777756 /nfs/dbraw/zinc/77/77/56/1037777756.db2.gz PBHILGGOELGSMC-CYBMUJFWSA-N 2 0 341.480 4.116 20 0 EIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+][C@H](C)CCCC[NH3+])cc1 ZINC000422714174 1037811454 /nfs/dbraw/zinc/81/14/54/1037811454.db2.gz KTJNLWMAMIYZGC-IERDGZPVSA-N 2 0 344.474 4.225 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@H](C)C[C@H](C)[NH3+])ccc1OCc1ccccc1 ZINC000422717316 1037814231 /nfs/dbraw/zinc/81/42/31/1037814231.db2.gz KQLDEQYVZVUOHS-BBWFWOEESA-N 2 0 342.483 4.051 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@H](C)CCC[NH3+])ccc1OCc1ccccc1 ZINC000422723127 1037815693 /nfs/dbraw/zinc/81/56/93/1037815693.db2.gz QJBJPJWUIKPLMS-SJORKVTESA-N 2 0 342.483 4.052 20 0 EIADRP CCc1ccc([C@H]([NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)C(C)C)cc1 ZINC000422759203 1037818529 /nfs/dbraw/zinc/81/85/29/1037818529.db2.gz FPXNKDCIYIGWQN-HRAATJIYSA-N 2 0 325.500 4.459 20 0 EIADRP Cc1[nH]c2c(cc(C)cc2C[NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)c1C ZINC000422741507 1037821974 /nfs/dbraw/zinc/82/19/74/1037821974.db2.gz OQJGMKSMQMTUIC-HNNXBMFYSA-N 2 0 336.483 4.106 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC1(c2cccs2)CCCCC1 ZINC000422751755 1037825707 /nfs/dbraw/zinc/82/57/07/1037825707.db2.gz ACJSUGRFBIKKMS-OAHLLOKOSA-N 2 0 343.540 4.463 20 0 EIADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCCCSc1ccccc1Br ZINC000422750228 1037825855 /nfs/dbraw/zinc/82/58/55/1037825855.db2.gz CLQMNMQXPMHHBC-OLZOCXBDSA-N 2 0 345.350 4.037 20 0 EIADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](C)c1ccccc1-c1ccc(Cl)cc1 ZINC000422774488 1037830151 /nfs/dbraw/zinc/83/01/51/1037830151.db2.gz XEYRERVEHMWDAG-CRAIPNDOSA-N 2 0 346.902 4.412 20 0 EIADRP CC[C@@H]([NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)C(C)(C)c1ccccc1 ZINC000422784780 1037833277 /nfs/dbraw/zinc/83/32/77/1037833277.db2.gz OOGXLQYJNQUZEW-OXJNMPFZSA-N 2 0 325.500 4.256 20 0 EIADRP C[C@H](CC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc(C(F)(F)F)c1 ZINC000422814879 1037835556 /nfs/dbraw/zinc/83/55/56/1037835556.db2.gz WIHNPOKDTOIZEH-AJSFGMTHSA-N 2 0 326.406 4.072 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000422800114 1037835762 /nfs/dbraw/zinc/83/57/62/1037835762.db2.gz AUMPSWPXEUKPHC-NWDGAFQWSA-N 2 0 337.389 4.279 20 0 EIADRP CCOc1ccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C(C)C)cc1OCC ZINC000422799093 1037836142 /nfs/dbraw/zinc/83/61/42/1037836142.db2.gz VCUVILJYBODNJI-APZTZJSISA-N 2 0 346.515 4.054 20 0 EIADRP CC1CC[NH+](Cc2ccc(CN[C@@H]3C[C@@H]([NH3+])c4ccccc43)cc2)CC1 ZINC000422800321 1037836193 /nfs/dbraw/zinc/83/61/93/1037836193.db2.gz BGIKWOZIMUEWGY-DHIUTWEWSA-N 2 0 349.522 4.153 20 0 EIADRP FC(F)(F)[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000422820207 1037845640 /nfs/dbraw/zinc/84/56/40/1037845640.db2.gz PLLDBVLUUZSIPD-OVYGPGRDSA-N 2 0 332.454 4.256 20 0 EIADRP COc1cc([C@@H](C)[NH2+][C@H](C)CCCC[NH3+])ccc1OC1CCCC1 ZINC000422875744 1037850989 /nfs/dbraw/zinc/85/09/89/1037850989.db2.gz DBBNHFNYRYXUKH-HZPDHXFCSA-N 2 0 334.504 4.185 20 0 EIADRP c1[nH]c2ccccc2c1CCC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000422884128 1037853020 /nfs/dbraw/zinc/85/30/20/1037853020.db2.gz DLAYZTFKSFRCIK-HLAWJBBLSA-N 2 0 325.500 4.001 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H]1CCCOc2c(Cl)c(Cl)ccc21 ZINC000422905958 1037863197 /nfs/dbraw/zinc/86/31/97/1037863197.db2.gz SYFAWINIUWXXBZ-SMDDNHRTSA-N 2 0 331.287 4.314 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1CCCOc2c(Cl)c(Cl)ccc21 ZINC000422905956 1037863339 /nfs/dbraw/zinc/86/33/39/1037863339.db2.gz SYFAWINIUWXXBZ-FZMZJTMJSA-N 2 0 331.287 4.314 20 0 EIADRP Cc1cc(C)cc([C@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422891480 1037868740 /nfs/dbraw/zinc/86/87/40/1037868740.db2.gz VKPCHDXDGVPKFG-RBDMOPTHSA-N 2 0 336.479 4.210 20 0 EIADRP CC[C@@H](C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)Oc1cccc(Cl)c1 ZINC000422927383 1037870963 /nfs/dbraw/zinc/87/09/63/1037870963.db2.gz GKJPMZSJTQCCLK-GUYCJALGSA-N 2 0 347.890 4.010 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1(c2ccc(Cl)cc2)CCC1 ZINC000422936051 1037873892 /nfs/dbraw/zinc/87/38/92/1037873892.db2.gz HUMVEEVVFAHHLX-AWEZNQCLSA-N 2 0 329.875 4.232 20 0 EIADRP c1ccc2c(c1)C1C[C@@H](C[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)C2c2ccccc21 ZINC000422939133 1037875574 /nfs/dbraw/zinc/87/55/74/1037875574.db2.gz HULRKNHKSUBHCE-MEHXZCLSSA-N 2 0 344.502 4.156 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCCCOc1ccc(Cl)cc1 ZINC000422942938 1037877820 /nfs/dbraw/zinc/87/78/20/1037877820.db2.gz XESSXWQFMVIWBZ-CQSZACIVSA-N 2 0 347.890 4.012 20 0 EIADRP COc1cc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)ccc1OCCC(C)C ZINC000422949604 1037886957 /nfs/dbraw/zinc/88/69/57/1037886957.db2.gz UMKTZHGIZRNVEE-YJJAZYOBSA-N 2 0 346.515 4.054 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]C2CCC(C[NH3+])CC2)cc1OC ZINC000422949935 1037887889 /nfs/dbraw/zinc/88/78/89/1037887889.db2.gz VAAASDSYHYFDLU-KLHKWILBSA-N 2 0 334.504 4.042 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c2ccccc21 ZINC000423004708 1037899077 /nfs/dbraw/zinc/89/90/77/1037899077.db2.gz PUOPICHTKZLICW-QSABTFIQSA-N 2 0 348.490 4.471 20 0 EIADRP C[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423028932 1037912199 /nfs/dbraw/zinc/91/21/99/1037912199.db2.gz UCSFGSNXRYRQOC-AUKDSKBCSA-N 2 0 348.490 4.156 20 0 EIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@@H](C)c1ccccc1C(F)(F)F ZINC000423022684 1037912799 /nfs/dbraw/zinc/91/27/99/1037912799.db2.gz IEIHEQBJWKLZSN-ARJVPZMDSA-N 2 0 326.406 4.070 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1 ZINC000423063696 1037929091 /nfs/dbraw/zinc/92/90/91/1037929091.db2.gz XGUHLNUAGUTHKL-GVDBMIGSSA-N 2 0 326.406 4.024 20 0 EIADRP C[C@@H]1CC[NH2+]CC[C@H]1[NH2+][C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000423095004 1037952181 /nfs/dbraw/zinc/95/21/81/1037952181.db2.gz DATCRFHAJUVVQS-LSCFUAHRSA-N 2 0 327.299 4.217 20 0 EIADRP [NH3+][C@H]1C[C@@H]([NH2+]C2CC(F)(c3cccc(Cl)c3)C2)c2ccccc21 ZINC000423095218 1037954628 /nfs/dbraw/zinc/95/46/28/1037954628.db2.gz LQOVSEIZJIOQAA-MMZJAPOHSA-N 2 0 330.834 4.402 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1CC(c2ccc(F)c(Cl)c2)C1 ZINC000423099667 1037958712 /nfs/dbraw/zinc/95/87/12/1037958712.db2.gz MGEOSJPMBHURKK-YGONEPDPSA-N 2 0 347.865 4.238 20 0 EIADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000423098584 1037960199 /nfs/dbraw/zinc/96/01/99/1037960199.db2.gz SIXHXYLSYSZIGR-SKRQURTPSA-N 2 0 326.459 4.010 20 0 EIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]C2CCC(C[NH3+])CC2)cc1 ZINC000423120161 1037968292 /nfs/dbraw/zinc/96/82/92/1037968292.db2.gz FTTDFRYOWYCBAQ-ZNIKRAEXSA-N 2 0 338.495 4.086 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1cccs1 ZINC000423206062 1038039958 /nfs/dbraw/zinc/03/99/58/1038039958.db2.gz FRVBLFLVIUIHPP-RHSMWYFYSA-N 2 0 334.916 4.275 20 0 EIADRP Fc1ccc([C@@H](CCSc2ccccc2)[NH2+]C2CC[NH2+]CC2)cc1 ZINC000423195203 1038048979 /nfs/dbraw/zinc/04/89/79/1038048979.db2.gz YUIPSOHGVGXKLI-HXUWFJFHSA-N 2 0 344.499 4.391 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423203931 1038053116 /nfs/dbraw/zinc/05/31/16/1038053116.db2.gz CXTUSQOTRUBZMR-SJLPKXTDSA-N 2 0 342.458 4.055 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000423215639 1038058147 /nfs/dbraw/zinc/05/81/47/1038058147.db2.gz NGSVGBNIBQURLS-UJLSLHKQSA-N 2 0 331.287 4.009 20 0 EIADRP Cc1ccsc1C[N@H+](Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2 ZINC000414725637 1038058580 /nfs/dbraw/zinc/05/85/80/1038058580.db2.gz WPOBZUZQWCXBEP-KRWDZBQOSA-N 2 0 332.538 4.262 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc2cc(OC)ccc2c1 ZINC000423219275 1038061838 /nfs/dbraw/zinc/06/18/38/1038061838.db2.gz SZKPNLYKUGMAFF-ZRCAFCQKSA-N 2 0 326.484 4.277 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc2ccccc2c1OC(F)F ZINC000423248245 1038079741 /nfs/dbraw/zinc/07/97/41/1038079741.db2.gz MTLOIUHFQBFZOR-KBPBESRZSA-N 2 0 334.410 4.091 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc(Br)cc1 ZINC000423291673 1038095682 /nfs/dbraw/zinc/09/56/82/1038095682.db2.gz JIVDCMMZFGBHIA-QWHCGFSZSA-N 2 0 333.273 4.320 20 0 EIADRP CCC[C@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000489514569 1038096583 /nfs/dbraw/zinc/09/65/83/1038096583.db2.gz UVFSVOJTQCPTAK-FQEVSTJZSA-N 2 0 345.531 4.168 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)cc1 ZINC000423290070 1038096479 /nfs/dbraw/zinc/09/64/79/1038096479.db2.gz CHEOENVLQACINH-CHWSQXEVSA-N 2 0 338.373 4.456 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423321517 1038121415 /nfs/dbraw/zinc/12/14/15/1038121415.db2.gz GHHUJMJUCWJRSB-IFXJQAMLSA-N 2 0 329.513 4.159 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NCC1([NH3+])CCC1 ZINC000423323989 1038135182 /nfs/dbraw/zinc/13/51/82/1038135182.db2.gz JVIKBIBXQYIWBQ-NSHDSACASA-N 2 0 335.904 4.304 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+][C@H]2CCCc3cc(N)ccc32)cc1 ZINC000423344727 1038136049 /nfs/dbraw/zinc/13/60/49/1038136049.db2.gz FMNZFCLQCZPLAZ-QRQCRPRQSA-N 2 0 346.478 4.491 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423327558 1038140650 /nfs/dbraw/zinc/14/06/50/1038140650.db2.gz LKHAEOBCMTYFJT-DJJJIMSYSA-N 2 0 347.503 4.298 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423330352 1038143978 /nfs/dbraw/zinc/14/39/78/1038143978.db2.gz NPOILIUALLIMHE-QRWLVFNGSA-N 2 0 343.540 4.467 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]C[C@]3(C)CCC[NH2+]C3)cs2)cs1 ZINC000423339450 1038147641 /nfs/dbraw/zinc/14/76/41/1038147641.db2.gz VBVMKIWYFXSYFQ-YVEFUNNKSA-N 2 0 335.542 4.220 20 0 EIADRP FC(F)(F)c1ccc([C@H]2CCCC[C@@H]2[NH2+]CC2=CC[NH2+]CC2)cc1 ZINC000423349636 1038165000 /nfs/dbraw/zinc/16/50/00/1038165000.db2.gz XGPCEGGAXONKMC-MSOLQXFVSA-N 2 0 338.417 4.241 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[NH2+]C[C@@H]1C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423361231 1038177914 /nfs/dbraw/zinc/17/79/14/1038177914.db2.gz AAPQQHJPILMACV-DOXZYTNZSA-N 2 0 328.431 4.267 20 0 EIADRP Clc1ccc([C@@H]2CC[C@@H]([NH2+]Cc3ccc4c(c3)C[NH2+]C4)C2)cc1 ZINC000423370774 1038183238 /nfs/dbraw/zinc/18/32/38/1038183238.db2.gz FWAFVZJMMTZTNL-OXQOHEQNSA-N 2 0 326.871 4.369 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(OC(F)F)cc1 ZINC000423365199 1038184730 /nfs/dbraw/zinc/18/47/30/1038184730.db2.gz WGZAAPSXERNRNY-GOSISDBHSA-N 2 0 332.394 4.132 20 0 EIADRP CCOc1cccc2cc([C@@H](C)[NH2+]Cc3ccc4c(c3)C[NH2+]C4)oc21 ZINC000423367539 1038186811 /nfs/dbraw/zinc/18/68/11/1038186811.db2.gz CQLASYXOFQDGAQ-CQSZACIVSA-N 2 0 336.435 4.286 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)[C@@H](C)c1nc2ccccc2s1 ZINC000423375987 1038188666 /nfs/dbraw/zinc/18/86/66/1038188666.db2.gz IZBIUUGIOWINMV-ZIAGYGMSSA-N 2 0 337.492 4.181 20 0 EIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@H]3CCC[C@@H]([NH3+])C3)s2)cc1 ZINC000423370195 1038190035 /nfs/dbraw/zinc/19/00/35/1038190035.db2.gz FHXMZZHHMOTRTQ-MAZHCROVSA-N 2 0 345.512 4.048 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1csc(-c2ccccc2F)n1 ZINC000423422563 1038212619 /nfs/dbraw/zinc/21/26/19/1038212619.db2.gz LIJHKJMMIJAWNG-RBSFLKMASA-N 2 0 347.503 4.365 20 0 EIADRP COCC1(C[NH2+][C@@H](C)c2ccc(-c3ccccc3)s2)CC[NH2+]CC1 ZINC000423411972 1038217228 /nfs/dbraw/zinc/21/72/28/1038217228.db2.gz VWPJHLPNKWGTSS-INIZCTEOSA-N 2 0 344.524 4.082 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cc2cc(Br)ccc2o1 ZINC000423442016 1038226175 /nfs/dbraw/zinc/22/61/75/1038226175.db2.gz UQYXWHNRLVBYPL-NWDGAFQWSA-N 2 0 339.277 4.363 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccc(Oc2ccccc2)cn1 ZINC000423427408 1038230034 /nfs/dbraw/zinc/23/00/34/1038230034.db2.gz QETSQCSFWQJGAS-BZSNNMDCSA-N 2 0 339.483 4.290 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000423434432 1038235956 /nfs/dbraw/zinc/23/59/56/1038235956.db2.gz XZEXGDDIUBCDSC-KKUMJFAQSA-N 2 0 344.421 4.043 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)cc1OC ZINC000423455436 1038238166 /nfs/dbraw/zinc/23/81/66/1038238166.db2.gz FDQXYTBMLOMXPT-BQFCYCMXSA-N 2 0 334.504 4.042 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000423462743 1038240953 /nfs/dbraw/zinc/24/09/53/1038240953.db2.gz FAHORMJWIMWGMX-CFVMTHIKSA-N 2 0 347.503 4.426 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000423467913 1038244192 /nfs/dbraw/zinc/24/41/92/1038244192.db2.gz UPDCDSVKNBJSLC-OIISXLGYSA-N 2 0 341.524 4.295 20 0 EIADRP FCCC[C@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000423467449 1038244394 /nfs/dbraw/zinc/24/43/94/1038244394.db2.gz IYTMEFHQWWHVNF-BWPNAZKDSA-N 2 0 336.470 4.027 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423467250 1038245001 /nfs/dbraw/zinc/24/50/01/1038245001.db2.gz BIAHKUZYPOHTHJ-ZFWWWQNUSA-N 2 0 347.503 4.440 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]CCC[C@H]3CCC[NH2+]3)cs2)cs1 ZINC000423469571 1038245039 /nfs/dbraw/zinc/24/50/39/1038245039.db2.gz COSBYMXYXKBWDG-DOMZBBRYSA-N 2 0 335.542 4.363 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1ccccc1Br ZINC000423470706 1038246708 /nfs/dbraw/zinc/24/67/08/1038246708.db2.gz LTEQLBALCNCOBD-ZENOOKHLSA-N 2 0 325.294 4.007 20 0 EIADRP Brc1ccc([C@@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)C2CC2)cc1 ZINC000423480982 1038251521 /nfs/dbraw/zinc/25/15/21/1038251521.db2.gz NVXUVOMWRHNOIS-IRXDYDNUSA-N 2 0 337.305 4.022 20 0 EIADRP CSC[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(C(F)(F)F)cc1 ZINC000423480505 1038252144 /nfs/dbraw/zinc/25/21/44/1038252144.db2.gz NJUGFOXPQQYSSJ-HOTGVXAUSA-N 2 0 346.462 4.231 20 0 EIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccccc1OC(F)F ZINC000423497347 1038253987 /nfs/dbraw/zinc/25/39/87/1038253987.db2.gz GQSRXIZLNHLLKX-RHSMWYFYSA-N 2 0 334.410 4.419 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423505353 1038256364 /nfs/dbraw/zinc/25/63/64/1038256364.db2.gz HLXCVGTWRHHQHU-ZJQURUERSA-N 2 0 338.495 4.257 20 0 EIADRP COc1ccc([C@H]([NH2+][C@@H]2CC[C@H](C[NH3+])C2)c2ccccc2Cl)cc1 ZINC000423502050 1038257082 /nfs/dbraw/zinc/25/70/82/1038257082.db2.gz JMFRYYKHUKJWOY-NBQZKYEYSA-N 2 0 344.886 4.155 20 0 EIADRP C[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1csc(-c2ccccc2F)n1 ZINC000423484309 1038259561 /nfs/dbraw/zinc/25/95/61/1038259561.db2.gz QQUFETQSNUWWRW-KGLIPLIRSA-N 2 0 333.476 4.132 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423493608 1038265368 /nfs/dbraw/zinc/26/53/68/1038265368.db2.gz QHJUENNMIPZETK-SCRDCRAPSA-N 2 0 332.435 4.119 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@H]2[NH2+]CCC2=CC[NH2+]CC2)cc1 ZINC000423534827 1038267039 /nfs/dbraw/zinc/26/70/39/1038267039.db2.gz AZHSNOYFEQRFOC-LEWJYISDSA-N 2 0 328.500 4.009 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423512028 1038272312 /nfs/dbraw/zinc/27/23/12/1038272312.db2.gz UFQIKIJLTMIGEE-VGOFRKELSA-N 2 0 348.494 4.312 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)c(C)c1OC ZINC000423519687 1038274493 /nfs/dbraw/zinc/27/44/93/1038274493.db2.gz QDLSNRRWVMCUTF-QFBILLFUSA-N 2 0 342.483 4.143 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000423519162 1038274776 /nfs/dbraw/zinc/27/47/76/1038274776.db2.gz VGUOCQWJXUNJPP-QIJZBDPFSA-N 2 0 326.406 4.059 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CCC[NH2+]C1CC1 ZINC000423526607 1038277615 /nfs/dbraw/zinc/27/76/15/1038277615.db2.gz LSSUXNIWJHIIIB-LBPRGKRZSA-N 2 0 333.476 4.050 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc(OC(F)(F)F)cc1 ZINC000423540970 1038285828 /nfs/dbraw/zinc/28/58/28/1038285828.db2.gz KGJGTGLRJWZPAV-HWMZRRJGSA-N 2 0 342.405 4.014 20 0 EIADRP FC(F)(F)c1cccc([C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)C2CC2)c1 ZINC000423545913 1038289520 /nfs/dbraw/zinc/28/95/20/1038289520.db2.gz PONJKLXSFNWGSM-BURFUSLBSA-N 2 0 338.417 4.134 20 0 EIADRP C[C@@H]1CCC[C@H](C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C1 ZINC000574553056 1038303587 /nfs/dbraw/zinc/30/35/87/1038303587.db2.gz YRSHWDOPZLGQIJ-MJGOQNOKSA-N 2 0 330.516 4.076 20 0 EIADRP C[C@@H]1C[C@@H](C[N@@H+]2CCC[C@@H]2c2ccc(Br)s2)CC[NH2+]1 ZINC000414760290 1038349456 /nfs/dbraw/zinc/34/94/56/1038349456.db2.gz QHDJGKJAWFSZHV-FRRDWIJNSA-N 2 0 343.334 4.036 20 0 EIADRP CC1CC[NH+](CCC[NH2+][C@H](Cc2ccncc2)c2cccs2)CC1 ZINC000424268173 1038764609 /nfs/dbraw/zinc/76/46/09/1038764609.db2.gz ZKXJDEUQELHLJQ-LJQANCHMSA-N 2 0 343.540 4.139 20 0 EIADRP CCCCc1ccc([C@@H](C)[NH2+]CCc2cn3c(n2)CCCC3)cc1 ZINC000480746199 1038784413 /nfs/dbraw/zinc/78/44/13/1038784413.db2.gz FVTNINBMMJWUJP-QGZVFWFLSA-N 2 0 325.500 4.455 20 0 EIADRP Cc1ccc(-c2ncc(C[N@H+]3CC4(C[C@H]3C)CC[NH2+]CC4)s2)cc1 ZINC000424376286 1038837468 /nfs/dbraw/zinc/83/74/68/1038837468.db2.gz KWHWQZQYLXJXQR-MRXNPFEDSA-N 2 0 341.524 4.083 20 0 EIADRP C[N@H+](CCCCc1ccccc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000480851272 1038843881 /nfs/dbraw/zinc/84/38/81/1038843881.db2.gz JKPJRUGGZYXUAB-UHFFFAOYSA-N 2 0 337.511 4.253 20 0 EIADRP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+]CCC[NH+]1CCCC1 ZINC000504905723 1038845861 /nfs/dbraw/zinc/84/58/61/1038845861.db2.gz MWZUXDMIQYEOHG-GJZGRUSLSA-N 2 0 328.422 4.273 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(C)cc2C)[C@@H](C)C1 ZINC000480887607 1038853191 /nfs/dbraw/zinc/85/31/91/1038853191.db2.gz FMIFRNMICOYHPG-ZVDOUQERSA-N 2 0 332.532 4.091 20 0 EIADRP CC(C)[C@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000539163212 1038865480 /nfs/dbraw/zinc/86/54/80/1038865480.db2.gz ONUNWJJIMVWOOT-KDOFPFPSSA-N 2 0 340.433 4.476 20 0 EIADRP C[NH+](C)CCCC[NH2+]C(Cc1ccccc1F)Cc1ccccc1F ZINC000462034219 1038875088 /nfs/dbraw/zinc/87/50/88/1038875088.db2.gz ZSEWLQIDKFJCGG-UHFFFAOYSA-N 2 0 346.465 4.050 20 0 EIADRP COc1ccccc1[C@H]([NH2+]C1CC[NH+](C(C)C)CC1)C1CCCC1 ZINC000539215130 1038884257 /nfs/dbraw/zinc/88/42/57/1038884257.db2.gz AOJSOGLLQJYJCW-OAQYLSRUSA-N 2 0 330.516 4.389 20 0 EIADRP C[C@@H]([NH2+]CCc1ccc(OCC[NH+]2CCCC2)cc1)c1cccs1 ZINC000539298521 1038922365 /nfs/dbraw/zinc/92/23/65/1038922365.db2.gz RBNAOEWERDFUDY-QGZVFWFLSA-N 2 0 344.524 4.116 20 0 EIADRP C[C@H](CCc1ccc(O)cc1)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000119537632 1038930754 /nfs/dbraw/zinc/93/07/54/1038930754.db2.gz JGQFODPFQVWFRU-QGZVFWFLSA-N 2 0 330.516 4.100 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2cc(Cl)ccc2OC(F)F)cc1 ZINC000414801459 1038930980 /nfs/dbraw/zinc/93/09/80/1038930980.db2.gz ADQUHRZGZOZQEV-NSHDSACASA-N 2 0 340.801 4.251 20 0 EIADRP C[NH+](C)C1CCC(n2cc(C3CC[NH2+]CC3)c3cc(F)ccc32)CC1 ZINC001168328257 1038935969 /nfs/dbraw/zinc/93/59/69/1038935969.db2.gz BSTRZVSFZAXJBH-UHFFFAOYSA-N 2 0 343.490 4.293 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CCSCc1ccc(Cl)cc1Cl ZINC000539296779 1038947056 /nfs/dbraw/zinc/94/70/56/1038947056.db2.gz LCWGAQDDCUDUBA-MLGOLLRUSA-N 2 0 347.355 4.156 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(C)s1 ZINC000089215723 1039024808 /nfs/dbraw/zinc/02/48/08/1039024808.db2.gz VPUPLLAVLDABAZ-OAHLLOKOSA-N 2 0 329.513 4.327 20 0 EIADRP CCCOc1c(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cccc1OCC ZINC000414808586 1039038488 /nfs/dbraw/zinc/03/84/88/1039038488.db2.gz LCYOWZXUXINLTR-INIZCTEOSA-N 2 0 342.483 4.184 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)CCc2ccc(OC(F)F)cc2)cc1 ZINC000414808712 1039039161 /nfs/dbraw/zinc/03/91/61/1039039161.db2.gz FSPKSFNGAAMMPY-GJZGRUSLSA-N 2 0 348.437 4.419 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CC2(c3cccc(Cl)c3F)CCCC2)CC[N@@H+]1C ZINC000477864125 1039143763 /nfs/dbraw/zinc/14/37/63/1039143763.db2.gz ZUZJOOCGZVMZSM-LSDHHAIUSA-N 2 0 338.898 4.363 20 0 EIADRP Cc1c(Br)cccc1C[N@@H+](C)C1CC[NH+](C(C)C)CC1 ZINC000534135270 1039152750 /nfs/dbraw/zinc/15/27/50/1039152750.db2.gz RESKSFQSFXEKDB-UHFFFAOYSA-N 2 0 339.321 4.062 20 0 EIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CC2(c3ccccn3)CCC2)CC1 ZINC000552099516 1039156422 /nfs/dbraw/zinc/15/64/22/1039156422.db2.gz LLIRUVLYCGTCOQ-AZUAARDMSA-N 2 0 341.543 4.136 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CC2(c3ccccn3)CCC2)CC1 ZINC000552099518 1039156973 /nfs/dbraw/zinc/15/69/73/1039156973.db2.gz LLIRUVLYCGTCOQ-QUCCMNQESA-N 2 0 341.543 4.136 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2ccccc2OC)cc1 ZINC000120577787 1039181000 /nfs/dbraw/zinc/18/10/00/1039181000.db2.gz VRLMXGCWRTXUKW-KRWDZBQOSA-N 2 0 326.484 4.388 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCc3cc(F)ccc32)c1 ZINC000481296892 1039234419 /nfs/dbraw/zinc/23/44/19/1039234419.db2.gz VCCUXHMRKYTHTC-NRFANRHFSA-N 2 0 326.459 4.445 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](CCc2ccccc2)Cc2ccccc2)C1 ZINC000481324776 1039298267 /nfs/dbraw/zinc/29/82/67/1039298267.db2.gz RXLGEGRTTKDYGV-GOTSBHOMSA-N 2 0 336.523 4.162 20 0 EIADRP CCC1(C[NH2+][C@H](C)c2cccnc2)CC[NH+](Cc2ccccc2)CC1 ZINC000513871431 1039338742 /nfs/dbraw/zinc/33/87/42/1039338742.db2.gz QRZKFQKNIPJBRK-LJQANCHMSA-N 2 0 337.511 4.425 20 0 EIADRP CCC1(C[NH2+][C@H](C)c2ccncc2)CC[NH+](Cc2ccccc2)CC1 ZINC000513873226 1039342030 /nfs/dbraw/zinc/34/20/30/1039342030.db2.gz VBNSWJMPWUYIGG-LJQANCHMSA-N 2 0 337.511 4.425 20 0 EIADRP Cc1nccn1-c1ccc(C[NH2+][C@@H](c2ccc(C)cc2)C2CC2)cn1 ZINC000091288577 1039357720 /nfs/dbraw/zinc/35/77/20/1039357720.db2.gz KSTGWVMFHXGJSC-NRFANRHFSA-N 2 0 332.451 4.125 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC000121796945 1039487118 /nfs/dbraw/zinc/48/71/18/1039487118.db2.gz JYVJPIWUYZDIAC-CQSZACIVSA-N 2 0 326.431 4.061 20 0 EIADRP C[NH+]1CCC2(C[NH+](C3CCC(c4ccc(Cl)cc4)CC3)C2)CC1 ZINC001168347619 1039503854 /nfs/dbraw/zinc/50/38/54/1039503854.db2.gz OMPWOHRUVJCICT-UHFFFAOYSA-N 2 0 332.919 4.394 20 0 EIADRP Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cn1 ZINC000514097964 1039632633 /nfs/dbraw/zinc/63/26/33/1039632633.db2.gz CHLSOGABQDBQPF-DNVJHFABSA-N 2 0 349.522 4.170 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)c(C)c1 ZINC000122367648 1039680737 /nfs/dbraw/zinc/68/07/37/1039680737.db2.gz GAIVDGVTGLBBIE-SFHVURJKSA-N 2 0 326.484 4.095 20 0 EIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000643536838 1039743204 /nfs/dbraw/zinc/74/32/04/1039743204.db2.gz WZZXHHXAXMNLIC-MSOLQXFVSA-N 2 0 326.509 4.072 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)[C@@H](C)c2nc3ccccc3s2)CC1 ZINC000122730533 1039783984 /nfs/dbraw/zinc/78/39/84/1039783984.db2.gz HALOPFXHFUSDES-HZPDHXFCSA-N 2 0 345.556 4.500 20 0 EIADRP CCc1oc2ccccc2c1C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000537649741 1039824437 /nfs/dbraw/zinc/82/44/37/1039824437.db2.gz ZFNJIMPSULKWNR-QGZVFWFLSA-N 2 0 326.484 4.159 20 0 EIADRP C[NH+](C)CCCOc1ccc(C[NH2+]CCc2cccc(Cl)c2)cc1 ZINC000551012303 1039873756 /nfs/dbraw/zinc/87/37/56/1039873756.db2.gz OBCWYYKYPMBWBK-UHFFFAOYSA-N 2 0 346.902 4.003 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCCC[NH+](C)C)CCC3)cc1 ZINC000481944784 1039916366 /nfs/dbraw/zinc/91/63/66/1039916366.db2.gz IKYAXFDXOHBRDC-QGZVFWFLSA-N 2 0 343.540 4.427 20 0 EIADRP c1cc2c(cccc2C[NH2+]CC2(N3CCSCC3)CCCCC2)[nH]1 ZINC000482040759 1039983777 /nfs/dbraw/zinc/98/37/77/1039983777.db2.gz MCBDLEFCJDIUAL-UHFFFAOYSA-N 2 0 343.540 4.009 20 0 EIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3F)s2)C1 ZINC000551207990 1040060392 /nfs/dbraw/zinc/06/03/92/1040060392.db2.gz GLFQYZUUDZNAHB-OAHLLOKOSA-N 2 0 332.488 4.374 20 0 EIADRP CC(C)=CCC[C@H](C)CC[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1 ZINC000482212061 1040079286 /nfs/dbraw/zinc/07/92/86/1040079286.db2.gz PIJOPUDUOKVABO-JBACZVJFSA-N 2 0 336.564 4.117 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CC[C@H](c2ccccc2)C(F)(F)F)[C@H](C)C1 ZINC000551238869 1040085789 /nfs/dbraw/zinc/08/57/89/1040085789.db2.gz FENIDPXKWAYUGS-OIISXLGYSA-N 2 0 328.422 4.043 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(OC(F)(F)F)cc2)C1 ZINC000482360659 1040201902 /nfs/dbraw/zinc/20/19/02/1040201902.db2.gz PWNPKNDLFDULPH-GJZGRUSLSA-N 2 0 344.421 4.356 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(F)cc1 ZINC000482434329 1040242824 /nfs/dbraw/zinc/24/28/24/1040242824.db2.gz FNKLMMJLDYXELO-PKOBYXMFSA-N 2 0 326.459 4.041 20 0 EIADRP CC(C)CCC[C@H]([NH2+]C[C@@H](C)CN1CC[NH+](C)CC1)c1ccccc1 ZINC000482509703 1040307313 /nfs/dbraw/zinc/30/73/13/1040307313.db2.gz MUDBKJXJNXZADO-IRLDBZIGSA-N 2 0 345.575 4.027 20 0 EIADRP C[C@H](Cc1ccccc1)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000482518169 1040313707 /nfs/dbraw/zinc/31/37/07/1040313707.db2.gz KQGOFIBNDRRBHS-LJQANCHMSA-N 2 0 337.511 4.109 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC3(CCCC3)O2)CCN1Cc1ccccc1 ZINC000379655499 1040317136 /nfs/dbraw/zinc/31/71/36/1040317136.db2.gz MBXNYHLZRZDSLD-HLAWJBBLSA-N 2 0 342.527 4.121 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(OC)c1 ZINC000479461728 1040367054 /nfs/dbraw/zinc/36/70/54/1040367054.db2.gz DLJDMMGEBSUECV-DENIHFKCSA-N 2 0 338.495 4.258 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]C/C(C)=C/c2ccccc2OC(F)F)C1 ZINC000515020057 1040420760 /nfs/dbraw/zinc/42/07/60/1040420760.db2.gz MSXKPCDSPVCMGH-SFKKXYGYSA-N 2 0 338.442 4.013 20 0 EIADRP CC(C)[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000539509579 1040504186 /nfs/dbraw/zinc/50/41/86/1040504186.db2.gz HFUSDOHKLFOCMF-KRWDZBQOSA-N 2 0 326.406 4.254 20 0 EIADRP CCc1nc(CN2CCC(C[NH2+][C@H]3[C@H](C)CCC[C@@H]3C)CC2)cs1 ZINC000482874302 1040533518 /nfs/dbraw/zinc/53/35/18/1040533518.db2.gz NQLNOQIZGVASGL-IGOJGBNBSA-N 2 0 349.588 4.332 20 0 EIADRP CSC1(C[NH2+][C@H]2CCC[C@H]2CCc2ccccc2)CC[NH+](C)CC1 ZINC000515353216 1040675079 /nfs/dbraw/zinc/67/50/79/1040675079.db2.gz GNIBTGBYRPKXKY-PMACEKPBSA-N 2 0 346.584 4.205 20 0 EIADRP c1ccc(N2CCC[C@@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)cc1 ZINC000483123060 1040716194 /nfs/dbraw/zinc/71/61/94/1040716194.db2.gz DDNJJLAUXSOVBJ-HXUWFJFHSA-N 2 0 341.543 4.042 20 0 EIADRP Cc1c([C@@H](C)NCC(C)(C)C[NH+](C)C)cnn1-c1cccc(Cl)c1 ZINC000479871025 1040731921 /nfs/dbraw/zinc/73/19/21/1040731921.db2.gz FFGPKYFEGYFEQM-CQSZACIVSA-N 2 0 348.922 4.073 20 0 EIADRP C[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1ccccc1OC(F)F ZINC000483188969 1040762141 /nfs/dbraw/zinc/76/21/41/1040762141.db2.gz YHOXJVZEFABAIP-BBRMVZONSA-N 2 0 328.447 4.305 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cc(Cl)cc(Cl)c2OC)C[C@H]1C ZINC000539816804 1040809918 /nfs/dbraw/zinc/80/99/18/1040809918.db2.gz DIRFXEZYNUPJKL-DOMZBBRYSA-N 2 0 345.314 4.307 20 0 EIADRP CSC1(C[NH2+][C@H](C)c2ccccc2C(F)(F)F)CC[NH+](C)CC1 ZINC000515492982 1040812451 /nfs/dbraw/zinc/81/24/51/1040812451.db2.gz GMTGEMICRLLNRU-CYBMUJFWSA-N 2 0 346.462 4.183 20 0 EIADRP CC(C)(C[NH2+]C1CCC(c2ccc(O)cc2)CC1)C[NH+]1CCCC1 ZINC000483417907 1040847814 /nfs/dbraw/zinc/84/78/14/1040847814.db2.gz YXVMZCJXJSZELG-UHFFFAOYSA-N 2 0 330.516 4.130 20 0 EIADRP CCCOc1ccc(C[NH+]2CCC(CCC[NH+](C)C)CC2)cc1OC ZINC000539851866 1040849497 /nfs/dbraw/zinc/84/94/97/1040849497.db2.gz FQJYGYFAEKKOLE-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000669846972 1040851070 /nfs/dbraw/zinc/85/10/70/1040851070.db2.gz UIKYOLMWUFUGSM-ACRUOGEOSA-N 2 0 332.507 4.407 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1nc2c(s1)CCCC2 ZINC000537883087 1040871272 /nfs/dbraw/zinc/87/12/72/1040871272.db2.gz QQVZAXXVLDWKCE-BRWVUGGUSA-N 2 0 349.588 4.431 20 0 EIADRP Cc1ccccc1O[C@H](C)C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000483634873 1040938438 /nfs/dbraw/zinc/93/84/38/1040938438.db2.gz IENNLRMXUJTBMF-GOSISDBHSA-N 2 0 330.516 4.149 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000462793866 1040942781 /nfs/dbraw/zinc/94/27/81/1040942781.db2.gz SLRAWFINJPZSQV-YPAWHYETSA-N 2 0 344.543 4.213 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2ccc(F)cc2OC(F)F)CC1 ZINC000483710611 1040981117 /nfs/dbraw/zinc/98/11/17/1040981117.db2.gz IHPPHMQVHPPDNW-ZDUSSCGKSA-N 2 0 344.421 4.200 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)ccc1F ZINC000436255595 1041011488 /nfs/dbraw/zinc/01/14/88/1041011488.db2.gz YAXLLKDGJQGNLH-UYAOXDASSA-N 2 0 326.459 4.313 20 0 EIADRP Fc1cccc2[nH]c(C[NH2+]Cc3cccc(C[NH+]4CCCC4)c3)cc21 ZINC000436283443 1041026553 /nfs/dbraw/zinc/02/65/53/1041026553.db2.gz VHCXALQAZJIHMO-UHFFFAOYSA-N 2 0 337.442 4.193 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CC[C@H](c2ccccc2)C1 ZINC000436273522 1041045909 /nfs/dbraw/zinc/04/59/09/1041045909.db2.gz KALTWRXRZGUPOK-FPOVZHCZSA-N 2 0 338.495 4.053 20 0 EIADRP CC(C)[C@H]([NH2+]CCC[NH+](C(C)C)C(C)C)c1ccc2[nH]c(=O)oc2c1 ZINC000538116676 1041047682 /nfs/dbraw/zinc/04/76/82/1041047682.db2.gz OQUSWLMFCCCTRQ-IBGZPJMESA-N 2 0 347.503 4.329 20 0 EIADRP c1ccc(C[C@H]2CC[C@H]([NH2+]C3CC[NH+](C4CCCC4)CC3)C2)cc1 ZINC000436299781 1041069467 /nfs/dbraw/zinc/06/94/67/1041069467.db2.gz HKHPKHDORIPZHP-CTNGQTDRSA-N 2 0 326.528 4.394 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000436300981 1041069632 /nfs/dbraw/zinc/06/96/32/1041069632.db2.gz XJXNTKQIBNNYJC-DUXKGJEZSA-N 2 0 338.495 4.224 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1(c2ccccc2)CC1 ZINC000480208926 1041081952 /nfs/dbraw/zinc/08/19/52/1041081952.db2.gz LDRZBTVZHNGRJS-DENIHFKCSA-N 2 0 334.507 4.218 20 0 EIADRP C[NH+](C)CCC1CC[NH+](CCOc2ccc(Cl)cc2Cl)CC1 ZINC000515775137 1041090749 /nfs/dbraw/zinc/09/07/49/1041090749.db2.gz BSAJLPPZBIRWOA-UHFFFAOYSA-N 2 0 345.314 4.036 20 0 EIADRP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000480253195 1041135088 /nfs/dbraw/zinc/13/50/88/1041135088.db2.gz WOSGGUXKBRVXJV-FUHWJXTLSA-N 2 0 342.449 4.262 20 0 EIADRP CCC1(C[NH2+][C@@H](C)c2cncs2)CC[NH+](Cc2ccccc2)CC1 ZINC000540144213 1041169555 /nfs/dbraw/zinc/16/95/55/1041169555.db2.gz VTVQPDILLGBCSU-KRWDZBQOSA-N 2 0 343.540 4.486 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccc(Sc2ccccc2)cc1 ZINC000540148274 1041194113 /nfs/dbraw/zinc/19/41/13/1041194113.db2.gz YKEWNEZPRJDYCY-JXFKEZNVSA-N 2 0 326.509 4.268 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cccc(Cl)c1Cl ZINC000484292350 1041194333 /nfs/dbraw/zinc/19/43/33/1041194333.db2.gz CVCIYOQSEOWRJX-QWHCGFSZSA-N 2 0 333.303 4.001 20 0 EIADRP Cc1ccc(SC2(C[NH2+][C@H]3CC[N@H+](C)[C@@H](C)C3)CCCC2)cc1 ZINC000484287868 1041194636 /nfs/dbraw/zinc/19/46/36/1041194636.db2.gz CYHWAVGHHIMLBB-ROUUACIJSA-N 2 0 332.557 4.472 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000540150166 1041198676 /nfs/dbraw/zinc/19/86/76/1041198676.db2.gz CBIUQHJIFFEVLH-HZPDHXFCSA-N 2 0 340.458 4.307 20 0 EIADRP c1cc2cc(C[NH2+]Cc3ccccc3C[NH+]3CCCCC3)ccc2[nH]1 ZINC000515866718 1041229624 /nfs/dbraw/zinc/22/96/24/1041229624.db2.gz AQCBMYSXKRUYOL-UHFFFAOYSA-N 2 0 333.479 4.444 20 0 EIADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(c2ccc(C(F)(F)F)cc2)CC1 ZINC000540199436 1041258775 /nfs/dbraw/zinc/25/87/75/1041258775.db2.gz VIFGBWPMPRMFLN-GOSISDBHSA-N 2 0 340.433 4.369 20 0 EIADRP CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc[nH+]c2ccccc21 ZINC000463063517 1041299471 /nfs/dbraw/zinc/29/94/71/1041299471.db2.gz HKFFKWKMAXEEHE-IBGZPJMESA-N 2 0 331.463 4.193 20 0 EIADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cccc(OCc2ccccc2)c1 ZINC000538406155 1041302621 /nfs/dbraw/zinc/30/26/21/1041302621.db2.gz REOVHNPVSRTUFC-GOSISDBHSA-N 2 0 336.479 4.178 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H]([NH+](C)C)C2)c2ccccc12 ZINC000484496510 1041303055 /nfs/dbraw/zinc/30/30/55/1041303055.db2.gz RMDHTRPAXXILHP-ULQDDVLXSA-N 2 0 326.484 4.372 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2OC ZINC000480473253 1041327910 /nfs/dbraw/zinc/32/79/10/1041327910.db2.gz SNFDFLZJMDHDLU-OAQYLSRUSA-N 2 0 338.495 4.314 20 0 EIADRP CC(C)[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000540302935 1041354883 /nfs/dbraw/zinc/35/48/83/1041354883.db2.gz WMRLMJXLVNKPBE-RHSMWYFYSA-N 2 0 328.422 4.334 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1C[C@@H]1c1ccccc1 ZINC000463162025 1041378975 /nfs/dbraw/zinc/37/89/75/1041378975.db2.gz JZSOVVDYWQIKTR-YADHBBJMSA-N 2 0 335.495 4.176 20 0 EIADRP Cc1cccc([C@H](C)C[NH2+]C2CCN(CCc3ccccc3)CC2)c1 ZINC000463191784 1041408028 /nfs/dbraw/zinc/40/80/28/1041408028.db2.gz QCPYYDADTHBNSC-HXUWFJFHSA-N 2 0 336.523 4.395 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH+]2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc1 ZINC000667706283 1041421847 /nfs/dbraw/zinc/42/18/47/1041421847.db2.gz WBQTYGYDSJMMNF-MOPGFXCFSA-N 2 0 341.524 4.035 20 0 EIADRP COc1cc(C)c([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1OC ZINC000480615273 1041425986 /nfs/dbraw/zinc/42/59/86/1041425986.db2.gz RJIVUKVWIWPNBP-ROUUACIJSA-N 2 0 348.531 4.317 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1cccc(OC(F)F)c1 ZINC000480604417 1041429423 /nfs/dbraw/zinc/42/94/23/1041429423.db2.gz BIXZCUMOYMXYSU-INIZCTEOSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc(F)cc1N(C)C ZINC000480636939 1041449155 /nfs/dbraw/zinc/44/91/55/1041449155.db2.gz ZRINPCLMHWUCLF-KRWDZBQOSA-N 2 0 335.511 4.054 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21)C(F)(F)F ZINC000480669411 1041461714 /nfs/dbraw/zinc/46/17/14/1041461714.db2.gz WOZCBRVWDMKCSV-VDHUWJSZSA-N 2 0 340.433 4.075 20 0 EIADRP CC(C)CSCCC[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000463283122 1041473051 /nfs/dbraw/zinc/47/30/51/1041473051.db2.gz OSEDMJCUFJHYMO-UHFFFAOYSA-N 2 0 334.573 4.062 20 0 EIADRP COc1ccc([C@H](CCC(C)C)[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000480692422 1041476534 /nfs/dbraw/zinc/47/65/34/1041476534.db2.gz IGUSJXWGIZQOAW-ZVDOUQERSA-N 2 0 330.516 4.389 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc3cc(OC)ccc3c2)C[C@H]1C ZINC000538718697 1041488301 /nfs/dbraw/zinc/48/83/01/1041488301.db2.gz IGLRUKDKEUFGHL-UZLBHIALSA-N 2 0 326.484 4.153 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H](C)c1ccc(F)cc1 ZINC000480731801 1041504106 /nfs/dbraw/zinc/50/41/06/1041504106.db2.gz RJISQCOJJSZWFC-QGZVFWFLSA-N 2 0 344.474 4.397 20 0 EIADRP C[C@@H]1C[NH+](CCCCC[N@@H+]2CCC(F)(F)[C@H](C)C2)CCC1(F)F ZINC000554946423 1041507793 /nfs/dbraw/zinc/50/77/93/1041507793.db2.gz SPUVNLAKEKBEGA-HUUCEWRRSA-N 2 0 338.433 4.111 20 0 EIADRP COc1ccc2ccccc2c1C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000538749409 1041521397 /nfs/dbraw/zinc/52/13/97/1041521397.db2.gz LLSWZVGXVLBDRP-SFHVURJKSA-N 2 0 338.495 4.012 20 0 EIADRP CC(C)[C@H](CC(F)(F)F)[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000437076322 1041625059 /nfs/dbraw/zinc/62/50/59/1041625059.db2.gz OBFQGWJVJMLUFM-PBHICJAKSA-N 2 0 346.437 4.255 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCCc3cc(N)ccc32)CC1 ZINC000414910771 1041869508 /nfs/dbraw/zinc/86/95/08/1041869508.db2.gz CSBFVBOVHXPIBX-HVETUWLQSA-N 2 0 341.543 4.279 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000414913308 1041898767 /nfs/dbraw/zinc/89/87/67/1041898767.db2.gz WDXMSWCAQXLEMC-CQSZACIVSA-N 2 0 328.422 4.006 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CCC[C@@H]2[NH2+][C@@H]2CCC[NH2+]CC2)cc1 ZINC000414918929 1041984523 /nfs/dbraw/zinc/98/45/23/1041984523.db2.gz TUEMGTYRBOOZPH-IKGGRYGDSA-N 2 0 326.406 4.073 20 0 EIADRP C[N@@H+](Cc1ccc(Cl)cc1F)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000437992282 1042007462 /nfs/dbraw/zinc/00/74/62/1042007462.db2.gz ZOVQWPZWQQMYGX-UHFFFAOYSA-N 2 0 347.865 4.223 20 0 EIADRP FC1(F)CC(C[NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000425940697 1042017838 /nfs/dbraw/zinc/01/78/38/1042017838.db2.gz XNIPNMOUVJKIMA-VAMGGRTRSA-N 2 0 348.481 4.312 20 0 EIADRP c1ccc(OCCCCC[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC000438132263 1042059666 /nfs/dbraw/zinc/05/96/66/1042059666.db2.gz YJQWRVYEXPEWEX-FQEVSTJZSA-N 2 0 330.516 4.044 20 0 EIADRP C[NH+]1CCC(C[NH2+]Cc2ccc(Oc3cc(F)cc(F)c3)cc2)CC1 ZINC000517547501 1042076252 /nfs/dbraw/zinc/07/62/52/1042076252.db2.gz WOCJERGSSYYUQB-UHFFFAOYSA-N 2 0 346.421 4.189 20 0 EIADRP C[C@@H](c1ccc(F)cc1)[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464832153 1042189236 /nfs/dbraw/zinc/18/92/36/1042189236.db2.gz BVJFWQIOWBYLJM-PKOBYXMFSA-N 2 0 326.459 4.341 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@H](c2cncc(F)c2)C2CC2)C1 ZINC000467371502 1042213422 /nfs/dbraw/zinc/21/34/22/1042213422.db2.gz WEHNDGLSTYQQIH-QINHECLXSA-N 2 0 333.495 4.020 20 0 EIADRP Fc1ccc2c(c1)CC[C@@H]([NH2+]CC1CC[NH+](C3CCCCC3)CC1)C2 ZINC001168406994 1042263259 /nfs/dbraw/zinc/26/32/59/1042263259.db2.gz KYRLYAMDNMGHKO-OAQYLSRUSA-N 2 0 344.518 4.317 20 0 EIADRP Cc1cc(C[N@@H+](C)C2CC[NH+](C(C)C)CC2)cc(C)c1OC(F)F ZINC000506327658 1042312099 /nfs/dbraw/zinc/31/20/99/1042312099.db2.gz QOHQHOMPGJBGHR-UHFFFAOYSA-N 2 0 340.458 4.209 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000509568717 1042378282 /nfs/dbraw/zinc/37/82/82/1042378282.db2.gz AQPAWXZSSNCHOF-HNNXBMFYSA-N 2 0 332.488 4.376 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3cccc(F)c3)s2)C1 ZINC000509568719 1042378756 /nfs/dbraw/zinc/37/87/56/1042378756.db2.gz AQPAWXZSSNCHOF-OAHLLOKOSA-N 2 0 332.488 4.376 20 0 EIADRP C[C@@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414972328 1042444009 /nfs/dbraw/zinc/44/40/09/1042444009.db2.gz XPHCJSLIHZKEHY-YOEHRIQHSA-N 2 0 328.422 4.148 20 0 EIADRP [NH3+][C@H]1CCC[C@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000414996495 1042600011 /nfs/dbraw/zinc/60/00/11/1042600011.db2.gz GJZQXNQIYDXKJF-YWZLYKJASA-N 2 0 344.449 4.204 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC(C)C)c(Cl)c2)[C@@H](C)C1 ZINC000492335644 1042611966 /nfs/dbraw/zinc/61/19/66/1042611966.db2.gz SQMUEZOROOSWCW-MAUKXSAKSA-N 2 0 338.923 4.289 20 0 EIADRP C[N@H+](CCC[NH2+]Cc1cccc(-c2ccncc2)c1)C1CCCCC1 ZINC000439466124 1042639172 /nfs/dbraw/zinc/63/91/72/1042639172.db2.gz GTLREUNRQYNNAM-UHFFFAOYSA-N 2 0 337.511 4.493 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCC[NH2+]Cc2cccc(-c3ccncc3)c2)C1 ZINC000439479477 1042655479 /nfs/dbraw/zinc/65/54/79/1042655479.db2.gz UHZVQLYGCWMGFC-OALUTQOASA-N 2 0 337.511 4.206 20 0 EIADRP COCCC[C@H](C)[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000177859968 1042852296 /nfs/dbraw/zinc/85/22/96/1042852296.db2.gz MKOVSZHSVYZHCT-SFHVURJKSA-N 2 0 340.511 4.320 20 0 EIADRP CSc1ccc(C[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)cc1 ZINC000178591215 1042869680 /nfs/dbraw/zinc/86/96/80/1042869680.db2.gz NEIKHWULHLYBFB-MRXNPFEDSA-N 2 0 344.524 4.200 20 0 EIADRP CSc1ccc(C[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)cc1 ZINC000178591205 1042869836 /nfs/dbraw/zinc/86/98/36/1042869836.db2.gz NEIKHWULHLYBFB-INIZCTEOSA-N 2 0 344.524 4.200 20 0 EIADRP c1cc(C[NH+]2CCCCC2)ccc1C[N@@H+]1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000520575619 1042899447 /nfs/dbraw/zinc/89/94/47/1042899447.db2.gz WNIPTQWPYKYQRX-FGZHOGPDSA-N 2 0 342.527 4.064 20 0 EIADRP C[C@@H]1CC([NH2+]CCc2cccs2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168004874 1042939395 /nfs/dbraw/zinc/93/93/95/1042939395.db2.gz BDEMNYAGBXDIDC-IAGOWNOFSA-N 2 0 328.525 4.322 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)[C@H](OC)c2ccccc2)c1 ZINC000493905183 1042973512 /nfs/dbraw/zinc/97/35/12/1042973512.db2.gz HBVMIRPPKPMYKF-UTKZUKDTSA-N 2 0 326.484 4.004 20 0 EIADRP CCCC[N@H+](CC)CCNC1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168008112 1043031373 /nfs/dbraw/zinc/03/13/73/1043031373.db2.gz CNYGBKDWAUXVMB-PMACEKPBSA-N 2 0 345.575 4.140 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc(-n3cccn3)cc2)c1 ZINC000067450037 1043041661 /nfs/dbraw/zinc/04/16/61/1043041661.db2.gz ZHXSYLAVYGVLQO-UHFFFAOYSA-N 2 0 348.494 4.002 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1sccc1OC ZINC000186089411 1043244151 /nfs/dbraw/zinc/24/41/51/1043244151.db2.gz HKAFEQMKDNJIBL-OAHLLOKOSA-N 2 0 332.513 4.449 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(c2ccc(F)cc2Cl)CCCC1 ZINC000427886277 1043249709 /nfs/dbraw/zinc/24/97/09/1043249709.db2.gz LOSFNZAAYVTJSF-KSSFIOAISA-N 2 0 338.898 4.221 20 0 EIADRP COc1cccc2cc(C[NH2+]CCCC[N@@H+]3CCC[C@@H](C)C3)oc21 ZINC000727644195 1043254983 /nfs/dbraw/zinc/25/49/83/1043254983.db2.gz RTIPUKLCAKBDPG-MRXNPFEDSA-N 2 0 330.472 4.043 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)C[C@H]1C ZINC000674005781 1043271591 /nfs/dbraw/zinc/27/15/91/1043271591.db2.gz OKTPLRBLDJJRIR-QAPCUYQASA-N 2 0 342.449 4.443 20 0 EIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CCSCC1 ZINC000187191548 1043334221 /nfs/dbraw/zinc/33/42/21/1043334221.db2.gz WQNYIXPVFPSBAI-ZNDGOPKYSA-N 2 0 344.568 4.303 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000174992596 1043425486 /nfs/dbraw/zinc/42/54/86/1043425486.db2.gz RXWVFEUKJYKOPX-OAQYLSRUSA-N 2 0 326.459 4.443 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000665281023 1043647792 /nfs/dbraw/zinc/64/77/92/1043647792.db2.gz RYJFFJKEHMBISE-BLLLJJGKSA-N 2 0 335.492 4.282 20 0 EIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)s2)cc1 ZINC000665281014 1043649890 /nfs/dbraw/zinc/64/98/90/1043649890.db2.gz RNNHGUSYWWZBJU-SUMWQHHRSA-N 2 0 347.528 4.151 20 0 EIADRP C[C@H]([NH2+]CCCCC(=O)OC(C)(C)C)c1cccc(-n2ccnc2)c1 ZINC000189903347 1043656320 /nfs/dbraw/zinc/65/63/20/1043656320.db2.gz XZQVIOMGXCOADV-INIZCTEOSA-N 2 0 343.471 4.035 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C ZINC000665280596 1043661090 /nfs/dbraw/zinc/66/10/90/1043661090.db2.gz HDJCGOSBILDOAR-WMLDXEAASA-N 2 0 331.529 4.066 20 0 EIADRP Cc1cccc2c1CCC[C@@H]2[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000665283666 1043687473 /nfs/dbraw/zinc/68/74/73/1043687473.db2.gz RYTLIWNDYGFXNR-XJUOHMSHSA-N 2 0 348.490 4.218 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1 ZINC000474033791 1043692735 /nfs/dbraw/zinc/69/27/35/1043692735.db2.gz LUTFVOUQTQHRJI-OXQOHEQNSA-N 2 0 330.516 4.128 20 0 EIADRP Cc1c([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cnn1C(C)(C)C ZINC000191178247 1043787545 /nfs/dbraw/zinc/78/75/45/1043787545.db2.gz QVAHCMPZCNMFOT-IRXDYDNUSA-N 2 0 334.552 4.252 20 0 EIADRP S=c1ccn(C[NH+]2CCC([NH+]3CCCCC3)CC2)c2ccccc12 ZINC000731659132 1043809551 /nfs/dbraw/zinc/80/95/51/1043809551.db2.gz QRWUJSOKKNRDQG-UHFFFAOYSA-N 2 0 341.524 4.279 20 0 EIADRP C[C@H]1CC([NH2+]CCc2ccsc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168014383 1043827415 /nfs/dbraw/zinc/82/74/15/1043827415.db2.gz KVFMGYFOBRQZKB-IRXDYDNUSA-N 2 0 328.525 4.322 20 0 EIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2ccc3[nH]ccc3c2)CC1 ZINC000442811726 1043852744 /nfs/dbraw/zinc/85/27/44/1043852744.db2.gz PHIGMUBRCVUVIN-JTSKRJEESA-N 2 0 339.527 4.343 20 0 EIADRP COCCC[C@H]([NH2+]CC1(C[NH+](C)C)CCCC1)c1ccc(F)cc1 ZINC000442868279 1043868450 /nfs/dbraw/zinc/86/84/50/1043868450.db2.gz QDTWQJBPGXGFMR-IBGZPJMESA-N 2 0 336.495 4.005 20 0 EIADRP CC(C)(C)C[N@H+]([C@@H]1Cc2cccc(Cl)c2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001168707185 1043895578 /nfs/dbraw/zinc/89/55/78/1043895578.db2.gz KIVDCCYJOAYXGJ-BRWVUGGUSA-N 2 0 334.935 4.425 20 0 EIADRP CCC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)C1CCCC1 ZINC000658162147 1043922905 /nfs/dbraw/zinc/92/29/05/1043922905.db2.gz BWRHQNJPJMOYJB-OAQYLSRUSA-N 2 0 329.532 4.242 20 0 EIADRP CC(C)[NH+]1CCN(CCC[N@@H+]2CCCCC[C@H]2c2ccccc2)CC1 ZINC000192723422 1043955654 /nfs/dbraw/zinc/95/56/54/1043955654.db2.gz JKNDZPMLFULORP-QFIPXVFZSA-N 2 0 343.559 4.020 20 0 EIADRP CSC1(C[NH2+][C@H](C)c2cc(Cl)cc(Cl)c2)CC[NH+](C)CC1 ZINC000521944696 1044095263 /nfs/dbraw/zinc/09/52/63/1044095263.db2.gz LPQRSVOZAXRGFX-GFCCVEGCSA-N 2 0 347.355 4.471 20 0 EIADRP CCC[C@H](C[NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccccc1 ZINC000657535306 1044364124 /nfs/dbraw/zinc/36/41/24/1044364124.db2.gz JBWRSXFRTIYZSE-OAQYLSRUSA-N 2 0 344.543 4.051 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(Cl)cc1 ZINC000069645321 1044369490 /nfs/dbraw/zinc/36/94/90/1044369490.db2.gz SRNHPZSJNZNYES-OAHLLOKOSA-N 2 0 332.875 4.131 20 0 EIADRP Clc1cccc2c1C[C@H]([NH2+]C1CC[NH+](C[C@@H]3CC=CCC3)CC1)C2 ZINC001168719150 1044408831 /nfs/dbraw/zinc/40/88/31/1044408831.db2.gz UYAWVCYYPGIPQX-VQIMIIECSA-N 2 0 344.930 4.218 20 0 EIADRP C[C@@H]([NH2+][C@H](Cc1ccccc1)c1ccccc1F)C1CC[NH+](C)CC1 ZINC000675898224 1044543954 /nfs/dbraw/zinc/54/39/54/1044543954.db2.gz GLNVENRJTNQFMS-VGOFRKELSA-N 2 0 340.486 4.429 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](CCCc3ccc(C(F)(F)F)cc3)CC[C@@H]21 ZINC000675897596 1044544073 /nfs/dbraw/zinc/54/40/73/1044544073.db2.gz HEQAPAHQZUHIOA-AEFFLSMTSA-N 2 0 340.433 4.054 20 0 EIADRP c1ccc(C[C@@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)C2CCCCC2)cc1 ZINC000480753800 1044582455 /nfs/dbraw/zinc/58/24/55/1044582455.db2.gz BUMSKTPRWUPYRM-DENIHFKCSA-N 2 0 326.528 4.252 20 0 EIADRP Cc1nc([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c(C)s1 ZINC000676489971 1044770007 /nfs/dbraw/zinc/77/00/07/1044770007.db2.gz NJMMCWKYEIPOLJ-CYBMUJFWSA-N 2 0 349.569 4.384 20 0 EIADRP COc1ccc(-c2nc(C[NH2+]C(C)(C)CCC[NH+](C)C)cs2)cc1 ZINC000648752660 1044784659 /nfs/dbraw/zinc/78/46/59/1044784659.db2.gz GEEQYMDRXPUMPG-UHFFFAOYSA-N 2 0 347.528 4.029 20 0 EIADRP CC1([NH+]2CCCC2)CCC([NH2+]Cc2c[nH]nc2-c2cccs2)CC1 ZINC000922510590 1044793877 /nfs/dbraw/zinc/79/38/77/1044793877.db2.gz UUQOEKNVENPZNH-UHFFFAOYSA-N 2 0 344.528 4.025 20 0 EIADRP FC(F)(F)c1ccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000676712965 1044827873 /nfs/dbraw/zinc/82/78/73/1044827873.db2.gz VLCNDTOISKYXAR-CRAIPNDOSA-N 2 0 338.417 4.154 20 0 EIADRP Cc1ccc([C@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)C2CCC2)o1 ZINC000543592894 1044873867 /nfs/dbraw/zinc/87/38/67/1044873867.db2.gz JUYZEFLJLYFCJZ-OAQYLSRUSA-N 2 0 342.483 4.159 20 0 EIADRP Fc1cc2c(c(F)c1)CC[C@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000154531839 1044945562 /nfs/dbraw/zinc/94/55/62/1044945562.db2.gz HMJUUNNVYHCEFY-OAQYLSRUSA-N 2 0 342.433 4.338 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCN(Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000922836941 1044982896 /nfs/dbraw/zinc/98/28/96/1044982896.db2.gz FIBCOBMCMXYNCX-QRQLOZEOSA-N 2 0 330.541 4.057 20 0 EIADRP Cc1nc2ccc(C[NH2+]C3CCC(C)([NH+]4CCC4)CC3)cc2s1 ZINC000922846233 1044992631 /nfs/dbraw/zinc/99/26/31/1044992631.db2.gz YAAGSHHNFRQXRA-UHFFFAOYSA-N 2 0 329.513 4.101 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2cccc(-c3cccnc3)c2)CC1 ZINC000922847362 1044994010 /nfs/dbraw/zinc/99/40/10/1044994010.db2.gz NLWIGSLHMUEXEB-UHFFFAOYSA-N 2 0 335.495 4.245 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000347913514 1044998524 /nfs/dbraw/zinc/99/85/24/1044998524.db2.gz AEMWYYDXMLOGKU-ROUUACIJSA-N 2 0 340.515 4.096 20 0 EIADRP C[C@H]([NH2+]CCN1CCCC[C@@H]1C)[C@H](C)c1nc2ccccc2s1 ZINC000474479561 1045019869 /nfs/dbraw/zinc/01/98/69/1045019869.db2.gz YFBHHQZIWDXNKF-JYJNAYRXSA-N 2 0 331.529 4.252 20 0 EIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]Cc3ccc(C(C)(C)O)cc3)CC2)C1 ZINC000186605573 1045033349 /nfs/dbraw/zinc/03/33/49/1045033349.db2.gz DJWKGFPYVUETEO-LAUBAEHRSA-N 2 0 344.543 4.047 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](CC(c3ccccc3)c3ccccc3)CC[C@H]21 ZINC000509069627 1045054621 /nfs/dbraw/zinc/05/46/21/1045054621.db2.gz LDCIJLFNCAIJGV-JTHBVZDNSA-N 2 0 334.507 4.235 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@H]2Cc3ccccc32)CC1 ZINC000671746653 1045179359 /nfs/dbraw/zinc/17/93/59/1045179359.db2.gz QJQZRYNZIPPSIU-HWELCPFYSA-N 2 0 334.507 4.359 20 0 EIADRP c1ccc(N2CC[NH+](Cc3ccccc3C[NH2+]C3CCCC3)CC2)cc1 ZINC000915229719 1045202467 /nfs/dbraw/zinc/20/24/67/1045202467.db2.gz OMNADBBHCKDFAJ-UHFFFAOYSA-N 2 0 349.522 4.041 20 0 EIADRP Fc1cc2c(c(F)c1)CC[C@H]2[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000154567360 1045351001 /nfs/dbraw/zinc/35/10/01/1045351001.db2.gz OGFYIZUJIRKYDW-OAQYLSRUSA-N 2 0 342.433 4.338 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(OCc3ccc(C)cc3)cc2)C1 ZINC000236823222 1045367605 /nfs/dbraw/zinc/36/76/05/1045367605.db2.gz SISYZVMZWKMAIR-NRFANRHFSA-N 2 0 338.495 4.005 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cccc3c2OC(C)(C)C3)c1 ZINC000236880879 1045369567 /nfs/dbraw/zinc/36/95/67/1045369567.db2.gz CDKQCJGQHPFSAA-UHFFFAOYSA-N 2 0 338.495 4.142 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c(C)o1 ZINC000397537461 1045622852 /nfs/dbraw/zinc/62/28/52/1045622852.db2.gz JTBXMSJROHTHAB-QGZVFWFLSA-N 2 0 326.484 4.459 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1F ZINC000397546606 1045632940 /nfs/dbraw/zinc/63/29/40/1045632940.db2.gz OQIKQWUOLPBJGT-QGZVFWFLSA-N 2 0 326.459 4.389 20 0 EIADRP Cn1cccc1C[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000161747753 1046030816 /nfs/dbraw/zinc/03/08/16/1046030816.db2.gz JQDYPHHKPYDOSX-UHFFFAOYSA-N 2 0 325.500 4.079 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc2c(s1)CCC2 ZINC000162510458 1046320305 /nfs/dbraw/zinc/32/03/05/1046320305.db2.gz HUYQEVZHPXOCID-HNNXBMFYSA-N 2 0 344.524 4.028 20 0 EIADRP C[N@H+](CCCO)C1CCN(Cc2ccc(C3CCCCC3)cc2)CC1 ZINC000509682215 1046352012 /nfs/dbraw/zinc/35/20/12/1046352012.db2.gz FOTUBYCVWPBLMS-UHFFFAOYSA-N 2 0 344.543 4.013 20 0 EIADRP C[C@@H](NC1(c2ccccc2F)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508717798 1046374167 /nfs/dbraw/zinc/37/41/67/1046374167.db2.gz IBOBXUSGNOHDRE-IEBWSBKVSA-N 2 0 338.470 4.315 20 0 EIADRP Cc1ccsc1CC[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508722731 1046426212 /nfs/dbraw/zinc/42/62/12/1046426212.db2.gz UGQANSABYXSSDN-HKUYNNGSSA-N 2 0 328.525 4.099 20 0 EIADRP Cc1[nH+]ccc(NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1Cl ZINC000497251757 1046517905 /nfs/dbraw/zinc/51/79/05/1046517905.db2.gz ZWHMYUZBWDUWEV-DYVFJYSZSA-N 2 0 335.904 4.022 20 0 EIADRP C[C@@H](Cc1ccc(O)cc1)[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000509699072 1046576169 /nfs/dbraw/zinc/57/61/69/1046576169.db2.gz PWIYSYBJDASZCS-SFHVURJKSA-N 2 0 338.495 4.099 20 0 EIADRP C[C@@H](C[NH2+]C1CCN(C2CC2)CC1)c1c(Cl)cccc1Cl ZINC000459400555 1046597549 /nfs/dbraw/zinc/59/75/49/1046597549.db2.gz MPOZQEPELXBVRC-LBPRGKRZSA-N 2 0 327.299 4.313 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cc(C)c(C)cc2OC(F)F)C[C@@H]1C ZINC000536662082 1046632311 /nfs/dbraw/zinc/63/23/11/1046632311.db2.gz NSCXMZUIAFZNCO-RDJZCZTQSA-N 2 0 340.458 4.209 20 0 EIADRP CCC[N@H+](C)C[C@H]1CCN(Cc2ccccc2OC2CCCC2)C1 ZINC000536664512 1046635074 /nfs/dbraw/zinc/63/50/74/1046635074.db2.gz OSWBFBCINSPOKI-GOSISDBHSA-N 2 0 330.516 4.172 20 0 EIADRP FC(F)(F)[C@H]1CCCC[C@@H]1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459433669 1046665692 /nfs/dbraw/zinc/66/56/92/1046665692.db2.gz HFUDTFDPYDCCAK-PBHICJAKSA-N 2 0 341.421 4.009 20 0 EIADRP C[N@H+]1CC=C(C[NH2+]C/C=C\c2ccc(OCc3ccccc3)cc2)CC1 ZINC000459459376 1046697094 /nfs/dbraw/zinc/69/70/94/1046697094.db2.gz HKMIXVYQPAXEBN-YVMONPNESA-N 2 0 348.490 4.130 20 0 EIADRP C[C@H]1C[C@H](NCc2ccc(F)cc2F)CC[N@@H+]1Cc1ccccc1 ZINC000379622201 1046715463 /nfs/dbraw/zinc/71/54/63/1046715463.db2.gz GEOHMLPKQHEPCZ-HNAYVOBHSA-N 2 0 330.422 4.108 20 0 EIADRP C[N@@H+](C/C=C\c1ccccc1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000536729687 1046726685 /nfs/dbraw/zinc/72/66/85/1046726685.db2.gz MQOLZXHQMDDQOX-YVMONPNESA-N 2 0 335.495 4.333 20 0 EIADRP CCOc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000379643034 1046738201 /nfs/dbraw/zinc/73/82/01/1046738201.db2.gz ASJQLZYYGUZDMV-NQIIRXRSSA-N 2 0 338.495 4.228 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCCC2(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000379651227 1046744204 /nfs/dbraw/zinc/74/42/04/1046744204.db2.gz UJEQNTIMWVEJHV-QRQLOZEOSA-N 2 0 336.470 4.455 20 0 EIADRP Clc1cccc([C@H]2C[C@H]([NH2+]C3CCN(c4cc[nH+]cc4)CC3)C2)c1 ZINC000459542946 1046763381 /nfs/dbraw/zinc/76/33/81/1046763381.db2.gz OVENFTAIGRKPBJ-RUCARUNLSA-N 2 0 341.886 4.240 20 0 EIADRP Clc1cc2c(s1)CCC[C@@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459566888 1046787334 /nfs/dbraw/zinc/78/73/34/1046787334.db2.gz ZFDOTLLEFWTUGK-INIZCTEOSA-N 2 0 347.915 4.433 20 0 EIADRP COc1cccc([C@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC000536830192 1046805733 /nfs/dbraw/zinc/80/57/33/1046805733.db2.gz BGGWPOAJHBOZGQ-KKXNLOMOSA-N 2 0 330.516 4.389 20 0 EIADRP Cc1cccc(C[C@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C2CC2)c1 ZINC000536825086 1046808420 /nfs/dbraw/zinc/80/84/20/1046808420.db2.gz DUXOHMNQZYGNTR-QHCPKHFHSA-N 2 0 349.522 4.217 20 0 EIADRP COc1ccc2c(c1)CCC[C@@H]2[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000536836796 1046810586 /nfs/dbraw/zinc/81/05/86/1046810586.db2.gz BPFGVHQPWNFENJ-UTKZUKDTSA-N 2 0 330.516 4.030 20 0 EIADRP Cc1ccc([C@@H]2CCC[C@@H]2[NH2+]CCCC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000536855973 1046826182 /nfs/dbraw/zinc/82/61/82/1046826182.db2.gz CVIQTDCLMNLHJN-MXNKGDRCSA-N 2 0 344.543 4.110 20 0 EIADRP C[C@@H]([NH2+]Cc1cnc2ccccc2c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000536856945 1046827068 /nfs/dbraw/zinc/82/70/68/1046827068.db2.gz JCFWHSQYHMXORR-QGZVFWFLSA-N 2 0 349.478 4.026 20 0 EIADRP Cc1c2ccccc2oc1[C@H](C)[NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1 ZINC000536860660 1046828145 /nfs/dbraw/zinc/82/81/45/1046828145.db2.gz ZWJDLMMTJZEWTK-NUJGCVRESA-N 2 0 344.499 4.281 20 0 EIADRP CC(C)[C@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccc2[nH]c(=O)oc2c1 ZINC000536961940 1046870595 /nfs/dbraw/zinc/87/05/95/1046870595.db2.gz VMVPKWCRSKGGDB-BEFAXECRSA-N 2 0 345.487 4.085 20 0 EIADRP c1ccc(COC2CC([NH2+]C3CCC([NH+]4CCCCC4)CC3)C2)cc1 ZINC000786838436 1046873291 /nfs/dbraw/zinc/87/32/91/1046873291.db2.gz UUZQZRMREDDVAY-UHFFFAOYSA-N 2 0 342.527 4.121 20 0 EIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000786820028 1046876016 /nfs/dbraw/zinc/87/60/16/1046876016.db2.gz MEUHQANTAXXMCO-AVRDEDQJSA-N 2 0 344.543 4.397 20 0 EIADRP COc1ccc([C@H]([NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)C2CC2)cc1 ZINC000536946954 1046877789 /nfs/dbraw/zinc/87/77/89/1046877789.db2.gz BRUZMNDYWFAMTK-DYESRHJHSA-N 2 0 330.516 4.248 20 0 EIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+]CC[C@H]1CCC[N@@H+](C)C1 ZINC000459796844 1046893619 /nfs/dbraw/zinc/89/36/19/1046893619.db2.gz WLKVQCLGSLPSTE-ASNKMWSDSA-N 2 0 338.442 4.013 20 0 EIADRP C[NH+]1CCC2(CC1)C[C@@H]([NH2+]CC(C1CC1)C1CC1)c1ccccc1O2 ZINC000537191958 1047013205 /nfs/dbraw/zinc/01/32/05/1047013205.db2.gz JERSQWFUTOQNNM-HXUWFJFHSA-N 2 0 340.511 4.000 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H](CCc2ccccc2)Cc2ccccc2)CC1 ZINC000537303055 1047084891 /nfs/dbraw/zinc/08/48/91/1047084891.db2.gz AYRWSNIBIVMHFT-HSZRJFAPSA-N 2 0 334.507 4.082 20 0 EIADRP C[NH+]1CCC(CC[NH2+][C@@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000497840868 1047118894 /nfs/dbraw/zinc/11/88/94/1047118894.db2.gz PDZKYVMRRZLLNF-JOCHJYFZSA-N 2 0 349.478 4.239 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@@H]2CCc3nc(Cl)ccc32)C1 ZINC000806131613 1047124169 /nfs/dbraw/zinc/12/41/69/1047124169.db2.gz LFQHFACZTQITPY-BFYDXBDKSA-N 2 0 335.923 4.070 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCc3ccc(Cl)nc32)cc1 ZINC000788504020 1047206837 /nfs/dbraw/zinc/20/68/37/1047206837.db2.gz FOSDJNZYWVHUBW-GOSISDBHSA-N 2 0 343.902 4.354 20 0 EIADRP CC[NH+](CC)CCC[N@@H+]1CCCCC[C@@H]1C[C@H](O)c1cccs1 ZINC000788482681 1047214879 /nfs/dbraw/zinc/21/48/79/1047214879.db2.gz QLFJBWRDWADLMA-MSOLQXFVSA-N 2 0 338.561 4.148 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCSC(F)(F)F)CC1 ZINC000788556961 1047221930 /nfs/dbraw/zinc/22/19/30/1047221930.db2.gz IHGATWPWKTUVRJ-UHFFFAOYSA-N 2 0 346.462 4.272 20 0 EIADRP FC(F)(F)[C@H]1CCC[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)C1 ZINC000129220881 1047335227 /nfs/dbraw/zinc/33/52/27/1047335227.db2.gz ZUGZYLZXYNWOIS-ZWKOTPCHSA-N 2 0 340.433 4.493 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@H]([NH2+]C2CC[NH+](CC3CCCC3)CC2)C1 ZINC000129559038 1047430565 /nfs/dbraw/zinc/43/05/65/1047430565.db2.gz XDIOEDIIAWMGDD-WBVHZDCISA-N 2 0 332.454 4.352 20 0 EIADRP Cc1cccnc1[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)C(C)(C)C ZINC000897994606 1047523192 /nfs/dbraw/zinc/52/31/92/1047523192.db2.gz HDRKBSDELGVTOU-HXUWFJFHSA-N 2 0 338.499 4.131 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2ccc(F)c3ccccc32)CC[NH+](C)CC1 ZINC000556194095 1047551768 /nfs/dbraw/zinc/55/17/68/1047551768.db2.gz VIWIKMDKDLZKIK-HNNXBMFYSA-N 2 0 346.515 4.457 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]C[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000556238285 1047604189 /nfs/dbraw/zinc/60/41/89/1047604189.db2.gz IJXZORJHTHZLMA-DSXGEBMQSA-N 2 0 341.326 4.415 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@H](c3ccncc3)C3CC3)CC2)C1 ZINC000898322238 1047615794 /nfs/dbraw/zinc/61/57/94/1047615794.db2.gz IGTZEOQTCPNHHE-CZAAIQMYSA-N 2 0 327.516 4.165 20 0 EIADRP CC(C)C[C@H](CCO)C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000556261901 1047633375 /nfs/dbraw/zinc/63/33/75/1047633375.db2.gz OWMBPSSFUJPHOU-HWELCPFYSA-N 2 0 346.559 4.064 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2ccccc2-c2ccc(F)cc2)CC1 ZINC001168294741 1047664113 /nfs/dbraw/zinc/66/41/13/1047664113.db2.gz FPRVTFOMJAHUQD-UHFFFAOYSA-N 2 0 326.459 4.455 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H]2CCc3c2cccc3OC(F)(F)F)CC1 ZINC001168298149 1047677780 /nfs/dbraw/zinc/67/77/80/1047677780.db2.gz AYNBPUVRJYDALV-ZUEPYMLJSA-N 2 0 342.405 4.035 20 0 EIADRP C[NH+](C)C1CCC([NH2+]C(C)(C)c2cccc(C(F)(F)F)c2)CC1 ZINC001168299682 1047708800 /nfs/dbraw/zinc/70/88/00/1047708800.db2.gz MLDSTAXJARTPEK-UHFFFAOYSA-N 2 0 328.422 4.403 20 0 EIADRP COc1cccc([C@@H]([NH2+]C2CCC([NH+](C)C)CC2)c2ccccc2)c1 ZINC001168303905 1047734541 /nfs/dbraw/zinc/73/45/41/1047734541.db2.gz GBMLDQVTZCVDKM-AOMIVXANSA-N 2 0 338.495 4.247 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cccc(C2CC2)c1 ZINC000550629449 1047782492 /nfs/dbraw/zinc/78/24/92/1047782492.db2.gz QVJGVMBURCECDX-KZNAEPCWSA-N 2 0 330.516 4.104 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H](c2cncc(C(F)(F)F)c2)C2CC2)CC1 ZINC001168306308 1047788011 /nfs/dbraw/zinc/78/80/11/1047788011.db2.gz WEDBBTCJAWMBSS-JCYILVPMSA-N 2 0 341.421 4.014 20 0 EIADRP Cc1ccccc1[C@H](O)C[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000763435122 1047791306 /nfs/dbraw/zinc/79/13/06/1047791306.db2.gz ZJBLMAGGRXMRJD-SIKLNZKXSA-N 2 0 344.543 4.005 20 0 EIADRP Cc1ccc2c(C[N@@H+]3C[C@H]4C[NH+](Cc5ccccc5)C[C@H]4C3)c[nH]c2c1 ZINC001136974646 1048005693 /nfs/dbraw/zinc/00/56/93/1048005693.db2.gz HGKGXOOEZPEDRP-OYRHEFFESA-N 2 0 345.490 4.040 20 0 EIADRP C[C@]1(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)CC1(Cl)Cl ZINC000824971538 1048011884 /nfs/dbraw/zinc/01/18/84/1048011884.db2.gz SWKIQCWAHZRGIZ-INIZCTEOSA-N 2 0 333.347 4.347 20 0 EIADRP FC1(F)CC([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000556887848 1048100791 /nfs/dbraw/zinc/10/07/91/1048100791.db2.gz MGQXTUWWPAZQGA-BHIYHBOVSA-N 2 0 334.454 4.065 20 0 EIADRP CC[N@H+](Cc1ccccc1)C1CC[NH+]([C@@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170755457 1048109124 /nfs/dbraw/zinc/10/91/24/1048109124.db2.gz BSVCCCSJIMCBAZ-MZADTFQBSA-N 2 0 326.528 4.408 20 0 EIADRP Cc1cc2cc(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)ccc2[nH]1 ZINC000556899231 1048157971 /nfs/dbraw/zinc/15/79/71/1048157971.db2.gz ZIKSUHFKPCPAAC-UHFFFAOYSA-N 2 0 325.500 4.363 20 0 EIADRP C[NH+](C)CC1CC[NH+](Cc2ccc(C(F)(F)F)cc2Cl)CC1 ZINC001143711976 1048170688 /nfs/dbraw/zinc/17/06/88/1048170688.db2.gz NWJQAKKEJORDIL-UHFFFAOYSA-N 2 0 334.813 4.132 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1Cl)c1ccc(OCC[NH+](C)C)cc1 ZINC000132409314 1048288885 /nfs/dbraw/zinc/28/88/85/1048288885.db2.gz DVPICHCJDUXHFQ-OAHLLOKOSA-N 2 0 332.875 4.131 20 0 EIADRP CCc1nc(C(C)C)ccc1C[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000815106919 1048346718 /nfs/dbraw/zinc/34/67/18/1048346718.db2.gz GFXCMGDGRKRYNO-UHFFFAOYSA-N 2 0 329.532 4.075 20 0 EIADRP C[NH+](C)CCC(C)(C)[NH2+][C@@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171142672 1048452114 /nfs/dbraw/zinc/45/21/14/1048452114.db2.gz CAKBQNDHCRHDHW-CQSZACIVSA-N 2 0 329.315 4.171 20 0 EIADRP C[NH+]1CCC(C2CC[NH+](Cc3ccc(-n4cccc4)cc3)CC2)CC1 ZINC001144245866 1048534203 /nfs/dbraw/zinc/53/42/03/1048534203.db2.gz JSORFOSOSTXZIT-UHFFFAOYSA-N 2 0 337.511 4.031 20 0 EIADRP Cc1cc(F)ccc1[C@H](C)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000815622219 1048547558 /nfs/dbraw/zinc/54/75/58/1048547558.db2.gz PRERQPXJGDLASI-HKUYNNGSSA-N 2 0 326.459 4.307 20 0 EIADRP CCCCCC[C@@H](CC)[NH+]1CCN(CCC[NH+](CC)CC)CC1 ZINC001170599971 1048669481 /nfs/dbraw/zinc/66/94/81/1048669481.db2.gz AFWDESJLMFBNMR-HXUWFJFHSA-N 2 0 325.585 4.085 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@H](c3ccccc3)C2)[C@H](C)C1 ZINC000133313413 1048703046 /nfs/dbraw/zinc/70/30/46/1048703046.db2.gz REHZEMRASDYTNT-ZDFPQIBNSA-N 2 0 344.543 4.049 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CC[C@@]3(C)C[C@]3(F)Cl)CC2)C1 ZINC000846032147 1048800267 /nfs/dbraw/zinc/80/02/67/1048800267.db2.gz KEGOXONDNBXCAY-LAVFITLUSA-N 2 0 330.919 4.324 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC[C@@]1(C)C[C@@]1(F)Cl ZINC000846188815 1048838671 /nfs/dbraw/zinc/83/86/71/1048838671.db2.gz JTERVABTEPDIAM-BVBHFADKSA-N 2 0 338.898 4.191 20 0 EIADRP COCc1ccccc1/C=C(\C)C[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000816598703 1048840132 /nfs/dbraw/zinc/84/01/32/1048840132.db2.gz MUNIRBODMVBASH-XDJHFCHBSA-N 2 0 342.527 4.044 20 0 EIADRP CC(C)n1c2ccccc2nc1[C@H]1CCC[N@H+](CCCCCC[NH3+])C1 ZINC000846220941 1048843800 /nfs/dbraw/zinc/84/38/00/1048843800.db2.gz ZXBIOLDGFXECJA-SFHVURJKSA-N 2 0 342.531 4.316 20 0 EIADRP Cc1ccc(C)c([C@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000817894617 1049054721 /nfs/dbraw/zinc/05/47/21/1049054721.db2.gz NLLVCODARRYFIL-XJABCFGWSA-N 2 0 336.479 4.210 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](c1ccccc1)c1ccc2c(c1)CCCO2 ZINC000817912794 1049058319 /nfs/dbraw/zinc/05/83/19/1049058319.db2.gz XXUJGAVYBGSQDB-JTSKRJEESA-N 2 0 338.495 4.208 20 0 EIADRP CCOc1cccc2cc([C@@H](C)[NH2+]Cc3ccc(CC[NH3+])cc3)oc21 ZINC000817948397 1049063260 /nfs/dbraw/zinc/06/32/60/1049063260.db2.gz IWVLOSURJXRCER-OAHLLOKOSA-N 2 0 338.451 4.184 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccccc1OC(F)F ZINC000817949195 1049064238 /nfs/dbraw/zinc/06/42/38/1049064238.db2.gz NNUYNZZFIWRKTC-KRWDZBQOSA-N 2 0 334.410 4.030 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2C[NH3+])ccc1SC(F)F ZINC000817960098 1049069724 /nfs/dbraw/zinc/06/97/24/1049069724.db2.gz KNYMNEZWLGMZAZ-FPMFFAJLSA-N 2 0 344.471 4.178 20 0 EIADRP COc1cc([C@H](C)[NH2+]CC2(C)CC[NH2+]CC2)ccc1SC(F)F ZINC000817964988 1049072266 /nfs/dbraw/zinc/07/22/66/1049072266.db2.gz MARBSRPMIPWPBG-LBPRGKRZSA-N 2 0 344.471 4.050 20 0 EIADRP COc1cc([C@@H](C)[NH2+][C@@H](C)CCCC[NH3+])ccc1SC(F)F ZINC000817976470 1049075461 /nfs/dbraw/zinc/07/54/61/1049075461.db2.gz ZEDOZDKDCYXEGG-NWDGAFQWSA-N 2 0 332.460 4.178 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2ccnc(Cl)c2Cl)CC1 ZINC000811483732 1049080816 /nfs/dbraw/zinc/08/08/16/1049080816.db2.gz OBVCURFUTACJGO-UHFFFAOYSA-N 2 0 344.330 4.236 20 0 EIADRP C[NH+](C)Cc1ccc(CC[NH2+][C@@H]2CCc3cccc(Cl)c3C2)cc1 ZINC001170903174 1049143244 /nfs/dbraw/zinc/14/32/44/1049143244.db2.gz TYIIGVXUZIPPIB-LJQANCHMSA-N 2 0 342.914 4.091 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCC2)[C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170911483 1049186673 /nfs/dbraw/zinc/18/66/73/1049186673.db2.gz XVGNEPOUFJKNKL-KBAYOESNSA-N 2 0 332.919 4.322 20 0 EIADRP Clc1cccc2c1C[C@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)CC2 ZINC001170911694 1049197366 /nfs/dbraw/zinc/19/73/66/1049197366.db2.gz YYHOOGKFXXNNGT-LJQANCHMSA-N 2 0 346.946 4.442 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]C[C@H](O)c1ccc(Cl)cc1 ZINC000818962629 1049217074 /nfs/dbraw/zinc/21/70/74/1049217074.db2.gz UZRNXIHUAMGQNO-FQEVSTJZSA-N 2 0 346.902 4.003 20 0 EIADRP Fc1ccc2c(NC[C@@H]3CC[N@H+](CCc4ccccc4)C3)cc[nH+]c2c1 ZINC000078695525 1049272331 /nfs/dbraw/zinc/27/23/31/1049272331.db2.gz RQLZTUKQILXIOB-SFHVURJKSA-N 2 0 349.453 4.350 20 0 EIADRP C[C@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1cccc(C[NH+](C)C)c1 ZINC000820823171 1049559684 /nfs/dbraw/zinc/55/96/84/1049559684.db2.gz LZRMGYLOEKIMBY-PXNSSMCTSA-N 2 0 330.516 4.281 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+][C@@H]1CCc2cc(F)c(F)cc2C1)c1ccccc1 ZINC001171454971 1049709430 /nfs/dbraw/zinc/70/94/30/1049709430.db2.gz XXYISNKAVNGLTM-NQIIRXRSSA-N 2 0 344.449 4.105 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2ccccc2Oc2cccnc2)[C@@H](C)C1 ZINC000245412718 1049710326 /nfs/dbraw/zinc/71/03/26/1049710326.db2.gz AWSHODHLRMKYBK-PXNSSMCTSA-N 2 0 339.483 4.036 20 0 EIADRP Cc1cccc2c1CC[C@H]([NH2+]C1CC[NH+](C[C@H]3CC=CCC3)CC1)C2 ZINC001171563778 1049756091 /nfs/dbraw/zinc/75/60/91/1049756091.db2.gz MJMSILRNFOCPAX-UGKGYDQZSA-N 2 0 338.539 4.263 20 0 EIADRP C[NH+]1C(C)(C)CC([NH+]2CCC(Oc3ccccc3)CC2)CC1(C)C ZINC001171630812 1049762454 /nfs/dbraw/zinc/76/24/54/1049762454.db2.gz CJJQLJRTQIIPLE-UHFFFAOYSA-N 2 0 330.516 4.181 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc(Br)cc2)CC1(C)C ZINC001171622269 1049767878 /nfs/dbraw/zinc/76/78/78/1049767878.db2.gz YSDWUNPLTYESON-UHFFFAOYSA-N 2 0 339.321 4.190 20 0 EIADRP CC(C)Oc1ccc(CC[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1 ZINC001171622971 1049768514 /nfs/dbraw/zinc/76/85/14/1049768514.db2.gz FOJXRXNIXQYVDT-UHFFFAOYSA-N 2 0 332.532 4.257 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc(-c3cccnc3)cc2)CC1(C)C ZINC001171624541 1049768621 /nfs/dbraw/zinc/76/86/21/1049768621.db2.gz VTFIGQGGZQFXFF-UHFFFAOYSA-N 2 0 337.511 4.490 20 0 EIADRP Cc1ccc(CC[C@@H](C)[NH+]2CCC([NH3+])(Cc3ccccc3)CC2)cc1 ZINC001171666034 1049772856 /nfs/dbraw/zinc/77/28/56/1049772856.db2.gz LHZBEFVJRNBCJJ-HXUWFJFHSA-N 2 0 336.523 4.352 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706774 1049775767 /nfs/dbraw/zinc/77/57/67/1049775767.db2.gz MACDXJRERGAPMZ-GBESFXJTSA-N 2 0 348.481 4.161 20 0 EIADRP C[NH+]1C(C)(C)CC(n2c3ccc(F)cc3c3c2CC[NH2+]C3)CC1(C)C ZINC001171639537 1049778712 /nfs/dbraw/zinc/77/87/12/1049778712.db2.gz OAXFTFRECFAIBC-UHFFFAOYSA-N 2 0 343.490 4.250 20 0 EIADRP C[NH+]1C(C)(C)CC([NH+]2CCC(c3cccc(O)c3)CC2)CC1(C)C ZINC001171641344 1049778744 /nfs/dbraw/zinc/77/87/44/1049778744.db2.gz PGKFUFDETZRDBB-UHFFFAOYSA-N 2 0 330.516 4.223 20 0 EIADRP Cc1ccc2c(CC[NH3+])cn([C@@H]3C[C@H](C)[N@@H+](Cc4ccccc4)C3)c2c1 ZINC001171724860 1049784648 /nfs/dbraw/zinc/78/46/48/1049784648.db2.gz DBGBJUKWAUSABI-GHTZIAJQSA-N 2 0 347.506 4.286 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)CCN1C ZINC000245605363 1049794747 /nfs/dbraw/zinc/79/47/47/1049794747.db2.gz QWFCCIPQIIGIAQ-DQYPLSBCSA-N 2 0 326.406 4.229 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+]([C@@H]2Cc3cccc(F)c3C2)C2CCCCC2)CC1 ZINC001171786024 1049804685 /nfs/dbraw/zinc/80/46/85/1049804685.db2.gz WNEXOCXEPJGJGN-BHIYHBOVSA-N 2 0 330.491 4.198 20 0 EIADRP C[N@H+]([C@H]1Cc2cccc(F)c2C1)C1CC[NH+](C2CCCCC2)CC1 ZINC001171812147 1049809481 /nfs/dbraw/zinc/80/94/81/1049809481.db2.gz LIXFTXGDHWSXSL-IBGZPJMESA-N 2 0 330.491 4.022 20 0 EIADRP CC1(C)C[C@H]([NH2+]Cc2ccc(F)cc2)CC[N@@H+]1Cc1ccccc1 ZINC001171966221 1049826472 /nfs/dbraw/zinc/82/64/72/1049826472.db2.gz UGHPQZJAGMRFAY-HXUWFJFHSA-N 2 0 326.459 4.359 20 0 EIADRP CC(C)([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1cccnc1 ZINC001171965726 1049826819 /nfs/dbraw/zinc/82/68/19/1049826819.db2.gz QSTXATSDXWUEGV-HXUWFJFHSA-N 2 0 337.511 4.350 20 0 EIADRP CC1(C)C[C@@H](C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CCO1 ZINC001171978674 1049838417 /nfs/dbraw/zinc/83/84/17/1049838417.db2.gz IJPMVEBTECYQFG-VQTJNVASSA-N 2 0 344.543 4.224 20 0 EIADRP CC1(C)C[C@@H]([NH+]2CC[C@]3(C2)CCCCO3)CC[N@@H+]1Cc1ccccc1 ZINC001171981734 1049838627 /nfs/dbraw/zinc/83/86/27/1049838627.db2.gz NGCUDPYJFMHABE-UNMCSNQZSA-N 2 0 342.527 4.075 20 0 EIADRP C[N@H+](C[C@@H]1CCCCO1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076438 1049843848 /nfs/dbraw/zinc/84/38/48/1049843848.db2.gz YOKNTWVFPLFCQJ-CBPXPLCBSA-N 2 0 342.527 4.073 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H]([NH2+][C@@H]2CCc4ncccc42)C3)cc1 ZINC001172077021 1049845635 /nfs/dbraw/zinc/84/56/35/1049845635.db2.gz OGECTQHXZGKJCB-ISHFTEKXSA-N 2 0 347.506 4.244 20 0 EIADRP CC(C)O[C@@H]1CC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172082432 1049847880 /nfs/dbraw/zinc/84/78/80/1049847880.db2.gz JWBQXKNRWMHQCY-CLAROIROSA-N 2 0 342.527 4.071 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC[C@@]3(CCc4c3cccc4F)C1)C2 ZINC001172133615 1049855125 /nfs/dbraw/zinc/85/51/25/1049855125.db2.gz UACFFLSCCOQYKS-WYADAEROSA-N 2 0 342.502 4.121 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H](CC1CCOCC1)c1ccccc1)C2 ZINC001172108401 1049856323 /nfs/dbraw/zinc/85/63/23/1049856323.db2.gz AAORPMLCJSBXIZ-CIAFKFPVSA-N 2 0 342.527 4.149 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH+]1CCC3(CCCc4ccccc43)CC1)C2 ZINC001172120678 1049858251 /nfs/dbraw/zinc/85/82/51/1049858251.db2.gz LMJOYVGRJXWKGW-AERCQKQUSA-N 2 0 338.539 4.372 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC1c3ccccc3-c3ccccc31)C2 ZINC001172112053 1049858605 /nfs/dbraw/zinc/85/86/05/1049858605.db2.gz ZUUZKOADQZRZLS-BCDXTJNWSA-N 2 0 332.491 4.404 20 0 EIADRP Cc1ccc2c(C[C@@H](C)[NH3+])cn([C@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4C)c2c1 ZINC001172113283 1049858857 /nfs/dbraw/zinc/85/88/57/1049858857.db2.gz BTLIXCVKTDMHAZ-YSHGAJCASA-N 2 0 325.500 4.027 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](N[C@H](c1ccccc1)[C@@H]([NH3+])c1ccccc1)C2 ZINC001172119426 1049859031 /nfs/dbraw/zinc/85/90/31/1049859031.db2.gz ZQJMJDQJRVPUSB-MFKCLSPESA-N 2 0 349.522 4.033 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H](n1cc(C(C)(C)C[NH3+])c3ccccc31)C2 ZINC001172114069 1049859035 /nfs/dbraw/zinc/85/90/35/1049859035.db2.gz LSIOAIAKBMDSFN-FVQHAEBGSA-N 2 0 325.500 4.065 20 0 EIADRP c1ccc2c(c1)C[C@H]([NH2+]CC1CC[NH+](C3CCCCC3)CC1)CS2 ZINC001172185437 1049860210 /nfs/dbraw/zinc/86/02/10/1049860210.db2.gz BXWIPAKRVQHLNM-IBGZPJMESA-N 2 0 344.568 4.338 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccc(Cl)cc2)C2C[C@H]3CC[C@@H](C2)O3)CC1 ZINC001172222424 1049867594 /nfs/dbraw/zinc/86/75/94/1049867594.db2.gz GYVYKSLWZMVFOA-LJRDSGNISA-N 2 0 348.918 4.122 20 0 EIADRP CC(C)(C)C[NH+]1CCC(C[NH2+][C@@H]2CSc3ccccc3C2)CC1 ZINC001172198715 1049869273 /nfs/dbraw/zinc/86/92/73/1049869273.db2.gz SALTWKQXNCZUHJ-SFHVURJKSA-N 2 0 332.557 4.051 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@H]2CCc3c(Cl)cccc3C2)C[C@@](C)(C[NH3+])C1 ZINC001171027816 1049872771 /nfs/dbraw/zinc/87/27/71/1049872771.db2.gz TUDJIGJUGNRZHS-TWOQFEAHSA-N 2 0 334.935 4.331 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[NH2+]CC1CC[NH+](CC2CCCCC2)CC1 ZINC001172326350 1049879980 /nfs/dbraw/zinc/87/99/80/1049879980.db2.gz CRTCDMXQECZUGS-OALUTQOASA-N 2 0 338.580 4.462 20 0 EIADRP CC[C@H](C)OCC[C@@H](C)[NH+]1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC001172340450 1049888516 /nfs/dbraw/zinc/88/85/16/1049888516.db2.gz KBARCGNPTXHPAJ-MOPGFXCFSA-N 2 0 332.532 4.177 20 0 EIADRP CC[C@H](C)OCC[C@@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1C ZINC001172353461 1049893215 /nfs/dbraw/zinc/89/32/15/1049893215.db2.gz XAHPKWRBVBHRPK-JBPLPALLSA-N 2 0 346.559 4.328 20 0 EIADRP CCOCC[C@H](C)[N@@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001172427388 1049900830 /nfs/dbraw/zinc/90/08/30/1049900830.db2.gz OVETZYOVSGKTGP-FQEVSTJZSA-N 2 0 344.543 4.180 20 0 EIADRP CCOCC[C@@H](C)[NH+]1CCC2(CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001172434441 1049902245 /nfs/dbraw/zinc/90/22/45/1049902245.db2.gz WJHKXOWSFPLNII-HXUWFJFHSA-N 2 0 344.543 4.180 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CCCC[NH+]1CCCC1 ZINC001172575135 1049941409 /nfs/dbraw/zinc/94/14/09/1049941409.db2.gz HOVAIXLHXQWTRL-AWEZNQCLSA-N 2 0 344.877 4.405 20 0 EIADRP CC(C)([NH3+])CCNCCC(C)(C)[NH2+][C@H]1CCC[C@@H](c2ccccc2)C1 ZINC001172535809 1049942744 /nfs/dbraw/zinc/94/27/44/1049942744.db2.gz JKIORAYWSZSHDZ-UXHICEINSA-N 2 0 345.575 4.188 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)CCc2c(F)cc(Cl)cc2F)CC1 ZINC001172578098 1049951949 /nfs/dbraw/zinc/95/19/49/1049951949.db2.gz ZJIILZKAXHCPKD-ZDUSSCGKSA-N 2 0 344.877 4.402 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+]C1CCC2(CCCC2)CC1 ZINC001172724688 1049965964 /nfs/dbraw/zinc/96/59/64/1049965964.db2.gz XBSGJPANAISYLU-UHFFFAOYSA-N 2 0 330.516 4.220 20 0 EIADRP COc1ccc2oc(C[NH2+]C3CCC([NH+]4CCCCC4)CC3)cc2c1 ZINC000763485805 1049972236 /nfs/dbraw/zinc/97/22/36/1049972236.db2.gz NQFWBEJWQFWZOO-UHFFFAOYSA-N 2 0 342.483 4.328 20 0 EIADRP CCC[N@@H+]1CC[C@@H](CN[C@H](C)c2nc(-c3ccccc3)cs2)C1 ZINC000247114636 1050012913 /nfs/dbraw/zinc/01/29/13/1050012913.db2.gz QVDJXEVDCKRJMK-CVEARBPZSA-N 2 0 329.513 4.193 20 0 EIADRP Cc1nccnc1[C@@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000249208292 1050094446 /nfs/dbraw/zinc/09/44/46/1050094446.db2.gz WXTIOXPRGQORKZ-SJLPKXTDSA-N 2 0 338.499 4.010 20 0 EIADRP Clc1cc2c(c(Cl)c1)CC[C@@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000089695999 1050128701 /nfs/dbraw/zinc/12/87/01/1050128701.db2.gz PRPLALUPGOEJQE-GTNSWQLSSA-N 2 0 325.283 4.055 20 0 EIADRP c1ccc(OCc2cccc(C[NH2+]CCC[NH+]3CCCCC3)c2)cc1 ZINC001177136604 1050154260 /nfs/dbraw/zinc/15/42/60/1050154260.db2.gz SJEIDHMGVAYGEP-UHFFFAOYSA-N 2 0 338.495 4.231 20 0 EIADRP FC(F)Oc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC001177136595 1050155037 /nfs/dbraw/zinc/15/50/37/1050155037.db2.gz RXDUCASODMXZFU-UHFFFAOYSA-N 2 0 346.421 4.174 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc3ccccc3)C1)CC2 ZINC001172825422 1050166620 /nfs/dbraw/zinc/16/66/20/1050166620.db2.gz GXKYYGRURNLFIJ-URXFXBBRSA-N 2 0 348.534 4.354 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ccc(F)c3cccnc23)C1 ZINC001177289270 1050177675 /nfs/dbraw/zinc/17/76/75/1050177675.db2.gz BZVNKCWKQZBBJQ-IAGOWNOFSA-N 2 0 343.490 4.222 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1csc(Br)c1 ZINC001177299146 1050180612 /nfs/dbraw/zinc/18/06/12/1050180612.db2.gz LAFJZRFRBSIZTR-CYBMUJFWSA-N 2 0 345.350 4.255 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]C/C=C\c1cccc(F)c1 ZINC001177277631 1050186195 /nfs/dbraw/zinc/18/61/95/1050186195.db2.gz MMMMAQVIWXRCNU-CLFYSBASSA-N 2 0 326.459 4.469 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[N@@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001172849777 1050189082 /nfs/dbraw/zinc/18/90/82/1050189082.db2.gz PNGUXNBKNGAPCJ-HUUCEWRRSA-N 2 0 326.887 4.251 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]C1CC[NH+](CC2CCC2)CC1 ZINC001172855948 1050193247 /nfs/dbraw/zinc/19/32/47/1050193247.db2.gz BKOIKZBVGRKPMN-AWEZNQCLSA-N 2 0 338.898 4.264 20 0 EIADRP CC(C)C[NH+]1CCC(C[NH2+][C@H](C)Cc2ccc(F)cc2Cl)CC1 ZINC001172859143 1050196940 /nfs/dbraw/zinc/19/69/40/1050196940.db2.gz ROKJENSXIPVUIV-OAHLLOKOSA-N 2 0 340.914 4.368 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@H](C)Cc2ccc(F)cc2Cl)CC1 ZINC001172860672 1050198364 /nfs/dbraw/zinc/19/83/64/1050198364.db2.gz NLYDWIVWTBQCRV-CQSZACIVSA-N 2 0 326.887 4.120 20 0 EIADRP CC(C)[NH+]1CCC(C[NH2+][C@@H](C)Cc2ccc(F)cc2Cl)CC1 ZINC001172863766 1050200027 /nfs/dbraw/zinc/20/00/27/1050200027.db2.gz QBKRCQYMOGIYAZ-AWEZNQCLSA-N 2 0 326.887 4.120 20 0 EIADRP C[C@H](C[NH2+]Cc1cccc(Oc2ccccn2)c1)C[NH+]1CCCCC1 ZINC001177416511 1050210053 /nfs/dbraw/zinc/21/00/53/1050210053.db2.gz QXRSZHVWZQUSTM-GOSISDBHSA-N 2 0 339.483 4.086 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1CC[C@@H]([NH+](C)C)CC1 ZINC001172873592 1050212270 /nfs/dbraw/zinc/21/22/70/1050212270.db2.gz NOFHXXCMFZSXDX-BMFZPTHFSA-N 2 0 326.937 4.283 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH2+]CC[C@H]1CCC[N@H+](C)C1 ZINC001172876082 1050216452 /nfs/dbraw/zinc/21/64/52/1050216452.db2.gz VZSSATJYUCOIDV-HUUCEWRRSA-N 2 0 326.937 4.142 20 0 EIADRP C[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1cccc2ccccc21 ZINC000090937010 1050218360 /nfs/dbraw/zinc/21/83/60/1050218360.db2.gz DWLNEXKWRAEDOR-QGZVFWFLSA-N 2 0 349.478 4.026 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[N@H+](C)CC1CC[NH+](C)CC1 ZINC001172879497 1050220161 /nfs/dbraw/zinc/22/01/61/1050220161.db2.gz NVXATUXQJVMKDJ-CQSZACIVSA-N 2 0 326.937 4.094 20 0 EIADRP CO[C@H]1CCC[C@H]([N@H+]2C[C@H]3c4ccccc4[C@H]([NH+](C)C(C)C)[C@H]3C2)C1 ZINC001172943936 1050243459 /nfs/dbraw/zinc/24/34/59/1050243459.db2.gz VGVRMMORFWDIIV-NXQKYAITSA-N 2 0 342.527 4.055 20 0 EIADRP CC(C)n1cc(C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)cn1 ZINC001177565762 1050252702 /nfs/dbraw/zinc/25/27/02/1050252702.db2.gz HJQWKMRMYGCQEE-UHFFFAOYSA-N 2 0 340.515 4.130 20 0 EIADRP C[C@@H](CC[NH+](C)C)[NH2+]C/C=C\c1ccc(OCc2ccccc2)cc1 ZINC001177565839 1050253850 /nfs/dbraw/zinc/25/38/50/1050253850.db2.gz JZMOLFQHOIQYAO-KWEPMOPPSA-N 2 0 338.495 4.209 20 0 EIADRP C[NH+](C)CC[C@@H]([NH2+]C1CCC2(CCOCC2)CC1)c1ccccc1 ZINC001173039879 1050268647 /nfs/dbraw/zinc/26/86/47/1050268647.db2.gz RKJRVOCKBULWNR-HXUWFJFHSA-N 2 0 330.516 4.008 20 0 EIADRP Cn1c(C[NH2+]CCCCCCC[NH+]2CCCC2)cc2ccccc21 ZINC001177737536 1050289281 /nfs/dbraw/zinc/28/92/81/1050289281.db2.gz PLJDOJYATIRFEN-UHFFFAOYSA-N 2 0 327.516 4.314 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2cnc(Cl)cc2Cl)CC1 ZINC001173104459 1050304817 /nfs/dbraw/zinc/30/48/17/1050304817.db2.gz PTYFUOWEBGIKAH-UHFFFAOYSA-N 2 0 330.303 4.131 20 0 EIADRP CCO[C@H]1CCC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)C1 ZINC001177803800 1050305368 /nfs/dbraw/zinc/30/53/68/1050305368.db2.gz HKQKTKXNFPBOJV-VXKWHMMOSA-N 2 0 344.543 4.500 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccccc2-c2cccnc2)CC1 ZINC001173104678 1050305257 /nfs/dbraw/zinc/30/52/57/1050305257.db2.gz ULVKVDADDABPMM-UHFFFAOYSA-N 2 0 337.511 4.491 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2(Cc3ccc(OC)cc3)CC2)CC1 ZINC001173107149 1050307804 /nfs/dbraw/zinc/30/78/04/1050307804.db2.gz WZVKMIYJRBUEJY-UHFFFAOYSA-N 2 0 330.516 4.013 20 0 EIADRP CC(C)(C)C[NH+]1CCC([NH2+]C2CCC(Oc3ccccc3)CC2)CC1 ZINC001173199283 1050342519 /nfs/dbraw/zinc/34/25/19/1050342519.db2.gz ZTHMQWKJQLKZBT-UHFFFAOYSA-N 2 0 344.543 4.477 20 0 EIADRP CCc1ccc(C[C@@H](C)[NH+]2CCC([NH3+])(Cc3ccccc3)CC2)cc1 ZINC001173249202 1050376391 /nfs/dbraw/zinc/37/63/91/1050376391.db2.gz KGZYYBHVHBGKKZ-LJQANCHMSA-N 2 0 336.523 4.216 20 0 EIADRP CCSC[C@H](C)[NH2+]CC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC001173295229 1050398368 /nfs/dbraw/zinc/39/83/68/1050398368.db2.gz KDIDFQHYGLOBEE-HNNXBMFYSA-N 2 0 340.964 4.283 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+][C@H]2CC[C@@H](C)SC2)C[N@@H+]1Cc1ccccc1 ZINC001178207160 1050404435 /nfs/dbraw/zinc/40/44/35/1050404435.db2.gz APOXJDJCPXDXKK-JYBIWHBTSA-N 2 0 332.557 4.161 20 0 EIADRP CCSC[C@@H](C)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001173306367 1050404640 /nfs/dbraw/zinc/40/46/40/1050404640.db2.gz TYUONFRNQPHAMP-GOSISDBHSA-N 2 0 332.557 4.116 20 0 EIADRP COc1ccccc1/C=C\C[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC001178280424 1050426334 /nfs/dbraw/zinc/42/63/34/1050426334.db2.gz CDRDTVFGFKCWIF-ALCCZGGFSA-N 2 0 342.527 4.341 20 0 EIADRP CC(C)([NH3+])CCNCCC(C)(C)[NH2+][C@@H]1CCCC2(CCCCC2)C1 ZINC001173338636 1050428465 /nfs/dbraw/zinc/42/84/65/1050428465.db2.gz BODDESKZZWOBDK-GOSISDBHSA-N 2 0 337.596 4.355 20 0 EIADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)cc1 ZINC001178284841 1050428940 /nfs/dbraw/zinc/42/89/40/1050428940.db2.gz CTZVDLJPZFNAEF-RJGXRXQPSA-N 2 0 334.507 4.385 20 0 EIADRP CCSC[C@H](C)[N@@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001173316897 1050439255 /nfs/dbraw/zinc/43/92/55/1050439255.db2.gz ZXJXFAKGJBTVDR-ICSRJNTNSA-N 2 0 332.557 4.116 20 0 EIADRP CCSC[C@@H](C)[N@@H+]1CCC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001173316899 1050440059 /nfs/dbraw/zinc/44/00/59/1050440059.db2.gz ZXJXFAKGJBTVDR-UYAOXDASSA-N 2 0 332.557 4.116 20 0 EIADRP Cc1ccccc1N(C)c1ccc(C[N@@H+]2CC[C@H]([NH3+])[C@@H](F)CC2)cc1 ZINC001206200336 1050455428 /nfs/dbraw/zinc/45/54/28/1050455428.db2.gz RDIFAKHMJAFRJT-PMACEKPBSA-N 2 0 341.474 4.024 20 0 EIADRP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC001173540377 1050475994 /nfs/dbraw/zinc/47/59/94/1050475994.db2.gz WMLPRIWYNPAOML-DZGCQCFKSA-N 2 0 329.315 4.388 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001173553721 1050481606 /nfs/dbraw/zinc/48/16/06/1050481606.db2.gz XZAUYNIFUIXASL-BMFZPTHFSA-N 2 0 341.326 4.198 20 0 EIADRP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH+]1CCC2(C[NH+](C)C2)CC1 ZINC001173550593 1050487738 /nfs/dbraw/zinc/48/77/38/1050487738.db2.gz MBDQHBDUDQOZBN-AWEZNQCLSA-N 2 0 341.326 4.342 20 0 EIADRP CCOC(=O)[C@@H]1CC12CCC([NH2+]CC[PH+](C(C)C)C(C)C)CC2 ZINC001173609910 1050508615 /nfs/dbraw/zinc/50/86/15/1050508615.db2.gz VZSLNADSYYRQQZ-HFCFLWKCSA-N 2 0 341.476 4.387 20 0 EIADRP [NH3+]CCC1CCC([NH2+]C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173685622 1050537434 /nfs/dbraw/zinc/53/74/34/1050537434.db2.gz XZGBPGSAVUZGDP-UHFFFAOYSA-N 2 0 326.528 4.310 20 0 EIADRP C[NH+](C)[C@H]1CC[C@@H]([NH2+]C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173685887 1050538438 /nfs/dbraw/zinc/53/84/38/1050538438.db2.gz GULQJLPJBSHHPQ-QTSWCKFRSA-N 2 0 326.528 4.276 20 0 EIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+]CCC(C)(C)C2CC2)CC1 ZINC001178817303 1050574695 /nfs/dbraw/zinc/57/46/95/1050574695.db2.gz OUGSMPVZJVEJAC-UHFFFAOYSA-N 2 0 349.950 4.008 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC001179277992 1050669229 /nfs/dbraw/zinc/66/92/29/1050669229.db2.gz PZDFFLNSSHDBDE-YADHBBJMSA-N 2 0 344.543 4.082 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccccc2N(C)C)c1 ZINC000093943470 1050724588 /nfs/dbraw/zinc/72/45/88/1050724588.db2.gz HTUKOQPYQCKDGL-GOSISDBHSA-N 2 0 339.527 4.444 20 0 EIADRP CCc1ccc(C[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)o1 ZINC001179771409 1050767267 /nfs/dbraw/zinc/76/72/67/1050767267.db2.gz CNEBXRAPLJGOCQ-HSALFYBXSA-N 2 0 338.495 4.232 20 0 EIADRP Cc1cc(C[NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)c(C)o1 ZINC001203283431 1050943958 /nfs/dbraw/zinc/94/39/58/1050943958.db2.gz RYCYPOLCSKMNFF-UHFFFAOYSA-N 2 0 326.484 4.288 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+]CCCc2c(Cl)cccc2Cl)CC1 ZINC001180302570 1050944227 /nfs/dbraw/zinc/94/42/27/1050944227.db2.gz ZOMPXYLTTFAMKA-UHFFFAOYSA-N 2 0 329.315 4.248 20 0 EIADRP C[C@@]1(c2ccccc2)CC[C@H]([NH+]2CCC([NH+]3CCCCC3)CC2)C1 ZINC001180540032 1051029893 /nfs/dbraw/zinc/02/98/93/1051029893.db2.gz FVJWQLOCJVAOIS-FCHUYYIVSA-N 2 0 326.528 4.447 20 0 EIADRP Cc1c[nH+]ccc1Nc1cccc2c1C[N@H+](C)C[C@@H]2c1ccccc1 ZINC001174539261 1051031774 /nfs/dbraw/zinc/03/17/74/1051031774.db2.gz ZYAMRGYSWWXDOW-LJQANCHMSA-N 2 0 329.447 4.133 20 0 EIADRP C[C@@H]1CCCc2ccccc2[C@@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC001180622198 1051041653 /nfs/dbraw/zinc/04/16/53/1051041653.db2.gz CLRFXDOFHRPPFK-VGOFRKELSA-N 2 0 335.495 4.354 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H](C)Cc2ccco2)ccc1OC ZINC000775365985 1051134845 /nfs/dbraw/zinc/13/48/45/1051134845.db2.gz RTAJJTMJTSOFIH-IRXDYDNUSA-N 2 0 344.499 4.412 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CCc2ccsc2)ccc1OC ZINC000775365187 1051135378 /nfs/dbraw/zinc/13/53/78/1051135378.db2.gz PAHFXVCTRHNTAA-INIZCTEOSA-N 2 0 346.540 4.492 20 0 EIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCSCc3ccccc3)C2)CC1 ZINC001190651732 1051245798 /nfs/dbraw/zinc/24/57/98/1051245798.db2.gz QAIQXZSSBHNJNF-OAQYLSRUSA-N 2 0 346.584 4.364 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)[C@H]1CCCC[C@H]1C ZINC001181656515 1051272458 /nfs/dbraw/zinc/27/24/58/1051272458.db2.gz SBPXSERFGALTKE-FGSXEWAUSA-N 2 0 344.543 4.464 20 0 EIADRP COc1ccc([C@@H](C)[NH2+][C@@H]2CC=CCC2)cc1C[NH+]1CCCCC1 ZINC000775412112 1051273771 /nfs/dbraw/zinc/27/37/71/1051273771.db2.gz RXHHUVYEUOGOEK-YLJYHZDGSA-N 2 0 328.500 4.440 20 0 EIADRP [NH3+]C[C@@]1(F)CCC[N@H+](CCCc2ccc(Cl)c(Cl)c2)CC1 ZINC001205546420 1051320101 /nfs/dbraw/zinc/32/01/01/1051320101.db2.gz VDLCWKLLDXLGEG-MRXNPFEDSA-N 2 0 333.278 4.079 20 0 EIADRP C([C@H]1CCC2(CCCCCC2)O1)[N@@H+]1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC001191069969 1051339044 /nfs/dbraw/zinc/33/90/44/1051339044.db2.gz JDXLWRBGTDZLKN-VQTJNVASSA-N 2 0 334.548 4.066 20 0 EIADRP C=Cc1ccc(CC[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC001181945461 1051359071 /nfs/dbraw/zinc/35/90/71/1051359071.db2.gz MFCASKALIGYAED-WMZHIEFXSA-N 2 0 334.507 4.372 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+](CCc1cccc(Cl)c1Cl)CC2 ZINC001175211230 1051445096 /nfs/dbraw/zinc/44/50/96/1051445096.db2.gz LGKKXWVRRMRVDV-UHFFFAOYSA-N 2 0 341.326 4.344 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCc2c(Cl)cccc2Cl)C[C@H]1C ZINC001191417640 1051453053 /nfs/dbraw/zinc/45/30/53/1051453053.db2.gz PZSKEHNRLJOPMB-ZIAGYGMSSA-N 2 0 329.315 4.341 20 0 EIADRP COc1cc(C)ccc1[C@@H](C)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311188774 1051468976 /nfs/dbraw/zinc/46/89/76/1051468976.db2.gz DJWVWNJTRNVTPU-UYAOXDASSA-N 2 0 338.495 4.176 20 0 EIADRP C[C@H](CC[NH2+][C@H]1CC[N@H+](C)C[C@H]1C)c1cccc(C(F)(F)F)c1 ZINC000155868302 1051469087 /nfs/dbraw/zinc/46/90/87/1051469087.db2.gz KTWOGAWJMHEAIV-CPUCHLNUSA-N 2 0 328.422 4.129 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1 ZINC000774272129 1051541357 /nfs/dbraw/zinc/54/13/57/1051541357.db2.gz NJPRFZIJDVZKJF-ZNDGOPKYSA-N 2 0 327.516 4.098 20 0 EIADRP Cc1cc(Nc2ccc(C[NH+]3CCCCC3)cc2)n(-c2cc[nH+]cc2)n1 ZINC001175362654 1051550036 /nfs/dbraw/zinc/55/00/36/1051550036.db2.gz ULCOVVZEZXOUFN-UHFFFAOYSA-N 2 0 347.466 4.305 20 0 EIADRP C[N@@H+]1C[C@@H](C[NH2+][C@@H]2CC[C@@](C)(c3ccccc3)C2)[C@H](c2ccccc2)C1 ZINC001182542187 1051636362 /nfs/dbraw/zinc/63/63/62/1051636362.db2.gz CKLFNZKYPJBNHJ-CAUSLRQDSA-N 2 0 348.534 4.432 20 0 EIADRP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC001182617031 1051661504 /nfs/dbraw/zinc/66/15/04/1051661504.db2.gz YJKWFJYXWBZXDB-WQVCFCJDSA-N 2 0 329.315 4.244 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](C[C@H]2[C@H](c3ccccc3)C2(F)F)CC1 ZINC001192261033 1051675819 /nfs/dbraw/zinc/67/58/19/1051675819.db2.gz BJRQZSCBJMXHJR-OALUTQOASA-N 2 0 336.470 4.089 20 0 EIADRP C[C@@H]1[C@H](c2ccccc2)c2ccccc2CC[N@@H+]1CCCn1ccnc1 ZINC001192334055 1051692092 /nfs/dbraw/zinc/69/20/92/1051692092.db2.gz GKCQQYDYDSECCJ-AUSIDOKSSA-N 2 0 345.490 4.352 20 0 EIADRP Cc1ccc(CC[NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)cc1C ZINC001182817343 1051719293 /nfs/dbraw/zinc/71/92/93/1051719293.db2.gz SKGSCOPHILUZSF-VXNXHJTFSA-N 2 0 348.534 4.489 20 0 EIADRP c1cc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cc2c1CCC2 ZINC001192400100 1051724126 /nfs/dbraw/zinc/72/41/26/1051724126.db2.gz HLCUKVWHBDSKIP-UHFFFAOYSA-N 2 0 326.528 4.263 20 0 EIADRP CC[N@H+](CCC1CC[NH+](C[C@@H](O)c2ccc(C)cc2)CC1)CC(C)C ZINC001192491049 1051745551 /nfs/dbraw/zinc/74/55/51/1051745551.db2.gz ZEAMAVZMBAOGCP-JOCHJYFZSA-N 2 0 346.559 4.108 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2c(C)nsc2C)CC1)CC1CC1 ZINC001192499435 1051746324 /nfs/dbraw/zinc/74/63/24/1051746324.db2.gz CASVYWRPLDYCMC-UHFFFAOYSA-N 2 0 335.561 4.094 20 0 EIADRP CC[N@H+](CCC1CC[NH+](CCSc2ccncc2)CC1)CC1CC1 ZINC001192502158 1051747391 /nfs/dbraw/zinc/74/73/91/1051747391.db2.gz SUKXXMBWAUSLBV-UHFFFAOYSA-N 2 0 347.572 4.008 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC(NC[C@H]2CC[N@@H+]2C2CCCCC2)CC1 ZINC001182918239 1051747442 /nfs/dbraw/zinc/74/74/42/1051747442.db2.gz KMLSZNISQLRKIH-STZQEDGTSA-N 2 0 347.591 4.026 20 0 EIADRP C[C@@H]1C[N@H+](CCC[NH+]2CCC(Cc3ccccc3)CC2)C(C)(C)C1 ZINC001175758304 1051770611 /nfs/dbraw/zinc/77/06/11/1051770611.db2.gz LYVRIKXKJOFTSK-IBGZPJMESA-N 2 0 328.544 4.452 20 0 EIADRP C[C@H](CC[NH2+][C@@H](C)Cc1ccc(Cl)c(C(F)(F)F)c1)[NH+](C)C ZINC001183105097 1051790339 /nfs/dbraw/zinc/79/03/39/1051790339.db2.gz YHHIGUYBXBWQEK-NWDGAFQWSA-N 2 0 336.829 4.220 20 0 EIADRP C[C@@H](Cc1cccc(F)c1)[NH2+]CC1(c2ccccc2)CC[NH+](C)CC1 ZINC001183355459 1051826008 /nfs/dbraw/zinc/82/60/08/1051826008.db2.gz PXOWVSGTJQCUIV-SFHVURJKSA-N 2 0 340.486 4.010 20 0 EIADRP CC(C)C[N@H+](C/C=C\c1ccc(F)c(F)c1)CC1CC[NH+](C)CC1 ZINC001183463218 1051846158 /nfs/dbraw/zinc/84/61/58/1051846158.db2.gz CKQLGNKNVBCZRV-PLNGDYQASA-N 2 0 336.470 4.278 20 0 EIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C[C@H]1CCCC(C)(C)O1 ZINC001193092253 1051875078 /nfs/dbraw/zinc/87/50/78/1051875078.db2.gz CHHHBLITYURQBB-JYRKZWEQSA-N 2 0 344.543 4.080 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC001193249481 1051889950 /nfs/dbraw/zinc/88/99/50/1051889950.db2.gz NAPLJYBWCOVLHG-GDBMZVCRSA-N 2 0 338.442 4.031 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2ccc(C)c(Cl)n2)CC1 ZINC001193323087 1051900803 /nfs/dbraw/zinc/90/08/03/1051900803.db2.gz FLWSZBZKXLHICS-UHFFFAOYSA-N 2 0 337.939 4.377 20 0 EIADRP CCCn1ccnc1CCC[N@H+](C)Cc1nc(C)c(C(C)(C)C)s1 ZINC001193354752 1051906878 /nfs/dbraw/zinc/90/68/78/1051906878.db2.gz HBFUIAFOFRQIOU-UHFFFAOYSA-N 2 0 348.560 4.420 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CC[C@H]2CCC(F)(F)C2)CC1 ZINC001184238699 1051975908 /nfs/dbraw/zinc/97/59/08/1051975908.db2.gz FANRHIHDPDPSER-NUJGCVRESA-N 2 0 328.491 4.445 20 0 EIADRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3cc(F)cc(C(F)(F)F)c3)C[C@H]2C1 ZINC001184303254 1051982370 /nfs/dbraw/zinc/98/23/70/1051982370.db2.gz NZSBTSAGSRRTRN-JJRVBVJISA-N 2 0 344.396 4.007 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)CC1 ZINC000163575513 1051995978 /nfs/dbraw/zinc/99/59/78/1051995978.db2.gz IGMSJNMHXZOVSI-UHFFFAOYSA-N 3 0 349.607 4.131 20 0 EIADRP C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1cccc(C(F)(F)F)c1 ZINC000294243324 1052056380 /nfs/dbraw/zinc/05/63/80/1052056380.db2.gz PIYKJWXSYLFHQM-CQSZACIVSA-N 2 0 349.400 4.420 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000166011369 1052081988 /nfs/dbraw/zinc/08/19/88/1052081988.db2.gz QJXPYHUQLBFOPO-DYXWJJEUSA-N 2 0 330.516 4.008 20 0 EIADRP Cc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)Cc3ccccc3CF)C2)s1 ZINC001194153711 1052089305 /nfs/dbraw/zinc/08/93/05/1052089305.db2.gz QRCAJGXSCGYJAW-KRWDZBQOSA-N 2 0 346.515 4.480 20 0 EIADRP c1cc(C[NH+]2CCCCC2)ccc1C[NH2+][C@H]1CCOCC12CCCC2 ZINC001176966348 1052212088 /nfs/dbraw/zinc/21/20/88/1052212088.db2.gz XJXTUKDQPVTTCF-NRFANRHFSA-N 2 0 342.527 4.111 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cc(C)cc(Br)c2)C[C@H]1C ZINC000774903338 1052269366 /nfs/dbraw/zinc/26/93/66/1052269366.db2.gz MKSNUMMUCOJKBU-PBHICJAKSA-N 2 0 339.321 4.062 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cc(Cl)ccc1O ZINC000184933330 1052316948 /nfs/dbraw/zinc/31/69/48/1052316948.db2.gz LBKNARNTYZSBSE-OAHLLOKOSA-N 2 0 344.886 4.492 20 0 EIADRP c1cc2c(s1)CCC[C@H]2[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000336707956 1052512737 /nfs/dbraw/zinc/51/27/37/1052512737.db2.gz JFXYQAFAHHBICT-PKOBYXMFSA-N 2 0 326.509 4.237 20 0 EIADRP COc1cc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)ccc1Cl ZINC000623343448 1052626716 /nfs/dbraw/zinc/62/67/16/1052626716.db2.gz TZUCQQBFYYQEPU-UHFFFAOYSA-N 2 0 344.886 4.234 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CC2(c3cccc(C(F)(F)F)c3)CC2)CC1(C)C ZINC000623398802 1052646649 /nfs/dbraw/zinc/64/66/49/1052646649.db2.gz PDMKDUOIPRTQNN-INIZCTEOSA-N 2 0 340.433 4.199 20 0 EIADRP C[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1(C)C ZINC000623512323 1052667130 /nfs/dbraw/zinc/66/71/30/1052667130.db2.gz BLZPDGQSFNLLQK-DJIMGWMZSA-N 2 0 340.433 4.414 20 0 EIADRP C[C@@H]([NH2+][C@H](c1ccccc1)C1CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000178493869 1052706618 /nfs/dbraw/zinc/70/66/18/1052706618.db2.gz MBQUIRYGOZXBLS-VGOFRKELSA-N 2 0 338.495 4.429 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1ccsc1 ZINC000178699057 1052710845 /nfs/dbraw/zinc/71/08/45/1052710845.db2.gz DHRLJHHUVSAICS-GOSISDBHSA-N 2 0 343.540 4.001 20 0 EIADRP Cc1ccc(Br)cc1[C@H](C)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000624002679 1052850618 /nfs/dbraw/zinc/85/06/18/1052850618.db2.gz BHBLQQHOMJYUBR-JEYLPNPQSA-N 2 0 339.321 4.281 20 0 EIADRP CSc1ccc(OCC[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185763804 1053021311 /nfs/dbraw/zinc/02/13/11/1053021311.db2.gz FCLCYPLZUYMXKA-IRXDYDNUSA-N 2 0 348.556 4.030 20 0 EIADRP CCOc1ccccc1C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381307070 1053065748 /nfs/dbraw/zinc/06/57/48/1053065748.db2.gz BYIFGXXADYLXQX-GHTZIAJQSA-N 2 0 338.495 4.086 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)cc1 ZINC000850174450 1053083126 /nfs/dbraw/zinc/08/31/26/1053083126.db2.gz QVXXRKVQFDYKOY-ZWKOTPCHSA-N 2 0 329.513 4.081 20 0 EIADRP CC[N@H+](Cc1cccc(C[NH+]2CCCCC2)c1)[C@H]1CCOC(C)(C)C1 ZINC001194781833 1053090944 /nfs/dbraw/zinc/09/09/44/1053090944.db2.gz INGGEAXNQHOVSE-NRFANRHFSA-N 2 0 344.543 4.452 20 0 EIADRP CSC1(C[NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)CCC1 ZINC000381904870 1053110943 /nfs/dbraw/zinc/11/09/43/1053110943.db2.gz IKVUGFDBUZUMNF-LJQANCHMSA-N 2 0 332.557 4.164 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(C)o1 ZINC000383543029 1053352791 /nfs/dbraw/zinc/35/27/91/1053352791.db2.gz UXPFVLFNVNGUBZ-ZWOKBUDYSA-N 2 0 326.484 4.458 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1cnn(-c2ccccc2)c1 ZINC000764963265 1053402866 /nfs/dbraw/zinc/40/28/66/1053402866.db2.gz BYUMVQISMVIFMI-LJQANCHMSA-N 2 0 340.515 4.035 20 0 EIADRP Clc1cccc(SCC[N@@H+]2CCCN(c3cc[nH+]cc3)CC2)c1 ZINC001195536235 1053428434 /nfs/dbraw/zinc/42/84/34/1053428434.db2.gz PJGVALYOYGPLTH-UHFFFAOYSA-N 2 0 347.915 4.039 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccnc(Cl)c1 ZINC000765449398 1053550510 /nfs/dbraw/zinc/55/05/10/1053550510.db2.gz JJJAPKMQMWUBKW-WMZOPIPTSA-N 2 0 343.902 4.298 20 0 EIADRP CC(CC[NH2+][C@@H](C)c1cscn1)CC[NH2+][C@@H](C)c1cscn1 ZINC000852417842 1053575378 /nfs/dbraw/zinc/57/53/78/1053575378.db2.gz XYRKLVKXRQHMAI-KBPBESRZSA-N 2 0 338.546 4.017 20 0 EIADRP COc1cc(C[NH2+]CCC2CC[NH+](C(C)C)CC2)ccc1SC ZINC000865716824 1053578659 /nfs/dbraw/zinc/57/86/59/1053578659.db2.gz FKEURPULWAYJCY-UHFFFAOYSA-N 2 0 336.545 4.017 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2ncc(-c3ccccc3)s2)CC1 ZINC000865764766 1053587417 /nfs/dbraw/zinc/58/74/17/1053587417.db2.gz APUPSMJVVGFMKQ-UHFFFAOYSA-N 2 0 329.513 4.163 20 0 EIADRP c1ccc(C[C@H]2CCC[C@@H]2[NH2+]CCCCC[NH+]2CCCCC2)nc1 ZINC000852566179 1053588883 /nfs/dbraw/zinc/58/88/83/1053588883.db2.gz DUYPSFSAHBFDAQ-CTNGQTDRSA-N 2 0 329.532 4.039 20 0 EIADRP CN1CCC[C@H](C[NH2+][C@H](C2CCC2)[C@@H]2CCCO2)[C@H]1c1cccs1 ZINC000866271588 1053671499 /nfs/dbraw/zinc/67/14/99/1053671499.db2.gz ANQJYFWZSCWSIL-BWPNAZKDSA-N 2 0 348.556 4.068 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1cc2c(ccnc2Cl)o1 ZINC000866364579 1053704694 /nfs/dbraw/zinc/70/46/94/1053704694.db2.gz RQTSNRFLEMXGLA-AWEZNQCLSA-N 2 0 335.879 4.398 20 0 EIADRP CCOc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000386416515 1053712329 /nfs/dbraw/zinc/71/23/29/1053712329.db2.gz YTOLFOWGZUAATJ-NQIIRXRSSA-N 2 0 338.495 4.086 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1cc2c(ccnc2Cl)o1 ZINC000866393959 1053712937 /nfs/dbraw/zinc/71/29/37/1053712937.db2.gz UAAHLQZHVMMPSQ-CYBMUJFWSA-N 2 0 347.890 4.254 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+][C@H](C)c2ccc(C(F)F)nc2)CC1 ZINC000866469598 1053740980 /nfs/dbraw/zinc/74/09/80/1053740980.db2.gz NICNYFIQGQGVLF-CQSZACIVSA-N 2 0 325.447 4.180 20 0 EIADRP C[C@H]([NH2+][C@H]1CCc2c1cccc2F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386578560 1053782319 /nfs/dbraw/zinc/78/23/19/1053782319.db2.gz ZGJCZCGMRKYEEG-ZJBJCVSYSA-N 2 0 338.470 4.313 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+][C@H](Cc2cccnc2)C2CCCC2)CC1 ZINC000866607111 1053802964 /nfs/dbraw/zinc/80/29/64/1053802964.db2.gz AKASGGHJTNLTLW-HXUWFJFHSA-N 2 0 329.532 4.035 20 0 EIADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@@H](Oc2ccnc(C[NH+](C)C(C)C)c2)C1 ZINC000856559695 1054084651 /nfs/dbraw/zinc/08/46/51/1054084651.db2.gz SMUOPAJPWAIMNW-GHTZIAJQSA-N 2 0 347.547 4.057 20 0 EIADRP C[NH+](C)[C@@H]1CCC[N@H+](CCCSc2ccccc2Cl)CC1 ZINC000429554336 1054125042 /nfs/dbraw/zinc/12/50/42/1054125042.db2.gz SDDVXVCBIWHKAO-OAHLLOKOSA-N 2 0 326.937 4.238 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCO[C@H](C(C)(C)C)C3)CC2)CC1 ZINC000872050701 1054362514 /nfs/dbraw/zinc/36/25/14/1054362514.db2.gz CEGGSSKSQAENAS-NBDWZHNGSA-N 2 0 336.564 4.213 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CC[C@H](C)[C@@H](C)C1 ZINC001199329095 1054392765 /nfs/dbraw/zinc/39/27/65/1054392765.db2.gz NEAYVFVJFIKHQO-CMKODMSKSA-N 2 0 332.532 4.322 20 0 EIADRP CC(C)C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)C1 ZINC001199384056 1054403226 /nfs/dbraw/zinc/40/32/26/1054403226.db2.gz NOZNVTCQPIBVLT-VQTJNVASSA-N 2 0 332.532 4.322 20 0 EIADRP [NH3+][C@@H](C[C@@H]1CCC[N@H+](Cc2csc(C3CC3)n2)C1)C1CCCC1 ZINC000872156697 1054412300 /nfs/dbraw/zinc/41/23/00/1054412300.db2.gz LFYVEBYXQZGNLJ-KSSFIOAISA-N 2 0 333.545 4.140 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cccc3ncccc23)c1 ZINC000873015756 1054477127 /nfs/dbraw/zinc/47/71/27/1054477127.db2.gz WOBUMEKVHJWJJO-UHFFFAOYSA-N 2 0 333.479 4.366 20 0 EIADRP CC[N@@H+]1CCC[C@@H](C[NH2+]Cc2cccc(Oc3ccc(F)cc3)c2)C1 ZINC001199844443 1054478750 /nfs/dbraw/zinc/47/87/50/1054478750.db2.gz ZGMOWSCXFPTGCV-SFHVURJKSA-N 2 0 342.458 4.440 20 0 EIADRP Cc1cccc(C)c1C[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC001199896066 1054484474 /nfs/dbraw/zinc/48/44/74/1054484474.db2.gz IOISEIXCJYFCDE-UHFFFAOYSA-N 2 0 328.525 4.367 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CC[C@@H](C)[C@@H](C)C3)CC2)cc1 ZINC001199883533 1054491158 /nfs/dbraw/zinc/49/11/58/1054491158.db2.gz JTHYCUMYQDIHCM-LVCYWYKZSA-N 2 0 344.543 4.322 20 0 EIADRP [NH3+][C@@H](C[C@H]1CCC[N@H+](Cc2scnc2C2CC2)C1)C1CCCC1 ZINC000873232491 1054509644 /nfs/dbraw/zinc/50/96/44/1054509644.db2.gz RPIAAMVDYVWVOG-PBHICJAKSA-N 2 0 333.545 4.140 20 0 EIADRP CCC[C@@H]([NH2+]Cc1cc2c(s1)CC[NH2+]C2)c1ccc(F)cc1F ZINC000873212954 1054509733 /nfs/dbraw/zinc/50/97/33/1054509733.db2.gz SEIYWBJRAJSGOQ-QGZVFWFLSA-N 2 0 336.451 4.303 20 0 EIADRP FC(F)(F)[C@@H]1CC=CC[C@H]1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000873250238 1054513810 /nfs/dbraw/zinc/51/38/10/1054513810.db2.gz FIAPMMLKTBVFGY-MZBWOGCUSA-N 2 0 330.438 4.032 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(Oc2ccccc2)cn1 ZINC000873262205 1054517683 /nfs/dbraw/zinc/51/76/83/1054517683.db2.gz WEVKOXJAXDWJLT-ZJPYXAASSA-N 2 0 337.467 4.055 20 0 EIADRP CCNc1ccccc1C[NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1 ZINC001200941774 1054596661 /nfs/dbraw/zinc/59/66/61/1054596661.db2.gz JMUKRTWXLCCPLB-SFHVURJKSA-N 2 0 325.500 4.119 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1ccc(C)c(C)c1 ZINC000061069873 1054741680 /nfs/dbraw/zinc/74/16/80/1054741680.db2.gz DEDXMUFXMMYEDX-UHFFFAOYSA-N 2 0 340.511 4.314 20 0 EIADRP CC(CC[NH2+][C@@H](C)c1ccns1)CC[NH2+][C@@H](C)c1ccns1 ZINC000860058837 1054765584 /nfs/dbraw/zinc/76/55/84/1054765584.db2.gz JFRFOWVOXJXYRD-KBPBESRZSA-N 2 0 338.546 4.017 20 0 EIADRP CCO[C@H]1C[C@@H]([NH2+]C2CCC([NH+]3CCCCC3)CC2)C12CCCC2 ZINC000776164448 1054780414 /nfs/dbraw/zinc/78/04/14/1054780414.db2.gz ZXKMJEVKOAKWNB-TUNPWDSISA-N 2 0 334.548 4.111 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccnc(Cl)c1 ZINC000125488982 1054805302 /nfs/dbraw/zinc/80/53/02/1054805302.db2.gz XPTCZAILWSLWID-CQSZACIVSA-N 2 0 349.931 4.359 20 0 EIADRP CCC[C@@H](C)C[NH+]1CCC2(C[C@@H]([N@H+](C)Cc3ccccc3)CO2)CC1 ZINC001201544395 1054837676 /nfs/dbraw/zinc/83/76/76/1054837676.db2.gz PNPPYTVQIIHOSQ-TZIWHRDSSA-N 2 0 344.543 4.178 20 0 EIADRP CCC[C@H](C)C[NH+]1CCC2(CC([N@H+](C)Cc3ccncc3)C2)CC1 ZINC001201543842 1054837927 /nfs/dbraw/zinc/83/79/27/1054837927.db2.gz LBXRLFACSMYEEQ-SFHVURJKSA-N 2 0 329.532 4.194 20 0 EIADRP c1ccc(CCC[N@@H+]2CC[C@H]3C[NH+](Cc4ccccc4)CC[C@@H]3C2)cc1 ZINC001201681703 1054875354 /nfs/dbraw/zinc/87/53/54/1054875354.db2.gz CIZQLBIMNVMSIZ-RPWUZVMVSA-N 2 0 348.534 4.463 20 0 EIADRP CC[N@H+]([C@@H]1CCOC1)C1CC[NH+](CC[C@@H](C)CCC=C(C)C)CC1 ZINC001201981665 1054958455 /nfs/dbraw/zinc/95/84/55/1054958455.db2.gz QLDWCFNTVMZDNC-PZJWPPBQSA-N 2 0 336.564 4.334 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cccc(Cl)c2N)c1 ZINC000876982114 1054992976 /nfs/dbraw/zinc/99/29/76/1054992976.db2.gz VRJPDOYADWVASW-UHFFFAOYSA-N 2 0 331.891 4.052 20 0 EIADRP Cc1c(C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)ccnc1F ZINC000862275268 1055045078 /nfs/dbraw/zinc/04/50/78/1055045078.db2.gz PLIVXNOKLHMDBI-UHFFFAOYSA-N 2 0 341.474 4.195 20 0 EIADRP Cc1c(C[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)ccnc1F ZINC000862295134 1055048184 /nfs/dbraw/zinc/04/81/84/1055048184.db2.gz ZWEINMIEFPMQPA-UHFFFAOYSA-N 2 0 341.474 4.051 20 0 EIADRP Clc1ccc([C@H](C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)OCC2CC2)cc1 ZINC000671764596 1055058225 /nfs/dbraw/zinc/05/82/25/1055058225.db2.gz GLEVDHRNUDVPAP-AABGKKOBSA-N 2 0 348.918 4.024 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[C@@H](c2ccccc2)O1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000878412321 1055299448 /nfs/dbraw/zinc/29/94/48/1055299448.db2.gz VTUBIBLKFRGRRY-TZEULACYSA-N 2 0 342.527 4.149 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[C@H](c2ccccc2)O1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000878412320 1055300590 /nfs/dbraw/zinc/30/05/90/1055300590.db2.gz VTUBIBLKFRGRRY-OZROYSPXSA-N 2 0 342.527 4.149 20 0 EIADRP Clc1cccc2c1C[C@@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)C2 ZINC001168675129 1056633511 /nfs/dbraw/zinc/63/35/11/1056633511.db2.gz DEWDCDIPJFWSIK-IBGZPJMESA-N 2 0 340.898 4.193 20 0 EIADRP Cc1n[nH]cc1[C@@H](C)[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000180137923 1058369881 /nfs/dbraw/zinc/36/98/81/1058369881.db2.gz LZOGSTFYARKRAZ-IXDOHACOSA-N 2 0 340.515 4.047 20 0 EIADRP CCN1CC[NH+](CCCC[NH2+][C@H](CC(C)(C)C)c2ccccc2)CC1 ZINC000181493908 1059464443 /nfs/dbraw/zinc/46/44/43/1059464443.db2.gz OMIOOJPGTGJECC-OAQYLSRUSA-N 2 0 345.575 4.171 20 0 EIADRP Cc1c(C[NH2+]CCC[NH+](C(C)C)C(C)C)sc2nc(C)nc(C)c12 ZINC000746052927 1059993461 /nfs/dbraw/zinc/99/34/61/1059993461.db2.gz FRHLVDOOWWKNSF-UHFFFAOYSA-N 2 0 348.560 4.215 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000386483114 1060267775 /nfs/dbraw/zinc/26/77/75/1060267775.db2.gz WLRQDPIDGSNHHW-UYAOXDASSA-N 2 0 338.495 4.258 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(SC(F)F)cc2)[C@@H](C)C1 ZINC000746469522 1060369904 /nfs/dbraw/zinc/36/99/04/1060369904.db2.gz COFBAFZSOXPIOW-XJKSGUPXSA-N 2 0 328.472 4.163 20 0 EIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]CCC(C)(C)C)CC1 ZINC001168812732 1060413649 /nfs/dbraw/zinc/41/36/49/1060413649.db2.gz NBXSRVWRUKDOPL-MRXNPFEDSA-N 2 0 335.511 4.054 20 0 EIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@H](C)[NH2+]C[C@H](C)CC(C)C)CC1 ZINC001168813919 1060416478 /nfs/dbraw/zinc/41/64/78/1060416478.db2.gz UEBDFBMEYNUMEX-MSOLQXFVSA-N 2 0 349.538 4.300 20 0 EIADRP CCc1nc2c(s1)[C@H]([NH2+]C1CCC([NH+]3CCCCC3)CC1)CCC2 ZINC000766513418 1060460841 /nfs/dbraw/zinc/46/08/41/1060460841.db2.gz RFYARSGNBRMNKD-OFLPRAFFSA-N 2 0 347.572 4.470 20 0 EIADRP CC(C)C[C@H](Cc1ccccc1)[NH2+]C(C)(C)CCNCCC(C)(C)[NH3+] ZINC001169062319 1060618768 /nfs/dbraw/zinc/61/87/68/1060618768.db2.gz SMSSXYMLCSGZJE-HXUWFJFHSA-N 2 0 347.591 4.119 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C(C)(C)Cc1ccc(C(F)(F)F)cc1)C2 ZINC001169118328 1060646840 /nfs/dbraw/zinc/64/68/40/1060646840.db2.gz HNYZGPHUNWKEKH-OSYLJGHBSA-N 2 0 340.433 4.241 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CCc1ccc(CCc3ccccc3)cc1)C2 ZINC001169124003 1060649270 /nfs/dbraw/zinc/64/92/70/1060649270.db2.gz OZRFIQSMOIIFSG-JOZNFPNDSA-N 2 0 348.534 4.229 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CCC(CCCc3ccccc3)CC1)C2 ZINC001169126745 1060651495 /nfs/dbraw/zinc/65/14/95/1060651495.db2.gz XEPJKAOEGWTFOW-KOUNCHBCSA-N 2 0 326.528 4.347 20 0 EIADRP CC1(C)C[C@H](Nc2cc(C[NH+]3CCCCC3)ccn2)C[C@@](C)(C[NH3+])C1 ZINC001169140941 1060660250 /nfs/dbraw/zinc/66/02/50/1060660250.db2.gz ICECNJSBYUWCRV-GHTZIAJQSA-N 2 0 344.547 4.023 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CCc3ccccc3[C@@H]1c1ccccc1)C2 ZINC001169143232 1060662462 /nfs/dbraw/zinc/66/24/62/1060662462.db2.gz ZCLCIAGQCXTXRG-GNXKAVGDSA-N 2 0 332.491 4.259 20 0 EIADRP CC1(C)C[C@@H](Nc2cc[nH+]c(N3CCCCC3)c2)C[C@@](C)(C[NH3+])C1 ZINC001169149345 1060668709 /nfs/dbraw/zinc/66/87/09/1060668709.db2.gz YXECWMXRBBJDKQ-YLJYHZDGSA-N 2 0 330.520 4.028 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H](n1cc(C3CC[NH2+]CC3)c3cccc(F)c31)C2 ZINC001169155158 1060670094 /nfs/dbraw/zinc/67/00/94/1060670094.db2.gz YTWVTIBMNRDQBY-BJWYYQGGSA-N 2 0 341.474 4.045 20 0 EIADRP CC[NH+]1CCC(n2cc(C3CC[NH2+]CC3)c3cc(C)ccc32)CC1 ZINC001169261489 1060710455 /nfs/dbraw/zinc/71/04/55/1060710455.db2.gz HLFTWUACVWUCJP-UHFFFAOYSA-N 2 0 325.500 4.074 20 0 EIADRP CCCC[C@@H]([NH3+])Cc1cn(C2CC[NH+](CC)CC2)c2ccccc12 ZINC001169237893 1060713025 /nfs/dbraw/zinc/71/30/25/1060713025.db2.gz BPCULPOAMHBJIA-GOSISDBHSA-N 2 0 327.516 4.358 20 0 EIADRP CC[NH+]1CCC([NH2+]CCc2ccc(/C=C/c3ccccc3)cc2)CC1 ZINC001169244139 1060715473 /nfs/dbraw/zinc/71/54/73/1060715473.db2.gz CSZVTJHGFDWQLU-CMDGGOBGSA-N 2 0 334.507 4.473 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1ccc([C@@H]2CCC[NH2+]C2)cc1 ZINC001169689302 1060900331 /nfs/dbraw/zinc/90/03/31/1060900331.db2.gz HUPLRHCHWWCYML-NQIIRXRSSA-N 2 0 335.495 4.394 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)c(C)o1 ZINC000767363773 1061212161 /nfs/dbraw/zinc/21/21/61/1061212161.db2.gz WYKIAYUJHDXIEN-INIZCTEOSA-N 2 0 326.484 4.418 20 0 EIADRP C[N@@H+]1CCC[C@H]1CCN1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000767370736 1061213574 /nfs/dbraw/zinc/21/35/74/1061213574.db2.gz DTVZWJPXPHGDJA-WMLDXEAASA-N 2 0 326.406 4.327 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)C1CCOCC1 ZINC000532192757 1032078806 /nfs/dbraw/zinc/07/88/06/1032078806.db2.gz KTJZSDOJBXNXNT-AVRDEDQJSA-N 2 0 344.543 4.356 20 0 EIADRP C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000532200565 1032085600 /nfs/dbraw/zinc/08/56/00/1032085600.db2.gz WJXSAWZZSQXBMM-BTYIYWSLSA-N 2 0 326.459 4.301 20 0 EIADRP C[N@H+](Cc1ccccc1NC1CC[NH+](C2CC2)CC1)C1CCCCC1 ZINC000459374358 1032092214 /nfs/dbraw/zinc/09/22/14/1032092214.db2.gz ULRXVSXRQGVQFI-UHFFFAOYSA-N 2 0 341.543 4.490 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(Br)cc2)C1 ZINC000532214759 1032095958 /nfs/dbraw/zinc/09/59/58/1032095958.db2.gz LCFFWJGJKWZARJ-GJZGRUSLSA-N 2 0 339.321 4.220 20 0 EIADRP C[NH+]1CCC(C[NH2+]Cc2ccc(Oc3ccccc3F)c(F)c2)CC1 ZINC000729682740 1032149178 /nfs/dbraw/zinc/14/91/78/1032149178.db2.gz DPCISVSPQSLWDF-UHFFFAOYSA-N 2 0 346.421 4.189 20 0 EIADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 ZINC000643458558 1032267689 /nfs/dbraw/zinc/26/76/89/1032267689.db2.gz DJLKVDJHTPWSFU-KIJLLGNVSA-N 2 0 346.359 4.003 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]C1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 ZINC000643458772 1032268478 /nfs/dbraw/zinc/26/84/78/1032268478.db2.gz ZWUNBTARHTUDAG-GMTAPVOTSA-N 2 0 334.348 4.003 20 0 EIADRP CC[C@@H]1C[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)CCO1 ZINC000648438131 1032310207 /nfs/dbraw/zinc/31/02/07/1032310207.db2.gz RFZZXRRBHPRODL-NHCUHLMSSA-N 2 0 330.516 4.110 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)C1 ZINC000532802083 1032320477 /nfs/dbraw/zinc/32/04/77/1032320477.db2.gz JFBNDSCQYMFGND-MJGOQNOKSA-N 2 0 328.500 4.145 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)C1 ZINC000532802082 1032321532 /nfs/dbraw/zinc/32/15/32/1032321532.db2.gz JFBNDSCQYMFGND-IEBWSBKVSA-N 2 0 328.500 4.145 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)C1 ZINC000532802075 1032321718 /nfs/dbraw/zinc/32/17/18/1032321718.db2.gz JFBNDSCQYMFGND-HKUYNNGSSA-N 2 0 328.500 4.145 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccsc2C(F)(F)F)CC1 ZINC000529526995 1032429009 /nfs/dbraw/zinc/42/90/09/1032429009.db2.gz OWWIFKAUTXPETH-UHFFFAOYSA-N 2 0 334.451 4.319 20 0 EIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C1CC(F)(F)C1 ZINC000529543592 1032435173 /nfs/dbraw/zinc/43/51/73/1032435173.db2.gz BHJSBXRGCIBYFW-FMJMRLDVSA-N 2 0 334.454 4.205 20 0 EIADRP CC[C@@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccncc1 ZINC000245750720 1032459869 /nfs/dbraw/zinc/45/98/69/1032459869.db2.gz TZBIKJDSJZDLTG-CIAFKFPVSA-N 2 0 335.495 4.318 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2cc(Cl)c(N)c(Cl)c2)CC1 ZINC000760159092 1032488413 /nfs/dbraw/zinc/48/84/13/1032488413.db2.gz OKWGRFRZPYASIZ-GFCCVEGCSA-N 2 0 344.330 4.348 20 0 EIADRP C[N@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)C[C@H]1CCCCC1(F)F ZINC000450455632 1032510828 /nfs/dbraw/zinc/51/08/28/1032510828.db2.gz OFYUOHGZROAWRC-RTBURBONSA-N 2 0 336.470 4.266 20 0 EIADRP C[NH2+]CCC1CC[NH+](Cc2nc3ccccc3c(C)c2Cl)CC1 ZINC000261655454 1032638471 /nfs/dbraw/zinc/63/84/71/1032638471.db2.gz FSTMBFHSDSRQBF-UHFFFAOYSA-N 2 0 331.891 4.018 20 0 EIADRP Cc1cc(C)cc([C@@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c1 ZINC000500568464 1032660177 /nfs/dbraw/zinc/66/01/77/1032660177.db2.gz WBSNMRRZJIYVAC-LJQANCHMSA-N 2 0 340.511 4.485 20 0 EIADRP CC[NH+](CC)Cc1ccccc1Nc1cc(C)nn1-c1cc[nH+]cc1 ZINC001211991732 1032763824 /nfs/dbraw/zinc/76/38/24/1032763824.db2.gz KLDXKDPYLZZTIH-UHFFFAOYSA-N 2 0 335.455 4.161 20 0 EIADRP c1c2c(cc3c1OCCC[C@@H]3[NH2+][C@@H]1CC[NH2+]C3(CCC3)C1)CCCC2 ZINC000643546503 1018896879 /nfs/dbraw/zinc/89/68/79/1018896879.db2.gz PMNWDVOCZAEYSC-QUCCMNQESA-N 2 0 340.511 4.043 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643546132 1018897521 /nfs/dbraw/zinc/89/75/21/1018897521.db2.gz JEGOLFQUIZYMDL-QLFBSQMISA-N 2 0 329.513 4.053 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643546130 1018898042 /nfs/dbraw/zinc/89/80/42/1018898042.db2.gz JEGOLFQUIZYMDL-ILXRZTDVSA-N 2 0 329.513 4.053 20 0 EIADRP CC[C@@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000643548399 1018926371 /nfs/dbraw/zinc/92/63/71/1018926371.db2.gz OUUMYHPVBGWAPB-GDBMZVCRSA-N 2 0 342.405 4.301 20 0 EIADRP C[NH+](C)[C@H]1CCCN(Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000432793000 1032812285 /nfs/dbraw/zinc/81/22/85/1032812285.db2.gz NAJVQQBFOINWFJ-HNNXBMFYSA-N 2 0 332.488 4.470 20 0 EIADRP Cc1cnc([C@H](C)C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000274752184 1019187773 /nfs/dbraw/zinc/18/77/73/1019187773.db2.gz HTZQEHKJOKIWON-SUMDDJOVSA-N 2 0 343.540 4.055 20 0 EIADRP CCCCn1nc(C)c(CNC2CC(C)(C)[NH2+]C(C)(C)C2)c1Cl ZINC000236737456 1032828558 /nfs/dbraw/zinc/82/85/58/1032828558.db2.gz HGZZUEFXQIIVKW-UHFFFAOYSA-N 2 0 340.943 4.044 20 0 EIADRP CC(C)n1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cn1 ZINC000154877026 1020083634 /nfs/dbraw/zinc/08/36/34/1020083634.db2.gz GLCJEZNFXZTBCU-QGZVFWFLSA-N 2 0 328.504 4.155 20 0 EIADRP CC(C)[NH+]1CCC(Nc2ccc(SCC[NH+]3CCCC3)cc2)CC1 ZINC000651960002 1020904552 /nfs/dbraw/zinc/90/45/52/1020904552.db2.gz MTIUZJIYSXFGKC-UHFFFAOYSA-N 2 0 347.572 4.159 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(SCC(F)F)cc1 ZINC000655805811 1020972107 /nfs/dbraw/zinc/97/21/07/1020972107.db2.gz LTKBPVBPUZLALB-NFAWXSAZSA-N 2 0 328.472 4.035 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)C1 ZINC000655804963 1020972681 /nfs/dbraw/zinc/97/26/81/1020972681.db2.gz HFBZSFJTQQHNLC-KHIZAZIESA-N 2 0 327.299 4.374 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](Cc2ccccc2F)c2ccccc2)C1 ZINC000655803638 1020975321 /nfs/dbraw/zinc/97/53/21/1020975321.db2.gz ARPAYLFJSREOSE-LKUPVBHCSA-N 2 0 326.459 4.039 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655806300 1020976110 /nfs/dbraw/zinc/97/61/10/1020976110.db2.gz UPKLAQBGGZFADF-JLJPHGGASA-N 2 0 329.513 4.109 20 0 EIADRP CC(C)Sc1cccc(Cl)c1C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655826000 1020993058 /nfs/dbraw/zinc/99/30/58/1020993058.db2.gz BJMVYCOFJKGJKB-OKILXGFUSA-N 2 0 326.937 4.270 20 0 EIADRP Cc1nccn1CC[NH2+][C@@H](C)c1ccc(-c2c(F)cccc2F)cc1 ZINC000564424296 1021065620 /nfs/dbraw/zinc/06/56/20/1021065620.db2.gz RSNZRVHUKJMYIG-AWEZNQCLSA-N 2 0 341.405 4.488 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@@H]2CCCc3ccc(O)cc32)C1 ZINC000340471524 1021079197 /nfs/dbraw/zinc/07/91/97/1021079197.db2.gz XWTNGHHCUSWIKV-CBGDNZLLSA-N 2 0 330.516 4.117 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000472468664 1021388041 /nfs/dbraw/zinc/38/80/41/1021388041.db2.gz UFXMFZNGXWYSNS-ZBFHGGJFSA-N 2 0 340.433 4.430 20 0 EIADRP Cc1cc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc(C)c1O ZINC000570435203 1021438683 /nfs/dbraw/zinc/43/86/83/1021438683.db2.gz PIXMHFVQKMVGEU-UHFFFAOYSA-N 2 0 344.524 4.072 20 0 EIADRP C[NH2+]C1CCC([N@H+](C)Cc2cccc(Br)c2Cl)CC1 ZINC000706460794 1021684069 /nfs/dbraw/zinc/68/40/69/1021684069.db2.gz MLCNSNOFQQPEPT-UHFFFAOYSA-N 2 0 345.712 4.065 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2ccc(SC(F)F)cc2)CC1 ZINC000050031377 1021764158 /nfs/dbraw/zinc/76/41/58/1021764158.db2.gz IXFNGCUZUOBVSU-UHFFFAOYSA-N 2 0 328.472 4.165 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)c(C)c1 ZINC000414113149 1021873029 /nfs/dbraw/zinc/87/30/29/1021873029.db2.gz KFANZXJSEIQZOU-OAHLLOKOSA-N 2 0 330.447 4.055 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCc2ccc(OC)cc21 ZINC000173227966 1021873313 /nfs/dbraw/zinc/87/33/13/1021873313.db2.gz CLBSGZHUOMXVNJ-QFIPXVFZSA-N 2 0 338.495 4.314 20 0 EIADRP FC(F)(F)Oc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c[nH+]cn3c1)CC2 ZINC000414162733 1022002466 /nfs/dbraw/zinc/00/24/66/1022002466.db2.gz DZXOLDPPMRGJRY-QGZVFWFLSA-N 2 0 347.340 4.010 20 0 EIADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@@H](c2cc3ccccc3o2)c2cccnc2)C1 ZINC000414170378 1022022056 /nfs/dbraw/zinc/02/20/56/1022022056.db2.gz BYYWSLMPMFOGJZ-HTAPYJJXSA-N 2 0 349.478 4.239 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CC[C@@H]2CCC[N@H+](C)C2)c2ccccc12 ZINC000414173962 1022032905 /nfs/dbraw/zinc/03/29/05/1022032905.db2.gz HEMSHFWOHXDMIF-IRXDYDNUSA-N 2 0 326.484 4.231 20 0 EIADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1nc(-c2ccccc2)cs1 ZINC000414184740 1022062172 /nfs/dbraw/zinc/06/21/72/1022062172.db2.gz OGHHKRXIAGNJHC-CVEARBPZSA-N 2 0 329.513 4.193 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccc(F)cc1F ZINC000171126653 1022066129 /nfs/dbraw/zinc/06/61/29/1022066129.db2.gz ZMJARDWHTLVACX-OAHLLOKOSA-N 2 0 348.437 4.146 20 0 EIADRP CC[C@@H]([NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccccc1 ZINC000414219526 1022190790 /nfs/dbraw/zinc/19/07/90/1022190790.db2.gz HQBRQJILMDJNJI-DYESRHJHSA-N 2 0 326.484 4.429 20 0 EIADRP CSC1(C[NH2+][C@H](c2ccc(C)cc2)C2CCC2)CC[NH+](C)CC1 ZINC000580605709 1022300170 /nfs/dbraw/zinc/30/01/70/1022300170.db2.gz LOPQBDDVWNLZGN-IBGZPJMESA-N 2 0 332.557 4.253 20 0 EIADRP COc1ccsc1[C@H](C)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000471602660 1022310122 /nfs/dbraw/zinc/31/01/22/1022310122.db2.gz CTHLLGUDIXOTHK-RYRKJORJSA-N 2 0 344.524 4.318 20 0 EIADRP COc1ccc(C[N@@H+]2CC[C@@H](C3CC[NH+](C)CC3)C2)c2ccccc12 ZINC000580677397 1022367466 /nfs/dbraw/zinc/36/74/66/1022367466.db2.gz NOFOVXGSBUJXHQ-GOSISDBHSA-N 2 0 338.495 4.012 20 0 EIADRP COCC1CCC([NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)CC1 ZINC000414315131 1022511666 /nfs/dbraw/zinc/51/16/66/1022511666.db2.gz RLXCVVWHBBPHCZ-UHFFFAOYSA-N 2 0 344.543 4.224 20 0 EIADRP COc1cccc([C@@H](C)[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000310858203 1022521042 /nfs/dbraw/zinc/52/10/42/1022521042.db2.gz BYMOXHZFKZYYNU-GCJKJVERSA-N 2 0 338.495 4.258 20 0 EIADRP CC(=O)Nc1ccc([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000181952905 1022746282 /nfs/dbraw/zinc/74/62/82/1022746282.db2.gz SUEHQWIOTYYKLJ-BZSNNMDCSA-N 2 0 345.531 4.054 20 0 EIADRP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C2CC[NH+](CC3CCCCC3)CC2)CCO1 ZINC000378407954 1022805608 /nfs/dbraw/zinc/80/56/08/1022805608.db2.gz YRZPDMJZTKPXAI-PMACEKPBSA-N 2 0 336.564 4.214 20 0 EIADRP CC[C@H](CC(F)(F)F)[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000545459274 1022854398 /nfs/dbraw/zinc/85/43/98/1022854398.db2.gz MRQLMIBKDXHVOI-UKRRQHHQSA-N 2 0 332.410 4.009 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000423372068 1022857354 /nfs/dbraw/zinc/85/73/54/1022857354.db2.gz QYWNXQAVZQTLGB-ORQFMDKSSA-N 2 0 326.406 4.201 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH3+])C1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000423386642 1022865076 /nfs/dbraw/zinc/86/50/76/1022865076.db2.gz MDRPMNGYTJLNEQ-CDGCEXEKSA-N 2 0 331.287 4.009 20 0 EIADRP Cc1nc(C[NH+]2CCC(C[NH+](C)C)CC2)oc1-c1ccc(Cl)cc1 ZINC000363933760 1022998091 /nfs/dbraw/zinc/99/80/91/1022998091.db2.gz RUNYHRUHOIOCBH-UHFFFAOYSA-N 2 0 347.890 4.077 20 0 EIADRP CCC[C@@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000473314710 1033101119 /nfs/dbraw/zinc/10/11/19/1033101119.db2.gz KIMIOZGIUPACIA-HXUWFJFHSA-N 2 0 345.531 4.024 20 0 EIADRP CCC[C@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000473314709 1033101496 /nfs/dbraw/zinc/10/14/96/1033101496.db2.gz KIMIOZGIUPACIA-FQEVSTJZSA-N 2 0 345.531 4.024 20 0 EIADRP C[C@@H]([NH3+])[C@@H]1CC[N@H+](Cc2cccc(OCc3ccccc3Cl)c2)C1 ZINC000414663837 1023311961 /nfs/dbraw/zinc/31/19/61/1023311961.db2.gz RWETVPMXQOHTNH-NVXWUHKLSA-N 2 0 344.886 4.088 20 0 EIADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](C(c2ccccc2)c2ccccc2)C1 ZINC000549140103 1023369062 /nfs/dbraw/zinc/36/90/62/1023369062.db2.gz ZFSBLKWZJDUZFA-FQEVSTJZSA-N 2 0 334.507 4.440 20 0 EIADRP Cc1ccc(-c2ncc(C[N@@H+]3CCCC[C@@H]3[C@H]3CC[NH2+]C3)s2)cc1 ZINC000415038598 1023403858 /nfs/dbraw/zinc/40/38/58/1023403858.db2.gz IABAIWHEXITKRM-PKOBYXMFSA-N 2 0 341.524 4.083 20 0 EIADRP CSc1ccccc1C[C@@H](C)[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415050071 1023407771 /nfs/dbraw/zinc/40/77/71/1023407771.db2.gz IFQDREHFLKXPNV-VQIMIIECSA-N 2 0 328.525 4.409 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1cnc(C2CCCC2)s1)c1ccccc1 ZINC000415054952 1023411847 /nfs/dbraw/zinc/41/18/47/1023411847.db2.gz OEQKDWFESSYITO-SFHVURJKSA-N 2 0 329.513 4.371 20 0 EIADRP C[C@H](CC[NH2+]C1CCC(C[NH3+])CC1)c1cccc(C(F)(F)F)c1 ZINC000415075779 1023422032 /nfs/dbraw/zinc/42/20/32/1023422032.db2.gz AFWDVNLLIWUBIA-TUBUQKNSSA-N 2 0 328.422 4.306 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000415073222 1023424693 /nfs/dbraw/zinc/42/46/93/1023424693.db2.gz ARHFEDUGPLIBPD-TZMCWYRMSA-N 2 0 349.931 4.422 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000415073794 1023428102 /nfs/dbraw/zinc/42/81/02/1023428102.db2.gz BNUZYWKHMHFFSF-LADRWXRNSA-N 2 0 332.850 4.428 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000415082772 1023431479 /nfs/dbraw/zinc/43/14/79/1023431479.db2.gz OVJHQYXCWCQMHB-GOEBONIOSA-N 2 0 329.513 4.077 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000415082769 1023433450 /nfs/dbraw/zinc/43/34/50/1023433450.db2.gz OVJHQYXCWCQMHB-GDBMZVCRSA-N 2 0 329.513 4.077 20 0 EIADRP COc1cccc([C@@H]([NH2+]CC2CC[NH2+]CC2)c2ccccc2Cl)c1 ZINC000415086696 1023438273 /nfs/dbraw/zinc/43/82/73/1023438273.db2.gz SMUDKZFPJLUGNE-HXUWFJFHSA-N 2 0 344.886 4.027 20 0 EIADRP CC[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(OC)c(OC)c1 ZINC000119866982 1023440462 /nfs/dbraw/zinc/44/04/62/1023440462.db2.gz CASHQMDURXSRJS-KRWDZBQOSA-N 2 0 334.504 4.007 20 0 EIADRP C[C@@H](Cc1cccc(F)c1)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000397554275 1023463639 /nfs/dbraw/zinc/46/36/39/1023463639.db2.gz JZGKPWCBXSMIDS-SFHVURJKSA-N 2 0 340.486 4.259 20 0 EIADRP C[C@H](NCC1(C[NH+](C)C)CCCC1)c1ccccc1OC(F)F ZINC000545519476 1023471125 /nfs/dbraw/zinc/47/11/25/1023471125.db2.gz MGWLLLPIHPIBQY-AWEZNQCLSA-N 2 0 326.431 4.061 20 0 EIADRP CC[C@H](c1ccc(Br)cc1)[N@H+](C)C[C@@H]1CCCN(C)C1 ZINC000472737616 1023475725 /nfs/dbraw/zinc/47/57/25/1023475725.db2.gz KLPBVDSFEFTOMX-RHSMWYFYSA-N 2 0 339.321 4.174 20 0 EIADRP C[C@@H](C[N@H+](C)CC1CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000500065105 1023480118 /nfs/dbraw/zinc/48/01/18/1023480118.db2.gz AVRPXSZPKJFLEA-AWEZNQCLSA-N 2 0 328.422 4.083 20 0 EIADRP Clc1ccc2cccnc2c1C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000656784132 1023529906 /nfs/dbraw/zinc/52/99/06/1023529906.db2.gz YWPQMKMRWWNJGL-KRWDZBQOSA-N 2 0 343.902 4.100 20 0 EIADRP Clc1ccc2cccnc2c1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000656787313 1023536099 /nfs/dbraw/zinc/53/60/99/1023536099.db2.gz XCAPXSTWJGJUJL-QGZVFWFLSA-N 2 0 343.902 4.100 20 0 EIADRP CSc1ccc(C[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000310079814 1023543906 /nfs/dbraw/zinc/54/39/06/1023543906.db2.gz IKJJDLZYSPYWFB-OAQYLSRUSA-N 2 0 340.536 4.410 20 0 EIADRP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)C1 ZINC000684370477 1023544841 /nfs/dbraw/zinc/54/48/41/1023544841.db2.gz VLQINWURUKZIDY-DUXKGJEZSA-N 2 0 330.516 4.108 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C(C)(C)C1)c1ccc(Br)cc1 ZINC000709357885 1023573387 /nfs/dbraw/zinc/57/33/87/1023573387.db2.gz WAINSYMLZKICNH-CABCVRRESA-N 2 0 325.294 4.020 20 0 EIADRP Cc1cc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc(C)c1O ZINC000311195079 1023622474 /nfs/dbraw/zinc/62/24/74/1023622474.db2.gz HOSNHISJYLNCSV-HXUWFJFHSA-N 2 0 338.495 4.011 20 0 EIADRP Cc1ccc([C@H](C2CC2)[N@@H+](C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1 ZINC000377688619 1023688026 /nfs/dbraw/zinc/68/80/26/1023688026.db2.gz AFPXSLHYNQRNEL-ZRBLBEILSA-N 2 0 349.522 4.466 20 0 EIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]C[C@@H]2CCC=CO2)cc1 ZINC000194199824 1023750121 /nfs/dbraw/zinc/75/01/21/1023750121.db2.gz IRGMHYUVGCNBFZ-NRFANRHFSA-N 2 0 336.479 4.198 20 0 EIADRP C[C@H]([NH2+]CC1(C(F)(F)F)CCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000367698016 1023885270 /nfs/dbraw/zinc/88/52/70/1023885270.db2.gz NRSJTAUFTYPQCW-RDJZCZTQSA-N 2 0 340.433 4.219 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(-c2ccccc2)cn1 ZINC000651787179 1024020821 /nfs/dbraw/zinc/02/08/21/1024020821.db2.gz GGQXAYQRIAQRKW-KRWDZBQOSA-N 2 0 335.495 4.274 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1csc(C(F)(F)F)c1)c1ccccc1 ZINC000925720598 1024101688 /nfs/dbraw/zinc/10/16/88/1024101688.db2.gz YORJLCQCXACMKN-AWEZNQCLSA-N 2 0 328.403 4.337 20 0 EIADRP C[C@@H](CCc1c(F)cccc1F)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000510653628 1024174009 /nfs/dbraw/zinc/17/40/09/1024174009.db2.gz SMXNTJGYXKPTDC-HNNXBMFYSA-N 2 0 332.438 4.137 20 0 EIADRP CCSc1cccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000473138877 1024382326 /nfs/dbraw/zinc/38/23/26/1024382326.db2.gz HGCCRADDZDMVMT-XLIONFOSSA-N 2 0 330.541 4.247 20 0 EIADRP Cc1ccc2[nH]c(C[NH+]3CCC(CCC[NH+](C)C)CC3)cc2c1C ZINC000473140721 1024408527 /nfs/dbraw/zinc/40/85/27/1024408527.db2.gz DTGNYLIYFDSYAH-UHFFFAOYSA-N 2 0 327.516 4.339 20 0 EIADRP CC(C)c1ccc([C@H](C)[N@@H+]2CCC[C@H]([C@H]3C[C@H]([NH3+])CCO3)C2)cc1 ZINC000652350439 1024702523 /nfs/dbraw/zinc/70/25/23/1024702523.db2.gz YMHSDDVBIKOYEF-VRXWPRPYSA-N 2 0 330.516 4.089 20 0 EIADRP Fc1ccc(/C=C/C[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1F ZINC000511926891 1024804989 /nfs/dbraw/zinc/80/49/89/1024804989.db2.gz MYQKHBSMGNFSCB-ZZXKWVIFSA-N 2 0 334.454 4.222 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@H]3CCCNc4ccccc43)C2)cc1 ZINC000249059197 1024875373 /nfs/dbraw/zinc/87/53/73/1024875373.db2.gz ZLRGILIFJDQZNB-OFNKIYASSA-N 2 0 349.522 4.088 20 0 EIADRP Cc1nc(C(C)C)sc1[C@H](C)[N@H+](C)Cc1cccc2c1CC[NH2+]C2 ZINC000662278575 1025024464 /nfs/dbraw/zinc/02/44/64/1025024464.db2.gz HELVGZNCAONQGR-HNNXBMFYSA-N 2 0 343.540 4.414 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+]([C@H](C)c2nc3ccccc3o2)CC1 ZINC000180981546 1025025802 /nfs/dbraw/zinc/02/58/02/1025025802.db2.gz BEOVRMWFSCDYQM-MRXNPFEDSA-N 2 0 329.488 4.333 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CCCc2c(Cl)cccc2Cl)[C@H](C)C1 ZINC000684613737 1025087107 /nfs/dbraw/zinc/08/71/07/1025087107.db2.gz KWQZEZWWMMSKHA-DYVFJYSZSA-N 2 0 329.315 4.246 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cnc2ccsc2c1 ZINC000663470615 1025420477 /nfs/dbraw/zinc/42/04/77/1025420477.db2.gz VMOQNMWCNJMMKX-GOEBONIOSA-N 2 0 329.513 4.069 20 0 EIADRP CC(C)CCOc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH3+])cc2)cc1 ZINC000563154200 1025438702 /nfs/dbraw/zinc/43/87/02/1025438702.db2.gz SEJKHVMGSHMSJD-KRWDZBQOSA-N 2 0 326.484 4.421 20 0 EIADRP Cc1ccc2[nH]c(C[NH2+]CC3CCN(c4cc[nH+]cc4)CC3)cc2c1C ZINC000472068674 1025608503 /nfs/dbraw/zinc/60/85/03/1025608503.db2.gz QEXNNWGIBRENDD-UHFFFAOYSA-N 2 0 348.494 4.186 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(COc2ccccc2)CC1 ZINC001167827436 1025657808 /nfs/dbraw/zinc/65/78/08/1025657808.db2.gz VZKFFTORHIINEZ-LJQANCHMSA-N 2 0 332.532 4.288 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+]1C[C@H]2[C@@H](C1)CCC[C@@H]2OCC1CC1 ZINC001167827670 1025665763 /nfs/dbraw/zinc/66/57/63/1025665763.db2.gz UNZHZGIPXRADAH-PBASOCQRSA-N 2 0 336.564 4.024 20 0 EIADRP CN(CCSc1cccc(Cl)c1)CC[C@@H]1CCCC[N@@H+]1C ZINC001167508630 1025770907 /nfs/dbraw/zinc/77/09/07/1025770907.db2.gz ILXUPWZJLPNARX-INIZCTEOSA-N 2 0 326.937 4.238 20 0 EIADRP CCC[C@@H](C(=O)c1ccccc1)[N@H+](C)[C@@H](C)CCC[NH+](CC)CC ZINC001167835291 1025835821 /nfs/dbraw/zinc/83/58/21/1025835821.db2.gz RBOJGSXQGMSUTF-ICSRJNTNSA-N 2 0 332.532 4.480 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCN([C@@H](C)c2ccc(F)cc2)CC1 ZINC001167835854 1025840062 /nfs/dbraw/zinc/84/00/62/1025840062.db2.gz URHYHUJXAIJPTP-MOPGFXCFSA-N 2 0 349.538 4.015 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@H]1c1ccc(C(=O)OC)cc1 ZINC001167836396 1025846037 /nfs/dbraw/zinc/84/60/37/1025846037.db2.gz ZHBCKCYUTFODNU-PXNSSMCTSA-N 2 0 346.515 4.121 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+](C)C1CC[NH+](C2CCCCC2)CC1 ZINC001167836224 1025846267 /nfs/dbraw/zinc/84/62/67/1025846267.db2.gz XUJIZKVZKPHALS-LJQANCHMSA-N 3 0 337.596 4.226 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@H](OCc2ccccc2)C1 ZINC001167837908 1025850352 /nfs/dbraw/zinc/85/03/52/1025850352.db2.gz NSONGBWXQUSDOW-CTNGQTDRSA-N 2 0 332.532 4.178 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)n1c2ccc(F)cc2c2c1CC[NH2+]C2 ZINC001167839430 1025852173 /nfs/dbraw/zinc/85/21/73/1025852173.db2.gz XRLMLRRTXQJQCA-HNNXBMFYSA-N 2 0 331.479 4.109 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(c2cccc(OC)c2)CC1 ZINC001167839709 1025853759 /nfs/dbraw/zinc/85/37/59/1025853759.db2.gz BLJBFEPTLOYMEZ-GOSISDBHSA-N 2 0 332.532 4.385 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@H+]1CC=C(c2ccc(OC)cc2)CC1 ZINC001167841354 1025882840 /nfs/dbraw/zinc/88/28/40/1025882840.db2.gz KXJAGGWCGCGYPS-SFHVURJKSA-N 2 0 330.516 4.295 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(Cc2cccc(OC)c2)CC1 ZINC001167841365 1025883248 /nfs/dbraw/zinc/88/32/48/1025883248.db2.gz LMAWZFZRHFXBIR-IBGZPJMESA-N 2 0 346.559 4.460 20 0 EIADRP CC(C)[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000432412234 1025883582 /nfs/dbraw/zinc/88/35/82/1025883582.db2.gz FSAQSRXSGVXEEL-QFBILLFUSA-N 2 0 338.923 4.128 20 0 EIADRP Clc1cccc(CCC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167968191 1025894582 /nfs/dbraw/zinc/89/45/82/1025894582.db2.gz NUCVMBLTLOOQOC-IHWFROFDSA-N 2 0 332.919 4.268 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167968911 1025935107 /nfs/dbraw/zinc/93/51/07/1025935107.db2.gz WSJOZLHANZAXER-KXZRCVDZSA-N 2 0 339.527 4.000 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2cc3ccncc3s2)c1 ZINC000657315568 1026009679 /nfs/dbraw/zinc/00/96/79/1026009679.db2.gz XHVZWTWFZYPLAY-UHFFFAOYSA-N 2 0 339.508 4.428 20 0 EIADRP Clc1cncc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C2CC2)c1 ZINC001167975033 1026218913 /nfs/dbraw/zinc/21/89/13/1026218913.db2.gz FWGSBQPCHJIAKS-RAFMOHDBSA-N 2 0 345.918 4.181 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(C3CCC3)cc2)[C@H](C)C1 ZINC000550138375 1026224629 /nfs/dbraw/zinc/22/46/29/1026224629.db2.gz DKRAVRWHUSBTAN-XMSQKQJNSA-N 2 0 344.543 4.181 20 0 EIADRP CC[N@H+](CCC1CC[NH+](CCCc2cnccc2C)CC1)CC1CC1 ZINC000582148847 1026258080 /nfs/dbraw/zinc/25/80/80/1026258080.db2.gz KKPCNNLASYHVLW-UHFFFAOYSA-N 2 0 343.559 4.157 20 0 EIADRP Cc1ccc2cc(C[NH+]3CCC(CCC[NH+](C)C)CC3)ccc2n1 ZINC000187372729 1026374786 /nfs/dbraw/zinc/37/47/86/1026374786.db2.gz IOMVXRMDSWJOEA-UHFFFAOYSA-N 2 0 325.500 4.097 20 0 EIADRP CN(c1ccccc1C[NH2+]C1CC(C(C)(C)C)C1)C1CC[NH+](C)CC1 ZINC000550256797 1026430686 /nfs/dbraw/zinc/43/06/86/1026430686.db2.gz PXOVHSXRZUVBQM-UHFFFAOYSA-N 2 0 343.559 4.131 20 0 EIADRP Clc1cc2cccnc2c(C[NH2+]CCCCC[NH+]2CCCC2)c1 ZINC000550262717 1026443226 /nfs/dbraw/zinc/44/32/26/1026443226.db2.gz PGHIHWDJIRYVJC-UHFFFAOYSA-N 2 0 331.891 4.244 20 0 EIADRP Clc1ccc2c(c1)[C@H]([NH2+]C[C@H]1CC[N@@H+](C3CC3)C1)CCCS2 ZINC000152450343 1026574875 /nfs/dbraw/zinc/57/48/75/1026574875.db2.gz ZOTYRNXZXXDPND-CXAGYDPISA-N 2 0 336.932 4.341 20 0 EIADRP Clc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@@H+](C3CC3)C1)CCCS2 ZINC000152450135 1026575298 /nfs/dbraw/zinc/57/52/98/1026575298.db2.gz ZOTYRNXZXXDPND-SUMWQHHRSA-N 2 0 336.932 4.341 20 0 EIADRP C[C@H](NCc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccccn1 ZINC000158671002 1026621575 /nfs/dbraw/zinc/62/15/75/1026621575.db2.gz AQWCYSGSEPENMI-OTWHNJEPSA-N 2 0 337.511 4.410 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc2c(c1)CCC2 ZINC000512318486 1026687268 /nfs/dbraw/zinc/68/72/68/1026687268.db2.gz PSCVPWZULWJPBL-FIKGOQFSSA-N 2 0 326.528 4.479 20 0 EIADRP c1cc(C[NH2+][C@H]2CCC[C@@H](c3ccccc3)C2)n(-c2cc[nH+]cc2)n1 ZINC000657448440 1026743869 /nfs/dbraw/zinc/74/38/69/1026743869.db2.gz ZIYBFXYUBXVLHR-MOPGFXCFSA-N 2 0 332.451 4.083 20 0 EIADRP c1csc(-c2ncc(C[NH+]3CCC(C[NH+]4CCCC4)CC3)s2)c1 ZINC000152678528 1026766443 /nfs/dbraw/zinc/76/64/43/1026766443.db2.gz XWDMQUBWTNFSIQ-UHFFFAOYSA-N 2 0 347.553 4.179 20 0 EIADRP CCc1cccnc1[C@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000507496646 1026811674 /nfs/dbraw/zinc/81/16/74/1026811674.db2.gz OZAOXBGPMUJVSV-KRWDZBQOSA-N 2 0 325.500 4.335 20 0 EIADRP CCc1cccnc1[C@H](C)[NH2+]Cc1cccc(C[NH+](CC)CC)c1 ZINC000507488438 1026814915 /nfs/dbraw/zinc/81/49/15/1026814915.db2.gz ULNCAJQEHFNMEY-KRWDZBQOSA-N 2 0 325.500 4.337 20 0 EIADRP FC1(F)CCC[C@H]([NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000507507622 1026821437 /nfs/dbraw/zinc/82/14/37/1026821437.db2.gz IOOLLBJQJRQTIL-CADBVGFASA-N 2 0 334.454 4.065 20 0 EIADRP Cc1cccc2c(CC[NH2+]C3CC[NH+](C4CCCC4)CC3)c[nH]c21 ZINC000164443570 1026835232 /nfs/dbraw/zinc/83/52/32/1026835232.db2.gz NXQZQOZLSIAQAX-UHFFFAOYSA-N 2 0 325.500 4.015 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@H]3CCCc4cccnc43)cc2)C1 ZINC000684954074 1026888560 /nfs/dbraw/zinc/88/85/60/1026888560.db2.gz PJDFCSLTKCFGES-AVRDEDQJSA-N 2 0 349.522 4.481 20 0 EIADRP CCC[C@@H](CCc1ccccc1)[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000519655969 1026935518 /nfs/dbraw/zinc/93/55/18/1026935518.db2.gz RQSQWZSTVXKGME-IBGZPJMESA-N 2 0 334.573 4.205 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1cccnc1Cl ZINC000178634851 1026983865 /nfs/dbraw/zinc/98/38/65/1026983865.db2.gz CQONWVJOVPAQLN-MRXNPFEDSA-N 2 0 343.902 4.298 20 0 EIADRP FC(F)(F)c1cccc(CCCC[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c1 ZINC000474470002 1027095947 /nfs/dbraw/zinc/09/59/47/1027095947.db2.gz CYJYJKDSTSAWOZ-ROUUACIJSA-N 2 0 340.433 4.245 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)C1CCSCC1 ZINC000474472351 1027098449 /nfs/dbraw/zinc/09/84/49/1027098449.db2.gz OEQXUDNFURTZMM-KRWDZBQOSA-N 2 0 332.557 4.294 20 0 EIADRP Cc1[nH+]c2ccccc2c(NC2CC[NH+](Cc3ccccn3)CC2)c1C ZINC000302061964 1027201192 /nfs/dbraw/zinc/20/11/92/1027201192.db2.gz CPYGICYQICDHPX-UHFFFAOYSA-N 2 0 346.478 4.323 20 0 EIADRP Cc1cc2c(cn1)[C@H]([NH2+][C@@H]1C[C@@H](C)[N@H+](Cc3ccccc3)[C@@H](C)C1)CC2 ZINC001168037448 1027252840 /nfs/dbraw/zinc/25/28/40/1027252840.db2.gz YNXQNUNCCVXXKE-NNTZPNAXSA-N 2 0 349.522 4.409 20 0 EIADRP CC(C)[C@@H]1CCC[C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C1 ZINC000657613480 1027288540 /nfs/dbraw/zinc/28/85/40/1027288540.db2.gz KZVIHCPSZJLCAF-RTWAWAEBSA-N 2 0 329.532 4.098 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H]2C[C@H](C)C[C@H](c3ccccc3)C2)CC1 ZINC000159237636 1027327580 /nfs/dbraw/zinc/32/75/80/1027327580.db2.gz BKCNMJJLCKMJFJ-KAGYGMCKSA-N 2 0 344.543 4.049 20 0 EIADRP C[C@H]1CC([N@@H+]2CCc3ccccc3C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168039975 1027351797 /nfs/dbraw/zinc/35/17/97/1027351797.db2.gz JEZKLHMOMIMYEP-OALUTQOASA-N 2 0 334.507 4.486 20 0 EIADRP CN1CC[C@H]([NH2+][C@H]2CCCN(C)c3ccccc32)C[C@H]1c1ccccc1 ZINC000453348351 1027416386 /nfs/dbraw/zinc/41/63/86/1027416386.db2.gz GCYYCWMHUNINKH-RRPUWOKSSA-N 2 0 349.522 4.383 20 0 EIADRP CN1CC[C@H]([NH2+][C@H]2CCCN(C)c3ccccc32)C[C@@H]1c1ccccc1 ZINC000453348349 1027417501 /nfs/dbraw/zinc/41/75/01/1027417501.db2.gz GCYYCWMHUNINKH-IEIRFRATSA-N 2 0 349.522 4.383 20 0 EIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1 ZINC000474812444 1027535360 /nfs/dbraw/zinc/53/53/60/1027535360.db2.gz DLGLOJSPEFFUFJ-JKSUJKDBSA-N 2 0 344.474 4.178 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CCCCc2cccc(C(F)(F)F)c2)CC[N@@H+]1C ZINC000474818035 1027539263 /nfs/dbraw/zinc/53/92/63/1027539263.db2.gz RJOIYUWTFAWKDB-RHSMWYFYSA-N 2 0 328.422 4.100 20 0 EIADRP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCCC1)c1ccc(OC(F)F)cc1 ZINC000320904108 1027544638 /nfs/dbraw/zinc/54/46/38/1027544638.db2.gz CLRMOYYJAYHBIG-LSDHHAIUSA-N 2 0 326.431 4.061 20 0 EIADRP [NH2+]=C(NCc1cccc(C[NH+]2CCCCCC2)c1)Nc1ccccc1 ZINC000303373182 1027550242 /nfs/dbraw/zinc/55/02/42/1027550242.db2.gz MCPUQENFGWDZAR-UHFFFAOYSA-N 2 0 336.483 4.199 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2cccc(Br)c21 ZINC000152452862 1027596580 /nfs/dbraw/zinc/59/65/80/1027596580.db2.gz KVIRHUJTDJHUEY-IIYDPXPESA-N 2 0 349.316 4.071 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)C1CCSCC1 ZINC000474879490 1027710130 /nfs/dbraw/zinc/71/01/30/1027710130.db2.gz QSEBCSBXVSYDQW-HBFSDRIKSA-N 2 0 346.584 4.408 20 0 EIADRP C[N@H+](CCc1ccccc1Cl)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995402 1027756391 /nfs/dbraw/zinc/75/63/91/1027756391.db2.gz DRHTXJWREUTILX-DFNIBXOVSA-N 2 0 332.919 4.220 20 0 EIADRP CCCc1nc(C)c(C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)o1 ZINC000428366738 1027803905 /nfs/dbraw/zinc/80/39/05/1027803905.db2.gz ZABQIFAWVPZULD-QGZVFWFLSA-N 2 0 347.547 4.412 20 0 EIADRP FC1(F)CC12CCC([NH2+]C1CC[NH+](C3CCCCC3)CC1)CC2 ZINC000657716440 1027842061 /nfs/dbraw/zinc/84/20/61/1027842061.db2.gz JNSQQUUWEZJMEN-UHFFFAOYSA-N 2 0 326.475 4.341 20 0 EIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000520460118 1028047284 /nfs/dbraw/zinc/04/72/84/1028047284.db2.gz XUCYOUUHUYTUOZ-LJISPDSOSA-N 2 0 326.937 4.213 20 0 EIADRP CCCc1nc(C)c(C[NH+]2CCC(CC[N@H+](CC)CC3CC3)CC2)o1 ZINC000428313705 1028069218 /nfs/dbraw/zinc/06/92/18/1028069218.db2.gz XTCBSBTUJFIONN-UHFFFAOYSA-N 2 0 347.547 4.270 20 0 EIADRP CCc1ccc(C[NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)o1 ZINC000150830369 1028254504 /nfs/dbraw/zinc/25/45/04/1028254504.db2.gz ACDLGHACUBPLSL-UHFFFAOYSA-N 2 0 338.451 4.357 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]([C@@H](C)c1ccccc1)C1CC1 ZINC000346128065 1028268839 /nfs/dbraw/zinc/26/88/39/1028268839.db2.gz DGINYJTXRZDXKX-KRWDZBQOSA-N 2 0 332.451 4.301 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)[C@H](c1ccccc1)C(C)C ZINC000346178406 1028307521 /nfs/dbraw/zinc/30/75/21/1028307521.db2.gz PRNARHNAGNXDDS-NRFANRHFSA-N 2 0 334.467 4.405 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)[C@@H](C)c1cccc(Cl)c1 ZINC000346207113 1028329712 /nfs/dbraw/zinc/32/97/12/1028329712.db2.gz MCOSMCTXVJPVJN-HNNXBMFYSA-N 2 0 340.858 4.422 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@H]1/C=C\c1ccccc1 ZINC000346350245 1028384229 /nfs/dbraw/zinc/38/42/29/1028384229.db2.gz JTRFTWXYTDLOFE-YUQDSPFASA-N 2 0 344.462 4.254 20 0 EIADRP Fc1cncc([C@@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)C2CC2)c1 ZINC000281266309 1028478468 /nfs/dbraw/zinc/47/84/68/1028478468.db2.gz OYFJKNXNSBKORP-NRFANRHFSA-N 2 0 339.458 4.057 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1F ZINC000162910291 1028531214 /nfs/dbraw/zinc/53/12/14/1028531214.db2.gz GZWYJEAGFWROOU-INIZCTEOSA-N 2 0 342.458 4.281 20 0 EIADRP c1[nH]c2ccccc2c1CCC[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000156356657 1028724994 /nfs/dbraw/zinc/72/49/94/1028724994.db2.gz GWJYNNXXXKTRFW-UHFFFAOYSA-N 2 0 325.500 4.097 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CNc2ccccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000635021329 1028830921 /nfs/dbraw/zinc/83/09/21/1028830921.db2.gz NXESBSKLAMBYHW-SESVDKBCSA-N 2 0 349.522 4.086 20 0 EIADRP CC(C)O[C@H](C[NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1 ZINC000428326125 1028879673 /nfs/dbraw/zinc/87/96/73/1028879673.db2.gz OMVAWMLDOVTIHS-SYYKKAFVSA-N 2 0 344.543 4.395 20 0 EIADRP c1ccc2c(CC[NH2+]C3CC[NH+](C4CCCCC4)CC3)nsc2c1 ZINC000657771059 1028880724 /nfs/dbraw/zinc/88/07/24/1028880724.db2.gz ZVFQDTRIJYUDGV-UHFFFAOYSA-N 2 0 343.540 4.226 20 0 EIADRP FC1(F)CCC([NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)CC1 ZINC000657771850 1028891224 /nfs/dbraw/zinc/89/12/24/1028891224.db2.gz HHNHMSVAPPAUOG-SFHVURJKSA-N 2 0 348.481 4.456 20 0 EIADRP CC(C)OC1CC[NH+]([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168050736 1028911834 /nfs/dbraw/zinc/91/18/34/1028911834.db2.gz CODMMJPJPLSGLX-CEQLMSFQSA-N 2 0 344.543 4.317 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]CCC2(C[NH3+])CC2)CCC3)cc1 ZINC000650744369 1029064336 /nfs/dbraw/zinc/06/43/36/1029064336.db2.gz MQNGVVABNVIHMG-MRXNPFEDSA-N 2 0 341.524 4.215 20 0 EIADRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000650746080 1029080985 /nfs/dbraw/zinc/08/09/85/1029080985.db2.gz VSYYJAQSYIGTGQ-LBPRGKRZSA-N 2 0 332.435 4.121 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@@H](Cc2ccccc2Cl)c2cccs2)CC1 ZINC000650748147 1029094760 /nfs/dbraw/zinc/09/47/60/1029094760.db2.gz OCURNGUWLDIKLC-INIZCTEOSA-N 2 0 334.916 4.404 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650754191 1029167587 /nfs/dbraw/zinc/16/75/87/1029167587.db2.gz CTROUEAOZNYEEG-FQEVSTJZSA-N 2 0 342.458 4.411 20 0 EIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)CCCO2 ZINC000650755025 1029186269 /nfs/dbraw/zinc/18/62/69/1029186269.db2.gz WZWDESSYMMUYIX-FQEVSTJZSA-N 2 0 342.458 4.411 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1sc(C(C)(C)C)nc1C ZINC000650758456 1029212921 /nfs/dbraw/zinc/21/29/21/1029212921.db2.gz QDRCLSLSCHTMOD-CYBMUJFWSA-N 2 0 331.529 4.319 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(Br)s1 ZINC000278460526 1029279998 /nfs/dbraw/zinc/27/99/98/1029279998.db2.gz MMRHBOIUXFQSPK-NSHDSACASA-N 2 0 343.334 4.036 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CCC1CC[NH2+]CC1 ZINC000650764349 1029280606 /nfs/dbraw/zinc/28/06/06/1029280606.db2.gz WQDHGWLHNJNXCS-ZDUSSCGKSA-N 2 0 347.503 4.298 20 0 EIADRP CCCCCOc1ccc(C[N@@H+]2CCCC23CC[NH+](C)CC3)cc1 ZINC000475125803 1029281681 /nfs/dbraw/zinc/28/16/81/1029281681.db2.gz WOQMZFWEOBLSDF-UHFFFAOYSA-N 2 0 330.516 4.316 20 0 EIADRP CCCN(CCC[NH+](C)C)[C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168056818 1029313342 /nfs/dbraw/zinc/31/33/42/1029313342.db2.gz ITDSZQIWIRWWHC-VTYHHJSWSA-N 2 0 345.575 4.092 20 0 EIADRP CCOCC1CC[NH+]([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168059677 1029440826 /nfs/dbraw/zinc/44/08/26/1029440826.db2.gz GHENJZRINXOISQ-HATOLVCRSA-N 2 0 344.543 4.177 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000657841285 1029755001 /nfs/dbraw/zinc/75/50/01/1029755001.db2.gz OPFNPJMHCNKEAE-TZMCWYRMSA-N 2 0 348.840 4.221 20 0 EIADRP C[C@H]([NH2+][C@H]1c2ccccc2C[C@@H]1C)c1cccc(OCC[NH+](C)C)c1 ZINC000089613814 1029850715 /nfs/dbraw/zinc/85/07/15/1029850715.db2.gz LMCCYFPHDGVMMT-PNLZDCPESA-N 2 0 338.495 4.211 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)c1ccc(OC)c(OC)c1 ZINC000090586285 1029867692 /nfs/dbraw/zinc/86/76/92/1029867692.db2.gz ZLTFGVIRUJHFKJ-MJGOQNOKSA-N 2 0 348.531 4.113 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](C[C@@H]2CCCCN2C(C)C)CC1 ZINC000450722132 1029916495 /nfs/dbraw/zinc/91/64/95/1029916495.db2.gz ZGLGKRSIXXCLBP-NRFANRHFSA-N 2 0 337.596 4.083 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1ccc(F)cn1 ZINC000092739199 1029932529 /nfs/dbraw/zinc/93/25/29/1029932529.db2.gz IINWQCKZOMSQAU-SJORKVTESA-N 2 0 341.474 4.446 20 0 EIADRP Cc1ccoc1C[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000525694530 1029935108 /nfs/dbraw/zinc/93/51/08/1029935108.db2.gz ACCDUGKHDOTXJL-CALCHBBNSA-N 2 0 326.484 4.356 20 0 EIADRP CC[C@@H]([NH2+][C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1OC ZINC000183187539 1029992803 /nfs/dbraw/zinc/99/28/03/1029992803.db2.gz UNTAPTLJWLZMII-MBOZVWFJSA-N 2 0 330.516 4.389 20 0 EIADRP COCCC1(C[NH2+]C2CCC([NH+]3CCCCC3)CC2)CCCCC1 ZINC000780536498 1030023402 /nfs/dbraw/zinc/02/34/02/1030023402.db2.gz IEWTWAAWHQYEBY-UHFFFAOYSA-N 2 0 336.564 4.360 20 0 EIADRP COc1ccccc1[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)C1CCCC1 ZINC000447558121 1030168473 /nfs/dbraw/zinc/16/84/73/1030168473.db2.gz MUDATZMTEBNWDV-QFIPXVFZSA-N 2 0 342.527 4.391 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H](Cc2ccc(F)cc2)c2ccccc2)CC1 ZINC000447561338 1030170638 /nfs/dbraw/zinc/17/06/38/1030170638.db2.gz HTDVVJVTSFJYJA-NRFANRHFSA-N 2 0 326.459 4.041 20 0 EIADRP FC1(F)CCC([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000447577525 1030205795 /nfs/dbraw/zinc/20/57/95/1030205795.db2.gz AKLJDXZMSMXKRW-LDLYASANSA-N 2 0 334.454 4.350 20 0 EIADRP C[C@@H](CC[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1)c1ccccc1 ZINC000447735318 1030312892 /nfs/dbraw/zinc/31/28/92/1030312892.db2.gz CVXCFBZANCNWSL-XUVXKRRUSA-N 2 0 344.543 4.001 20 0 EIADRP C[C@@H]([NH2+]CCc1ccc(F)c(F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000527041848 1030422386 /nfs/dbraw/zinc/42/23/86/1030422386.db2.gz BSTWTEHIJUHSFI-VQIMIIECSA-N 2 0 344.449 4.008 20 0 EIADRP CC[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)CCO1 ZINC000648423712 1030441190 /nfs/dbraw/zinc/44/11/90/1030441190.db2.gz WUALTKPMLVBRDW-DUXKGJEZSA-N 2 0 330.516 4.108 20 0 EIADRP CCOC1CCC([NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000657907438 1030454483 /nfs/dbraw/zinc/45/44/83/1030454483.db2.gz LUOSNXNSQHMMSV-KHQYNDFOSA-N 2 0 344.543 4.080 20 0 EIADRP Cc1c([C@@H](C)NC2CC[NH+](C3CCCCC3)CC2)cnn1C(C)(C)C ZINC000191325764 1030616946 /nfs/dbraw/zinc/61/69/46/1030616946.db2.gz JLNLOWYSWRGGMH-MRXNPFEDSA-N 2 0 346.563 4.394 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CCCSCC2)C[N@@H+]1Cc1ccccc1 ZINC000657934215 1030632468 /nfs/dbraw/zinc/63/24/68/1030632468.db2.gz ZZRLTWMYIHHYPQ-MISYRCLQSA-N 2 0 332.557 4.162 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000548851784 1030632493 /nfs/dbraw/zinc/63/24/93/1030632493.db2.gz FHCPGEDZZOCZAD-LTBFUDJGSA-N 2 0 326.406 4.040 20 0 EIADRP COCC1(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CCCCC1 ZINC000685665272 1030663147 /nfs/dbraw/zinc/66/31/47/1030663147.db2.gz QERVGKLNGHBMDL-CTNGQTDRSA-N 2 0 344.543 4.084 20 0 EIADRP Cc1cc(F)ccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398051031 1030693746 /nfs/dbraw/zinc/69/37/46/1030693746.db2.gz XSMZPGYZINEKAE-DYESRHJHSA-N 2 0 326.459 4.134 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)[C@@H](C)C1CCCCC1 ZINC000658066996 1030812076 /nfs/dbraw/zinc/81/20/76/1030812076.db2.gz JHHIDCNEAXLQAT-MSOLQXFVSA-N 2 0 336.564 4.072 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)c2sccc21 ZINC000658069520 1030815179 /nfs/dbraw/zinc/81/51/79/1030815179.db2.gz GNFZVGVGUFBMSK-BEFAXECRSA-N 2 0 348.556 4.167 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+]C[C@H]2CCN(c3ccccc3Cl)C2)CC1 ZINC000658069671 1030815347 /nfs/dbraw/zinc/81/53/47/1030815347.db2.gz QDGQQZVPZPUWFK-MRXNPFEDSA-N 2 0 349.950 4.019 20 0 EIADRP Brc1ccc(/C=C/CC[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000527741682 1030838909 /nfs/dbraw/zinc/83/89/09/1030838909.db2.gz AEKFDMYGDLWECB-HNBCNZSYSA-N 2 0 349.316 4.069 20 0 EIADRP c1cc(C[NH+]2CCC(C[NH2+][C@@H]3CCCC34CCCCC4)CC2)ccn1 ZINC000658161868 1030859383 /nfs/dbraw/zinc/85/93/83/1030859383.db2.gz BGVOHIMBNAZFGZ-OAQYLSRUSA-N 2 0 341.543 4.386 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ncc(-c3cccc(F)c3)o2)CC1 ZINC000531107712 1030880710 /nfs/dbraw/zinc/88/07/10/1030880710.db2.gz KCDQOBDZDILYMM-UHFFFAOYSA-N 2 0 345.462 4.033 20 0 EIADRP COCCC1CC[NH+](C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CC1 ZINC000527933612 1030974708 /nfs/dbraw/zinc/97/47/08/1030974708.db2.gz HAIOBKFOGBJZHK-UHFFFAOYSA-N 2 0 338.580 4.414 20 0 EIADRP Cc1cncc([C@@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)c1 ZINC000658320180 1030980577 /nfs/dbraw/zinc/98/05/77/1030980577.db2.gz PLRQHZYWPSYAOD-DENIHFKCSA-N 2 0 349.522 4.343 20 0 EIADRP C[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000527964488 1031006187 /nfs/dbraw/zinc/00/61/87/1031006187.db2.gz KSCRHKLTRJXPFS-ZEYPLWLESA-N 2 0 349.522 4.423 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H]2CC3(CCC3)Oc3ccccc32)CC1 ZINC000122754701 1031013326 /nfs/dbraw/zinc/01/33/26/1031013326.db2.gz IRFNDYSZHMWNPA-IBGZPJMESA-N 2 0 328.500 4.145 20 0 EIADRP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658353009 1031020732 /nfs/dbraw/zinc/02/07/32/1031020732.db2.gz BCFIYKNYQJLGNW-CQSZACIVSA-N 2 0 335.561 4.348 20 0 EIADRP Cc1[nH]c2ccc(F)cc2c1CC[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000527995555 1031020910 /nfs/dbraw/zinc/02/09/10/1031020910.db2.gz NDKUMUUUSBSEGJ-UHFFFAOYSA-N 2 0 331.479 4.010 20 0 EIADRP Cc1cccnc1[C@H]1CCC[C@@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)C1 ZINC000658353732 1031022584 /nfs/dbraw/zinc/02/25/84/1031022584.db2.gz QRIHGLPMLKDTMJ-LEWJYISDSA-N 2 0 341.543 4.128 20 0 EIADRP CSc1ccccc1C[C@H](C)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658357665 1031027020 /nfs/dbraw/zinc/02/70/20/1031027020.db2.gz VFQTVQZDQBQPDM-INIZCTEOSA-N 2 0 332.557 4.051 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1cccc(Br)n1 ZINC000924528620 1031034978 /nfs/dbraw/zinc/03/49/78/1031034978.db2.gz ONVNJQBHOXMDOW-UONOGXRCSA-N 2 0 342.325 4.005 20 0 EIADRP C[C@@H](NC(C)(C)C[NH2+][C@H]1CCc2cccnc2CC1)c1ccccc1 ZINC000421840423 1031035147 /nfs/dbraw/zinc/03/51/47/1031035147.db2.gz ZBOFTRMWXUKRCM-XLIONFOSSA-N 2 0 337.511 4.048 20 0 EIADRP C[C@H]([NH2+]CCO[C@H]1CCCC[C@H]1C)c1ccc(-n2ccnc2)cc1 ZINC000532448165 1031076656 /nfs/dbraw/zinc/07/66/56/1031076656.db2.gz SJQNLCLADFSNJH-UWVAXJGDSA-N 2 0 327.472 4.118 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCc2ccccc21 ZINC000532446488 1031080707 /nfs/dbraw/zinc/08/07/07/1031080707.db2.gz CMWPFEJCCNHKJL-OAQYLSRUSA-N 2 0 338.495 4.184 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+][C@H]1CSCCc2ccccc21 ZINC000532459796 1031100275 /nfs/dbraw/zinc/10/02/75/1031100275.db2.gz MGUXAHSFRAMYGF-PXNSSMCTSA-N 2 0 332.557 4.261 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cccc(F)c1 ZINC000171126265 1031187846 /nfs/dbraw/zinc/18/78/46/1031187846.db2.gz FZMOERULCPUINJ-INIZCTEOSA-N 2 0 330.447 4.007 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2ccccc2C(F)(F)F)CC1 ZINC000532483071 1031217099 /nfs/dbraw/zinc/21/70/99/1031217099.db2.gz YCEYOWZHEPSZDL-CQSZACIVSA-N 2 0 328.422 4.478 20 0 EIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc(C)c1F ZINC000532501142 1031222036 /nfs/dbraw/zinc/22/20/36/1031222036.db2.gz LEDVSYZWURPCOB-HNNXBMFYSA-N 2 0 332.438 4.494 20 0 EIADRP c1c2cccnc2oc1C[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000449067511 1031408888 /nfs/dbraw/zinc/40/88/88/1031408888.db2.gz MAUHZTVWRYLCTI-UHFFFAOYSA-N 2 0 335.451 4.104 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccnn2C2CCCC2)c1 ZINC000449087078 1031416932 /nfs/dbraw/zinc/41/69/32/1031416932.db2.gz DLSKXNIEPFZUST-UHFFFAOYSA-N 2 0 340.515 4.130 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1cc2cccnc2o1 ZINC000449080974 1031437185 /nfs/dbraw/zinc/43/71/85/1031437185.db2.gz ATIQUIDCLZEUSB-QGZVFWFLSA-N 2 0 349.478 4.492 20 0 EIADRP COc1cc(C)ccc1C[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000449098405 1031441678 /nfs/dbraw/zinc/44/16/78/1031441678.db2.gz JGHDBKOIDDNKPS-UHFFFAOYSA-N 2 0 326.484 4.134 20 0 EIADRP Clc1ccc(C2=CC[C@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CC2)cc1 ZINC000449089122 1031449447 /nfs/dbraw/zinc/44/94/47/1031449447.db2.gz JICCKKQQTOBXDY-XUVXKRRUSA-N 2 0 330.903 4.492 20 0 EIADRP Clc1ccc(C[C@@H]2CCC[C@@H]2[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000449090466 1031449889 /nfs/dbraw/zinc/44/98/89/1031449889.db2.gz NDBVQOMVJODAMD-FFGOWVMKSA-N 2 0 332.919 4.268 20 0 EIADRP CC1CC[NH+](Cc2cccc(C[NH2+]Cc3cc4cccnc4o3)c2)CC1 ZINC000449129440 1031464151 /nfs/dbraw/zinc/46/41/51/1031464151.db2.gz CGSQMBOGWFRALI-UHFFFAOYSA-N 2 0 349.478 4.350 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@H]2CSCCc3ccccc32)C1 ZINC000531681415 1031473457 /nfs/dbraw/zinc/47/34/57/1031473457.db2.gz VHWIFIOIVVOQKZ-XLIONFOSSA-N 2 0 332.557 4.119 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)C1CCOCC1 ZINC000531682142 1031473768 /nfs/dbraw/zinc/47/37/68/1031473768.db2.gz HNOMNZUCSCQWCA-PGRDOPGGSA-N 2 0 344.543 4.356 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCCOc3ccc(F)cc32)c1 ZINC000123913889 1031491583 /nfs/dbraw/zinc/49/15/83/1031491583.db2.gz FAZSWWPAVZOLEF-FQEVSTJZSA-N 2 0 342.458 4.281 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCOc3cc(C)ccc32)c1 ZINC000123914216 1031493138 /nfs/dbraw/zinc/49/31/38/1031493138.db2.gz SOTGBNULVKXIRS-OAQYLSRUSA-N 2 0 338.495 4.450 20 0 EIADRP CC[C@H](C[C@@H](C)CO)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449172913 1031494424 /nfs/dbraw/zinc/49/44/24/1031494424.db2.gz KGIFPHQPSITMEM-IAGOWNOFSA-N 2 0 326.569 4.052 20 0 EIADRP CC(C)(C)[NH+]1CCC(NCC2([NH+]3CCCCC3)CCCCC2)CC1 ZINC000531692685 1031505072 /nfs/dbraw/zinc/50/50/72/1031505072.db2.gz UBJSNZHXPJTUSC-UHFFFAOYSA-N 2 0 335.580 4.028 20 0 EIADRP C[C@H](Cc1coc2ccccc12)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000449185279 1031523559 /nfs/dbraw/zinc/52/35/59/1031523559.db2.gz NPPBJYBNMSJUCB-MRXNPFEDSA-N 2 0 326.484 4.360 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c2sccc21 ZINC000453069627 1031534795 /nfs/dbraw/zinc/53/47/95/1031534795.db2.gz UCNYCIYMNYWZKH-BEFAXECRSA-N 2 0 344.524 4.417 20 0 EIADRP C[C@@H](CCCc1cccnc1)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000453075286 1031557419 /nfs/dbraw/zinc/55/74/19/1031557419.db2.gz HJWKZVIZIPVOQU-IBGZPJMESA-N 2 0 337.511 4.178 20 0 EIADRP CC[C@@H](CC(F)(F)F)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449243600 1031579362 /nfs/dbraw/zinc/57/93/62/1031579362.db2.gz LXNFBYZYFBMLNE-RDJZCZTQSA-N 2 0 342.449 4.403 20 0 EIADRP CC[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccccc1OC(F)F ZINC000125422159 1031595526 /nfs/dbraw/zinc/59/55/26/1031595526.db2.gz NDQJAAUYGWETGG-MRXNPFEDSA-N 2 0 326.431 4.061 20 0 EIADRP CCOC1(C[NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)CCCC1 ZINC000449342927 1031642023 /nfs/dbraw/zinc/64/20/23/1031642023.db2.gz GKCYBRJENQVFLF-IBGZPJMESA-N 2 0 344.543 4.021 20 0 EIADRP CC1(C)C[N@H+](Cc2cccnc2)[C@@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000449413591 1031696394 /nfs/dbraw/zinc/69/63/94/1031696394.db2.gz JLEQUDOGHOUGMZ-JOCHJYFZSA-N 2 0 349.522 4.204 20 0 EIADRP Cc1cc([C@H](C)[NH2+]C2CCN(c3cccc(C)n3)CC2)c(C)s1 ZINC000128088394 1031722861 /nfs/dbraw/zinc/72/28/61/1031722861.db2.gz AIRVXDGFLMGPBL-HNNXBMFYSA-N 2 0 329.513 4.388 20 0 EIADRP FC(F)C1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)CC1 ZINC000453228680 1031749261 /nfs/dbraw/zinc/74/92/61/1031749261.db2.gz UTBGRQFFYXVERG-KZNAEPCWSA-N 2 0 334.454 4.065 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCCCC1(F)F)c1ccc(OCC[NH+](C)C)cc1 ZINC000453242053 1031798672 /nfs/dbraw/zinc/79/86/72/1031798672.db2.gz FBEINZABQYEUEP-DOTOQJQBSA-N 2 0 340.458 4.103 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCCCC1(F)F)c1ccc(OCC[NH+](C)C)cc1 ZINC000453242078 1031798750 /nfs/dbraw/zinc/79/87/50/1031798750.db2.gz FBEINZABQYEUEP-WBVHZDCISA-N 2 0 340.458 4.103 20 0 EIADRP CC(C)[C@@H]1C[C@H](C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)CCO1 ZINC000449495663 1031804334 /nfs/dbraw/zinc/80/43/34/1031804334.db2.gz OVXXVEOFDORXDN-ZSXPUABSSA-N 2 0 336.564 4.070 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1)C1CCOCC1 ZINC000531947153 1031859372 /nfs/dbraw/zinc/85/93/72/1031859372.db2.gz HNGSHGJGTZTUDG-XMSQKQJNSA-N 2 0 344.543 4.213 20 0 EIADRP Cc1ccc(C)c([C@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c1 ZINC000531960729 1031877796 /nfs/dbraw/zinc/87/77/96/1031877796.db2.gz DAJPMKHGCOYNOC-IBGZPJMESA-N 2 0 340.511 4.485 20 0 EIADRP CCN(c1ccccc1)c1ccc(C[NH2+][C@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000531980329 1031928443 /nfs/dbraw/zinc/92/84/43/1031928443.db2.gz ZZLICZRAQDKBBY-QUCCMNQESA-N 2 0 337.511 4.417 20 0 EIADRP C[C@H]1CCCC[C@@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000531994307 1031963429 /nfs/dbraw/zinc/96/34/29/1031963429.db2.gz UPQSPABHJAUTHG-UGKGYDQZSA-N 2 0 344.543 4.226 20 0 EIADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000453419656 1031973072 /nfs/dbraw/zinc/97/30/72/1031973072.db2.gz VVKSITMDZXNWTP-PVIWCNJMSA-N 2 0 342.527 4.119 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(OC(F)(F)F)cc1 ZINC000453420100 1031975343 /nfs/dbraw/zinc/97/53/43/1031975343.db2.gz ZCLSHIBLHNIXJP-ZDUSSCGKSA-N 2 0 330.394 4.110 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)CCCS2 ZINC000453420456 1031975740 /nfs/dbraw/zinc/97/57/40/1031975740.db2.gz ZOWYIZKDDDQTEQ-SFHVURJKSA-N 2 0 334.529 4.086 20 0 EIADRP CCO[C@@H](C[NH2+]C1CCN(Cc2ccccc2)CC1)c1ccccc1 ZINC000193431181 1032047924 /nfs/dbraw/zinc/04/79/24/1032047924.db2.gz XVTXMSDUAFMTTL-QFIPXVFZSA-N 2 0 338.495 4.018 20 0 EIADRP CCO[C@@H](C[NH2+][C@@H](C)c1ccc(-n2ccnc2)cc1)c1ccccc1 ZINC000193431100 1032049198 /nfs/dbraw/zinc/04/91/98/1032049198.db2.gz SCQMKIKEOFCBHW-UWJYYQICSA-N 2 0 335.451 4.301 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)s2)C1 ZINC000512848749 1034066575 /nfs/dbraw/zinc/06/65/75/1034066575.db2.gz JDDDYIBUQDHLRE-CQSZACIVSA-N 2 0 334.916 4.500 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2cc3ccccc3[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000513053794 1034373228 /nfs/dbraw/zinc/37/32/28/1034373228.db2.gz YIPUERXUFQKWHR-YLJYHZDGSA-N 2 0 333.479 4.311 20 0 EIADRP FC(F)(F)c1ccccc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000261762087 1034563137 /nfs/dbraw/zinc/56/31/37/1034563137.db2.gz PWKBOIFZSGLQFI-BHYGNILZSA-N 2 0 326.406 4.106 20 0 EIADRP Fc1cc(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc(F)c1F ZINC000513395565 1034911777 /nfs/dbraw/zinc/91/17/77/1034911777.db2.gz MYKAUGHJQDMNEW-UHFFFAOYSA-N 2 0 340.433 4.033 20 0 EIADRP C[C@H]1C[C@H](CC[NH2+]Cc2ccc(Cl)o2)C[N@@H+]1Cc1ccccc1 ZINC000513501544 1034998081 /nfs/dbraw/zinc/99/80/81/1034998081.db2.gz TVTQRHXIURNJQL-RDJZCZTQSA-N 2 0 332.875 4.323 20 0 EIADRP CCc1ncc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)s1 ZINC000513500613 1034999339 /nfs/dbraw/zinc/99/93/39/1034999339.db2.gz NMKKXRFBVBDCFV-SJLPKXTDSA-N 2 0 343.540 4.096 20 0 EIADRP COc1cccc(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC000513510916 1035006564 /nfs/dbraw/zinc/00/65/64/1035006564.db2.gz GNHOOBOTGVCYPJ-WIYYLYMNSA-N 2 0 338.495 4.086 20 0 EIADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccc(SCC(F)F)cc1 ZINC000414170130 1035057027 /nfs/dbraw/zinc/05/70/27/1035057027.db2.gz BRWLMMLYWXWXTK-CABCVRRESA-N 2 0 342.499 4.426 20 0 EIADRP Cc1ccc([C@H](Cn2ccnc2)[NH2+][C@H](C)c2cccc(CO)c2)c(C)c1 ZINC000345246480 1035169252 /nfs/dbraw/zinc/16/92/52/1035169252.db2.gz HGFIOBNZYAMDBU-GCJKJVERSA-N 2 0 349.478 4.084 20 0 EIADRP c1cncc([C@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)C2CCC2)c1 ZINC000280150363 1035187467 /nfs/dbraw/zinc/18/74/67/1035187467.db2.gz AETLWXSQFISIQF-JOCHJYFZSA-N 2 0 335.495 4.308 20 0 EIADRP C[C@@H](CCc1ccccc1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501066456 1035366254 /nfs/dbraw/zinc/36/62/54/1035366254.db2.gz CQJSPKUHTYTRKQ-IBGZPJMESA-N 2 0 337.511 4.251 20 0 EIADRP Fc1ccccc1NCCC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000419685670 1035400198 /nfs/dbraw/zinc/40/01/98/1035400198.db2.gz NDVMZAYZNZFZLI-UHFFFAOYSA-N 2 0 333.495 4.014 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CCCc2cccc(C(F)(F)F)c2)[C@H]2CCC[C@@H]21 ZINC000513712196 1035425112 /nfs/dbraw/zinc/42/51/12/1035425112.db2.gz AJPCAEFOAIROLQ-SQNIBIBYSA-N 2 0 340.433 4.100 20 0 EIADRP c1cncc([C@H]2CCC[C@@H]([NH2+]CCCCC[NH+]3CCCCC3)C2)c1 ZINC000501425817 1035444009 /nfs/dbraw/zinc/44/40/09/1035444009.db2.gz PHFHFPOCNBDGAH-PZJWPPBQSA-N 2 0 329.532 4.354 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+]C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000501423737 1035444060 /nfs/dbraw/zinc/44/40/60/1035444060.db2.gz OJDHFAZUHJSFJS-RBFDBLARSA-N 2 0 340.433 4.430 20 0 EIADRP c1cncc([C@@H]2CCC[C@@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)c1 ZINC000501454085 1035448506 /nfs/dbraw/zinc/44/85/06/1035448506.db2.gz UDFJQBGPAJORMW-WIYYLYMNSA-N 2 0 341.543 4.495 20 0 EIADRP CSCC1(CC[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000595067423 1035552221 /nfs/dbraw/zinc/55/22/21/1035552221.db2.gz ILNPRTXKAGURLZ-IEBWSBKVSA-N 2 0 332.557 4.020 20 0 EIADRP CSCC1(CC[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000595073425 1035555098 /nfs/dbraw/zinc/55/50/98/1035555098.db2.gz SLDWDSCGUNGRBI-HKUYNNGSSA-N 2 0 332.557 4.020 20 0 EIADRP CC(C)c1ccc([C@H](C)[NH+]2CCC([C@@H]3C[C@@H]([NH3+])CCO3)CC2)cc1 ZINC000420388974 1035563141 /nfs/dbraw/zinc/56/31/41/1035563141.db2.gz LUDVXPYYDYPUPK-NDXORKPFSA-N 2 0 330.516 4.089 20 0 EIADRP FC(F)(F)c1cccc([C@H]([NH2+]CC[C@H]2CCC[NH2+]C2)C2CC2)c1 ZINC000420402601 1035576493 /nfs/dbraw/zinc/57/64/93/1035576493.db2.gz KBQZNWLYRALYCT-CXAGYDPISA-N 2 0 326.406 4.136 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 ZINC000491058987 1035799365 /nfs/dbraw/zinc/79/93/65/1035799365.db2.gz JNUKSVIXTXPWOM-HXUWFJFHSA-N 2 0 346.877 4.500 20 0 EIADRP Cc1cc(C)c([C@H](C)[N@@H+]2CC[C@H](C(F)(F)F)[C@@H](C[NH3+])C2)c(C)c1 ZINC000629561779 1035829830 /nfs/dbraw/zinc/82/98/30/1035829830.db2.gz KKJWUZKTAKQDHN-JYJNAYRXSA-N 2 0 328.422 4.132 20 0 EIADRP C[C@H](N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cnn(C2CCCC2)c1 ZINC000502469654 1036247476 /nfs/dbraw/zinc/24/74/76/1036247476.db2.gz CWWZEARNNUJVNN-OKZBNKHCSA-N 2 0 344.547 4.302 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000669614721 1036254372 /nfs/dbraw/zinc/25/43/72/1036254372.db2.gz JIOUIVXMJVFUMP-UWWQBHOKSA-N 2 0 340.433 4.273 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000669614718 1036255448 /nfs/dbraw/zinc/25/54/48/1036255448.db2.gz JIOUIVXMJVFUMP-HFTRVMKXSA-N 2 0 340.433 4.273 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000669614720 1036255526 /nfs/dbraw/zinc/25/55/26/1036255526.db2.gz JIOUIVXMJVFUMP-QGPMSJSTSA-N 2 0 340.433 4.273 20 0 EIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000421373066 1036321219 /nfs/dbraw/zinc/32/12/19/1036321219.db2.gz MGIZYLUYOURTPO-NNGSBXSVSA-N 2 0 342.449 4.489 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000421379269 1036334141 /nfs/dbraw/zinc/33/41/41/1036334141.db2.gz UGGKNICGYOMXGK-QRNKSROTSA-N 2 0 331.529 4.251 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1cnn(C2CCCC2)c1 ZINC000502685103 1036504914 /nfs/dbraw/zinc/50/49/14/1036504914.db2.gz IIIFCAMYJPBXRX-GOSISDBHSA-N 2 0 332.536 4.161 20 0 EIADRP COCC[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000502697631 1036515176 /nfs/dbraw/zinc/51/51/76/1036515176.db2.gz PHMFSEYJZSACGQ-YADHBBJMSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502729032 1036592821 /nfs/dbraw/zinc/59/28/21/1036592821.db2.gz VICITSWNRADEPX-MSOLQXFVSA-N 2 0 332.536 4.161 20 0 EIADRP CSC1(C[NH2+][C@@H](c2cccs2)C2CCCC2)CC[NH+](C)CC1 ZINC000589349653 1036758828 /nfs/dbraw/zinc/75/88/28/1036758828.db2.gz RGOSPMUKDHEGAJ-QGZVFWFLSA-N 2 0 338.586 4.396 20 0 EIADRP COC1([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCC1 ZINC000421829858 1036789016 /nfs/dbraw/zinc/78/90/16/1036789016.db2.gz JALFRUNWCQLYIF-XSLAUPDRSA-N 2 0 342.527 4.119 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000572712712 1036811533 /nfs/dbraw/zinc/81/15/33/1036811533.db2.gz YJJHZLRJULOQAC-FDQGKXFDSA-N 2 0 343.902 4.489 20 0 EIADRP Fc1ccc2c(c1)CC[C@@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)C2 ZINC001168414389 1036827240 /nfs/dbraw/zinc/82/72/40/1036827240.db2.gz FRDSHCUIEMEDSJ-HXUWFJFHSA-N 2 0 330.491 4.070 20 0 EIADRP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]C2CCC([NH+](C)C)CC2)c1 ZINC000421879076 1036829091 /nfs/dbraw/zinc/82/90/91/1036829091.db2.gz OKTWBNUJFHZCIE-WLYUNCDWSA-N 2 0 326.431 4.120 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Br)cs1 ZINC000421883485 1036833066 /nfs/dbraw/zinc/83/30/66/1036833066.db2.gz SVJNDOKPQNNHMR-QFWMXSHPSA-N 2 0 331.323 4.034 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccccc1OC(F)(F)F ZINC000421890184 1036834882 /nfs/dbraw/zinc/83/48/82/1036834882.db2.gz XWVCDVMLXRMBFU-HSBZDZAISA-N 2 0 330.394 4.109 20 0 EIADRP CC1CC[NH+](Cc2ccccc2C[NH2+]Cc2[nH]nc3ccccc32)CC1 ZINC000589641825 1036857555 /nfs/dbraw/zinc/85/75/55/1036857555.db2.gz PYYDYDODECWRAT-UHFFFAOYSA-N 2 0 348.494 4.085 20 0 EIADRP CCOc1cccc2cc([C@H](C)[NH2+]C3CCC([NH+](C)C)CC3)oc21 ZINC000513762629 1036867061 /nfs/dbraw/zinc/86/70/61/1036867061.db2.gz RPNYHEAHWAHAEK-OOHWJJMZSA-N 2 0 330.472 4.355 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cc(F)cc(F)c2)CC1 ZINC000513761780 1036882416 /nfs/dbraw/zinc/88/24/16/1036882416.db2.gz OLIOQHCIFAZRBF-UHFFFAOYSA-N 2 0 344.449 4.498 20 0 EIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]C[C@@H]2CCSC2)cc1 ZINC000486933947 1036896692 /nfs/dbraw/zinc/89/66/92/1036896692.db2.gz XPKSAGJLBHZSJT-SFHVURJKSA-N 2 0 340.536 4.258 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]C/C=C\c1ccncc1 ZINC000486944397 1036899306 /nfs/dbraw/zinc/89/93/06/1036899306.db2.gz PMNQBJUKCOWGFW-QJSCKGPTSA-N 2 0 335.495 4.259 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+]C/C=C\c2ccncc2)cc1 ZINC000486965478 1036905876 /nfs/dbraw/zinc/90/58/76/1036905876.db2.gz JGTXQNGCAIFUJG-UTSMFGRCSA-N 2 0 335.495 4.259 20 0 EIADRP CC[N@H+](CCO[C@@H]1CCCC[C@@H]1C)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999650 1036918659 /nfs/dbraw/zinc/91/86/59/1036918659.db2.gz QIMFCIVCMWQDNE-GHTZIAJQSA-N 2 0 332.532 4.165 20 0 EIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2cccc3[nH]ccc32)CC1 ZINC000503121266 1036919503 /nfs/dbraw/zinc/91/95/03/1036919503.db2.gz NTWFWTFDXFEFGK-JTSKRJEESA-N 2 0 339.527 4.343 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+]C/C=C/c2ccncc2)C1 ZINC000486980342 1036932368 /nfs/dbraw/zinc/93/23/68/1036932368.db2.gz MLNZGQKTTZRNBH-BGEOSOQGSA-N 2 0 349.522 4.363 20 0 EIADRP CCOc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc1F ZINC000486990940 1036938902 /nfs/dbraw/zinc/93/89/02/1036938902.db2.gz RTOZFFWFVOKINJ-UHFFFAOYSA-N 2 0 342.458 4.110 20 0 EIADRP C[N@H+](CCc1ccc(C(F)(F)F)cc1)C1CC[NH+](CC2CC2)CC1 ZINC001168397977 1036975059 /nfs/dbraw/zinc/97/50/59/1036975059.db2.gz RFTQFFJMTPWMOR-UHFFFAOYSA-N 2 0 340.433 4.054 20 0 EIADRP Fc1ccc2c(c1)CC[C@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)C2 ZINC001168399146 1036991872 /nfs/dbraw/zinc/99/18/72/1036991872.db2.gz XRSQMEDPFXQFBS-QFIPXVFZSA-N 2 0 338.470 4.069 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2cccc(OC(F)(F)F)c2)C1 ZINC000590301380 1037038359 /nfs/dbraw/zinc/03/83/59/1037038359.db2.gz CLJYQADKTALOFP-OAHLLOKOSA-N 2 0 344.421 4.187 20 0 EIADRP C[C@@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)[C@H]1CC1(C)C ZINC000487278193 1037092702 /nfs/dbraw/zinc/09/27/02/1037092702.db2.gz MJUYYNSVZYILNB-WIYYLYMNSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@H](Cn1ccnc1)[NH2+]Cc1cn(Cc2ccccc2)c2ccccc12 ZINC000590612063 1037117229 /nfs/dbraw/zinc/11/72/29/1037117229.db2.gz WYJCRWHVABEDJS-GOSISDBHSA-N 2 0 344.462 4.064 20 0 EIADRP CCC1(C[NH2+]C/C=C/c2ccncc2)CC[NH+](Cc2ccccc2)CC1 ZINC000487553524 1037136863 /nfs/dbraw/zinc/13/68/63/1037136863.db2.gz CUBTUYWSIDWMPA-RMKNXTFCSA-N 2 0 349.522 4.377 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000590786794 1037167606 /nfs/dbraw/zinc/16/76/06/1037167606.db2.gz MVVYREKJTTYVIO-UHFFFAOYSA-N 2 0 328.422 4.258 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000590819075 1037182852 /nfs/dbraw/zinc/18/28/52/1037182852.db2.gz ZXFSWIAJEPUNIM-UHFFFAOYSA-N 2 0 344.421 4.137 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CNC(=[NH2+])Nc2ccccc2)cc1 ZINC000057887899 1037290127 /nfs/dbraw/zinc/29/01/27/1037290127.db2.gz BROGNUAVQBKVEE-KRWDZBQOSA-N 2 0 336.483 4.197 20 0 EIADRP CSC1(C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)CC[NH+](C)CC1 ZINC000573256009 1037456721 /nfs/dbraw/zinc/45/67/21/1037456721.db2.gz VKUILWVSQSRRKZ-GFCCVEGCSA-N 2 0 347.355 4.471 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1nc(C(C)C)n2ccccc12 ZINC000573614594 1037602291 /nfs/dbraw/zinc/60/22/91/1037602291.db2.gz BESVVIYZBXWQNQ-QGZVFWFLSA-N 2 0 330.520 4.058 20 0 EIADRP C/C(=C\c1ccccc1)C[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000488513591 1037640174 /nfs/dbraw/zinc/64/01/74/1037640174.db2.gz KKDXFIHDCPGGLV-KNTRCKAVSA-N 2 0 338.495 4.210 20 0 EIADRP CC[NH2+]CC1CC[NH+](C[C@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000414658879 1037696049 /nfs/dbraw/zinc/69/60/49/1037696049.db2.gz KHTBNZVPNRSGBM-AWEZNQCLSA-N 2 0 328.422 4.130 20 0 EIADRP CCCOCc1ccccc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000422697053 1037798755 /nfs/dbraw/zinc/79/87/55/1037798755.db2.gz TYSBQOTWRQOUJX-QHAWAJNXSA-N 2 0 330.516 4.014 20 0 EIADRP c1ccc2cc(C[NH2+][C@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)ccc2c1 ZINC000422700360 1037802527 /nfs/dbraw/zinc/80/25/27/1037802527.db2.gz GRGCRDWYRJSXEZ-GMAHTHKFSA-N 2 0 344.458 4.185 20 0 EIADRP C[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000422715168 1037810079 /nfs/dbraw/zinc/81/00/79/1037810079.db2.gz RQVKDPAKMBOTOH-UZLBHIALSA-N 2 0 342.458 4.197 20 0 EIADRP Fc1ccccc1C[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000592464531 1037817720 /nfs/dbraw/zinc/81/77/20/1037817720.db2.gz YEZPNSFKIJYYBZ-UHFFFAOYSA-N 2 0 346.877 4.481 20 0 EIADRP CCc1ccc([C@@H]([NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)C(C)C)cc1 ZINC000422759575 1037819984 /nfs/dbraw/zinc/81/99/84/1037819984.db2.gz FPXNKDCIYIGWQN-KKSFZXQISA-N 2 0 325.500 4.459 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422740402 1037822546 /nfs/dbraw/zinc/82/25/46/1037822546.db2.gz MQOOXSPSUHHHSO-RGBAJIRYSA-N 2 0 345.487 4.191 20 0 EIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)NC1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000422740251 1037822804 /nfs/dbraw/zinc/82/28/04/1037822804.db2.gz BJZHZMNFODVQQN-DXIQSLLYSA-N 2 0 343.559 4.112 20 0 EIADRP CC[C@@H]1C[C@H](C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CCO1 ZINC000503572727 1037823617 /nfs/dbraw/zinc/82/36/17/1037823617.db2.gz HHKMJPMHYLVUCB-PSWRPDDJSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(Cl)c1 ZINC000422748882 1037825961 /nfs/dbraw/zinc/82/59/61/1037825961.db2.gz WPUQIYRVBOMEOS-ADLFWFRXSA-N 2 0 342.870 4.247 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000422769106 1037829064 /nfs/dbraw/zinc/82/90/64/1037829064.db2.gz STIMPJWXUJYTFZ-BFUOFWGJSA-N 2 0 329.875 4.304 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000422774241 1037830334 /nfs/dbraw/zinc/83/03/34/1037830334.db2.gz WFGGEMQKJCLCFW-KSSFIOAISA-N 2 0 334.410 4.094 20 0 EIADRP COC[C@H](CCC[NH3+])[NH2+][C@H](C)c1ccccc1-c1ccc(Cl)cc1 ZINC000422774490 1037831329 /nfs/dbraw/zinc/83/13/29/1037831329.db2.gz XEYRERVEHMWDAG-QAPCUYQASA-N 2 0 346.902 4.412 20 0 EIADRP CCC[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1 ZINC000422765897 1037834523 /nfs/dbraw/zinc/83/45/23/1037834523.db2.gz PRRYTCUECHCNKI-ONTIZHBOSA-N 2 0 336.479 4.373 20 0 EIADRP COc1ccc([C@@H]([NH2+][C@H](C)CCC[NH3+])c2ccccc2Cl)c(C)c1 ZINC000422797008 1037835076 /nfs/dbraw/zinc/83/50/76/1037835076.db2.gz KWNOHSFJYVDNBS-FOIQADDNSA-N 2 0 346.902 4.463 20 0 EIADRP CC1CC[NH+](Cc2ccc(CN[C@H]3C[C@H]([NH3+])c4ccccc43)cc2)CC1 ZINC000422800322 1037835712 /nfs/dbraw/zinc/83/57/12/1037835712.db2.gz BGIKWOZIMUEWGY-GOTSBHOMSA-N 2 0 349.522 4.153 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1ccc(C(F)(F)F)cc1 ZINC000422800116 1037836776 /nfs/dbraw/zinc/83/67/76/1037836776.db2.gz AUMPSWPXEUKPHC-VXGBXAGGSA-N 2 0 337.389 4.279 20 0 EIADRP c1csc([C@H]([NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C2CC2)c1 ZINC000422796662 1037836955 /nfs/dbraw/zinc/83/69/55/1037836955.db2.gz KCJYFCAMMFELOX-NSISKUIASA-N 2 0 340.492 4.045 20 0 EIADRP C[C@H](CC[NH2+][C@H]1CC[NH2+]CC[C@H]1C)c1cccc(C(F)(F)F)c1 ZINC000422806063 1037838360 /nfs/dbraw/zinc/83/83/60/1037838360.db2.gz HRUKHBJAHFHFCI-CPUCHLNUSA-N 2 0 328.422 4.177 20 0 EIADRP [NH3+][C@@H]1C[C@@H](NCc2ccc(C[NH+]3CCCCCC3)cc2)c2ccccc21 ZINC000422792884 1037840593 /nfs/dbraw/zinc/84/05/93/1037840593.db2.gz ZYSCPOHCGXBQJG-DHIUTWEWSA-N 2 0 349.522 4.297 20 0 EIADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1COCc1ccccc1 ZINC000422862318 1037849309 /nfs/dbraw/zinc/84/93/09/1037849309.db2.gz NMSLPLTUKOUUBW-UGKGYDQZSA-N 2 0 338.495 4.011 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H](c2cccc(F)c2)c2cccc(Cl)c2)CC1 ZINC000422879176 1037852865 /nfs/dbraw/zinc/85/28/65/1037852865.db2.gz UWSHIMZEXNLTFZ-ACBHZAAOSA-N 2 0 332.850 4.428 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1cccc(OC(C)C)c1 ZINC000422886717 1037853867 /nfs/dbraw/zinc/85/38/67/1037853867.db2.gz XFOGUDIKXRNXHB-HUUCEWRRSA-N 2 0 327.472 4.048 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+][C@H](C)C1C[NH2+]C1 ZINC000422884740 1037854626 /nfs/dbraw/zinc/85/46/26/1037854626.db2.gz FOYIQBCSQMNLAV-GHMZBOCLSA-N 2 0 335.904 4.030 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1ccc(OC(C)C)cc1 ZINC000422888635 1037856662 /nfs/dbraw/zinc/85/66/62/1037856662.db2.gz DIJYGPWKMWAEBA-GJZGRUSLSA-N 2 0 327.472 4.048 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](c1ccc(F)cc1F)C(C)C ZINC000422872393 1037858557 /nfs/dbraw/zinc/85/85/57/1037858557.db2.gz GYVYJMJYYRHFNN-DJJJIMSYSA-N 2 0 333.426 4.175 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CN[C@@H]2C[C@H]([NH3+])c3ccccc32)C1 ZINC000422874196 1037858791 /nfs/dbraw/zinc/85/87/91/1037858791.db2.gz CGFMFZGQGORYSN-MQNAVGNWSA-N 2 0 349.522 4.153 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1F ZINC000422873734 1037861467 /nfs/dbraw/zinc/86/14/67/1037861467.db2.gz LYCFIIBPQGFCAV-ZRCAFCQKSA-N 2 0 340.442 4.041 20 0 EIADRP CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422873363 1037861727 /nfs/dbraw/zinc/86/17/27/1037861727.db2.gz LDRJDSACROUMPI-CVEARBPZSA-N 2 0 341.499 4.185 20 0 EIADRP CO[C@H](c1ccc(Cl)cc1)[C@H](C)[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422911804 1037866061 /nfs/dbraw/zinc/86/60/61/1037866061.db2.gz LOPNYHHTODRSAB-RCUQFMMVSA-N 2 0 330.859 4.150 20 0 EIADRP CC1CC[NH+](Cc2ccccc2CN[C@@H]2C[C@H]([NH3+])c3ccccc32)CC1 ZINC000422967258 1037883391 /nfs/dbraw/zinc/88/33/91/1037883391.db2.gz OTCKRCNGMFAORR-XZOQPEGZSA-N 2 0 349.522 4.153 20 0 EIADRP COc1ccc([C@H]([NH2+]C2CCC(C[NH3+])CC2)c2ccc(F)cc2)cc1 ZINC000422945728 1037884923 /nfs/dbraw/zinc/88/49/23/1037884923.db2.gz NWEGBEMFWWAJEI-FFYTWODTSA-N 2 0 342.458 4.031 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C1CCC(C)(c2ccccc2)CC1 ZINC000422986370 1037894433 /nfs/dbraw/zinc/89/44/33/1037894433.db2.gz CHNGZOJCUXJXRY-IDMYKUQPSA-N 2 0 337.511 4.400 20 0 EIADRP CC[C@@H](CSc1ccccc1)[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000423007457 1037899399 /nfs/dbraw/zinc/89/93/99/1037899399.db2.gz XSKZFQIKNBYPPR-ZBFHGGJFSA-N 2 0 329.513 4.070 20 0 EIADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]CCc1csc(-c2ccc(Cl)cc2)n1 ZINC000423012772 1037903294 /nfs/dbraw/zinc/90/32/94/1037903294.db2.gz LJDMIZUHWJYEFN-RHSMWYFYSA-N 2 0 349.931 4.113 20 0 EIADRP Cc1cc([C@@H]([NH2+][C@@H](C)c2ccc(C[NH3+])nc2C)C2CC2)ccc1F ZINC000423015958 1037903432 /nfs/dbraw/zinc/90/34/32/1037903432.db2.gz RXHUBUWRLAXTHD-XOBRGWDASA-N 2 0 327.447 4.098 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1nc(-c2cc3ccccc3o2)cs1 ZINC000423048765 1037911882 /nfs/dbraw/zinc/91/18/82/1037911882.db2.gz IRYFCPPBMGIDHV-CYBMUJFWSA-N 2 0 329.469 4.163 20 0 EIADRP Fc1ccc(C2(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)CC2)c(Cl)c1 ZINC000423030291 1037913030 /nfs/dbraw/zinc/91/30/30/1037913030.db2.gz WACDWJGHESASGW-FHLIZLRMSA-N 2 0 336.882 4.021 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](Cc1ccc(Cl)cc1)c1ccccn1 ZINC000423027916 1037913156 /nfs/dbraw/zinc/91/31/56/1037913156.db2.gz RWASDEKHCUODHC-BEFAXECRSA-N 2 0 331.891 4.126 20 0 EIADRP c1ccc(N2CCCCC2)c(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000423040659 1037922058 /nfs/dbraw/zinc/92/20/58/1037922058.db2.gz HTJHYFARKXGJJQ-PCCBWWKXSA-N 2 0 341.543 4.077 20 0 EIADRP CC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cc(F)cc(Br)c1 ZINC000423059825 1037927805 /nfs/dbraw/zinc/92/78/05/1037927805.db2.gz GUHMCVQZXKDHRQ-XHDPSFHLSA-N 2 0 331.273 4.146 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1cc2ccccc2s1 ZINC000423053863 1037940495 /nfs/dbraw/zinc/94/04/95/1037940495.db2.gz BDXMTFATCAZZOL-OCCSQVGLSA-N 2 0 325.481 4.475 20 0 EIADRP FC1(c2cccc(Cl)c2)CC([NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)C1 ZINC000423095831 1037953191 /nfs/dbraw/zinc/95/31/91/1037953191.db2.gz NEAFSVDJRHBSFR-FRPQEJHRSA-N 2 0 336.882 4.178 20 0 EIADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000423098581 1037957296 /nfs/dbraw/zinc/95/72/96/1037957296.db2.gz SIXHXYLSYSZIGR-HGWQEYRNSA-N 2 0 326.459 4.010 20 0 EIADRP CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1[NH2+][C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000423101826 1037962583 /nfs/dbraw/zinc/96/25/83/1037962583.db2.gz DFRGJPBIGBFZBZ-WIXLDOGYSA-N 2 0 336.479 4.072 20 0 EIADRP Cc1ccccc1[C@H]1C[C@H]([NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423106920 1037982876 /nfs/dbraw/zinc/98/28/76/1037982876.db2.gz RSEYBTJBHDUMIO-CFFRYYMNSA-N 2 0 348.490 4.087 20 0 EIADRP C[C@H]([NH2+][C@@H](c1cccc(C(F)(F)F)c1)C1CCC1)[C@H]1CC[NH2+]C1 ZINC000423112411 1037990624 /nfs/dbraw/zinc/99/06/24/1037990624.db2.gz XNDUENAGSNDHIM-YLQAJVPDSA-N 2 0 326.406 4.134 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](c1ccc(F)c(Cl)c1)C1CC1 ZINC000423152419 1038001209 /nfs/dbraw/zinc/00/12/09/1038001209.db2.gz DZJKQPQIASUSLD-BUXKBTBVSA-N 2 0 347.865 4.443 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423132905 1038008511 /nfs/dbraw/zinc/00/85/11/1038008511.db2.gz PSHKXABLJGFXBU-GIWBLDEGSA-N 2 0 348.490 4.218 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423210416 1038038213 /nfs/dbraw/zinc/03/82/13/1038038213.db2.gz GFIKUABPNOZISN-BRWVUGGUSA-N 2 0 327.516 4.202 20 0 EIADRP Clc1ccccc1C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1cccs1 ZINC000423206064 1038038583 /nfs/dbraw/zinc/03/85/83/1038038583.db2.gz FRVBLFLVIUIHPP-YOEHRIQHSA-N 2 0 334.916 4.275 20 0 EIADRP C[C@@H]([NH2+]Cc1oc2ccc(Cl)cc2c1-c1ccccc1)C1C[NH2+]C1 ZINC000423195073 1038050041 /nfs/dbraw/zinc/05/00/41/1038050041.db2.gz XLSLYIXNOSKTER-CYBMUJFWSA-N 2 0 340.854 4.451 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000423215631 1038058650 /nfs/dbraw/zinc/05/86/50/1038058650.db2.gz NGSVGBNIBQURLS-BCVKRFQSSA-N 2 0 331.287 4.009 20 0 EIADRP CSC[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1 ZINC000423218962 1038060964 /nfs/dbraw/zinc/06/09/64/1038060964.db2.gz SQQSSTMXXXVKOX-NOLJZWGESA-N 2 0 346.462 4.087 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(SCC(F)(F)F)cc1)[C@@H]1CCC[NH2+]C1 ZINC000423216233 1038062101 /nfs/dbraw/zinc/06/21/01/1038062101.db2.gz OENIEOHDTGCXSM-GZBFAFLISA-N 2 0 346.462 4.380 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc(OC(F)(F)F)cc1 ZINC000423217805 1038063983 /nfs/dbraw/zinc/06/39/83/1038063983.db2.gz QMHYFKGHOJJRQT-BJJXKVORSA-N 2 0 330.394 4.014 20 0 EIADRP CC[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(Br)cc1Cl ZINC000423223773 1038069769 /nfs/dbraw/zinc/06/97/69/1038069769.db2.gz ANCJIWBIIJVPQW-KOHJWAIASA-N 2 0 345.712 4.413 20 0 EIADRP Cc1cccc(C)c1OCCC[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000606447864 1038069789 /nfs/dbraw/zinc/06/97/89/1038069789.db2.gz IOHLNUHWUFGOFQ-FQEVSTJZSA-N 2 0 330.516 4.023 20 0 EIADRP CC[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(Br)cc1Cl ZINC000423223778 1038071034 /nfs/dbraw/zinc/07/10/34/1038071034.db2.gz ANCJIWBIIJVPQW-QOZQQMKHSA-N 2 0 345.712 4.413 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H]2CCCCc3cc(Br)ccc32)CC1 ZINC000423242087 1038076342 /nfs/dbraw/zinc/07/63/42/1038076342.db2.gz YIVZXPWUIBGCAZ-VMBOVVBDSA-N 2 0 337.305 4.076 20 0 EIADRP C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423244932 1038076599 /nfs/dbraw/zinc/07/65/99/1038076599.db2.gz HYSSCFKCIHTVPR-SJORKVTESA-N 2 0 342.458 4.055 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423254148 1038084099 /nfs/dbraw/zinc/08/40/99/1038084099.db2.gz XHHXQJVTGGWNGZ-GDBMZVCRSA-N 2 0 329.513 4.077 20 0 EIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423256476 1038084275 /nfs/dbraw/zinc/08/42/75/1038084275.db2.gz FGIMGAWRSIZOSB-DOTOQJQBSA-N 2 0 341.524 4.167 20 0 EIADRP [NH3+]C1(C[NH2+][C@H]2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)CCC1 ZINC000423322351 1038122685 /nfs/dbraw/zinc/12/26/85/1038122685.db2.gz IHMYGHNJFFLNRU-HOTGVXAUSA-N 2 0 326.406 4.203 20 0 EIADRP Cc1ccc(C)c(OCCC[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000606540423 1038126812 /nfs/dbraw/zinc/12/68/12/1038126812.db2.gz NHVPYCPJCNUKGF-HXUWFJFHSA-N 2 0 330.516 4.023 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]C[C@]2(C)CCC[NH2+]C2)cc1 ZINC000423336456 1038146419 /nfs/dbraw/zinc/14/64/19/1038146419.db2.gz STVRZSRQUZCXEM-HTAPYJJXSA-N 2 0 338.495 4.403 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@H]1CC[NH2+][C@@H](C)C1 ZINC000423368244 1038186876 /nfs/dbraw/zinc/18/68/76/1038186876.db2.gz DYOHCUVTYQIWKP-ZQIUZPCESA-N 2 0 329.513 4.218 20 0 EIADRP CC[C@@H]([NH2+]CC1(COC)CC[NH2+]CC1)c1ccc(Cl)cc1Cl ZINC000423378546 1038189593 /nfs/dbraw/zinc/18/95/93/1038189593.db2.gz CFTXDWGGQDJZLB-MRXNPFEDSA-N 2 0 345.314 4.050 20 0 EIADRP Clc1ccccc1C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)C1CC1 ZINC000423388876 1038198346 /nfs/dbraw/zinc/19/83/46/1038198346.db2.gz NRTUJLJDZSSBSW-FQEVSTJZSA-N 2 0 326.871 4.054 20 0 EIADRP Clc1cc2c(c(Cl)c1)[C@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CC2 ZINC000423401184 1038205744 /nfs/dbraw/zinc/20/57/44/1038205744.db2.gz VVUQAKPMHSSLPL-QGZVFWFLSA-N 2 0 333.262 4.374 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423399821 1038207086 /nfs/dbraw/zinc/20/70/86/1038207086.db2.gz VEEPFFAEUCOAAA-KNXALSJPSA-N 2 0 332.900 4.287 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CCCS2 ZINC000423406076 1038216851 /nfs/dbraw/zinc/21/68/51/1038216851.db2.gz YJWZBSFAGRTPFX-IBGZPJMESA-N 2 0 340.492 4.015 20 0 EIADRP Clc1cc2c(c(Cl)c1)CC[C@H]2[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423407279 1038219142 /nfs/dbraw/zinc/21/91/42/1038219142.db2.gz ZPRZZTYPCLXGCV-GOSISDBHSA-N 2 0 333.262 4.374 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]C[C@H]1CC[C@H](C[NH3+])CC1 ZINC000423417239 1038222606 /nfs/dbraw/zinc/22/26/06/1038222606.db2.gz FFEQNABUUIITAP-QKPAOTATSA-N 2 0 331.529 4.143 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@@H](C)CCCC[NH3+] ZINC000423432578 1038232759 /nfs/dbraw/zinc/23/27/59/1038232759.db2.gz MLZIULCKWYWRIX-GJZGRUSLSA-N 2 0 331.529 4.210 20 0 EIADRP CSC[C@@H]([NH2+][C@H](C)CCCC[NH3+])c1ccc(C(F)(F)F)cc1 ZINC000423439061 1038239486 /nfs/dbraw/zinc/23/94/86/1038239486.db2.gz SDWSWXLTGWBAQJ-IUODEOHRSA-N 2 0 334.451 4.217 20 0 EIADRP COc1ccc([C@H](Cc2ccccc2)[NH2+]C[C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC000423464705 1038242456 /nfs/dbraw/zinc/24/24/56/1038242456.db2.gz GYLSNCRNVYGWAP-VCOUNFBDSA-N 2 0 338.495 4.086 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1ccccc1Br ZINC000423470703 1038247255 /nfs/dbraw/zinc/24/72/55/1038247255.db2.gz LTEQLBALCNCOBD-WWGRRREGSA-N 2 0 325.294 4.007 20 0 EIADRP CSC[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1 ZINC000423479222 1038251006 /nfs/dbraw/zinc/25/10/06/1038251006.db2.gz USAMWMDXUYILCJ-WQVCFCJDSA-N 2 0 346.462 4.217 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+][C@H]1CCSc2ccc(F)cc21)c1ccccc1 ZINC000423499227 1038255788 /nfs/dbraw/zinc/25/57/88/1038255788.db2.gz IZZHRZVFEBWWQT-MSOLQXFVSA-N 2 0 330.472 4.432 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423486815 1038260018 /nfs/dbraw/zinc/26/00/18/1038260018.db2.gz SUXWRPAHIRKYRB-IRXDYDNUSA-N 2 0 327.516 4.346 20 0 EIADRP CC[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cccc(Br)c1 ZINC000423488766 1038261669 /nfs/dbraw/zinc/26/16/69/1038261669.db2.gz VRIQQEVUVFQXJS-HOTGVXAUSA-N 2 0 325.294 4.022 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423495233 1038263906 /nfs/dbraw/zinc/26/39/06/1038263906.db2.gz UDXAKRRLLCATNQ-KNBMTAEXSA-N 2 0 342.458 4.183 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H]1CC[C@H](C[NH3+])C1 ZINC000423491974 1038264953 /nfs/dbraw/zinc/26/49/53/1038264953.db2.gz LAUNYBNRFZGMPV-FPMFFAJLSA-N 2 0 333.476 4.036 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423511979 1038266971 /nfs/dbraw/zinc/26/69/71/1038266971.db2.gz UFQIKIJLTMIGEE-HTAPYJJXSA-N 2 0 348.494 4.312 20 0 EIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1N(C)C ZINC000423513985 1038270053 /nfs/dbraw/zinc/27/00/53/1038270053.db2.gz WCAYHBXRBMDFFY-KXBFYZLASA-N 2 0 329.463 4.023 20 0 EIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000423512178 1038270528 /nfs/dbraw/zinc/27/05/28/1038270528.db2.gz UPGRADMULNRKGR-DYESRHJHSA-N 2 0 334.467 4.003 20 0 EIADRP COc1ccc(Cl)cc1[C@H](C)[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000423513998 1038270595 /nfs/dbraw/zinc/27/05/95/1038270595.db2.gz WCUSJERTUIECRU-KBXCAEBGSA-N 2 0 332.875 4.479 20 0 EIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ncc(-c2ccccc2)n1C ZINC000423518977 1038275105 /nfs/dbraw/zinc/27/51/05/1038275105.db2.gz PNRYVSBWCDFMQB-FXAWDEMLSA-N 2 0 348.494 4.218 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]C1CCC(OC2CCCC2)CC1)c1ccccc1 ZINC000423526460 1038278050 /nfs/dbraw/zinc/27/80/50/1038278050.db2.gz ZJPZXUXUGBJTEB-MNLRITNHSA-N 2 0 330.516 4.327 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000423523107 1038278614 /nfs/dbraw/zinc/27/86/14/1038278614.db2.gz VMTPESQOIQEGPW-RTWAWAEBSA-N 2 0 338.495 4.487 20 0 EIADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccccc1OCc1ccccc1 ZINC000423559817 1038281684 /nfs/dbraw/zinc/28/16/84/1038281684.db2.gz PGYJOSROHSGCAK-GOSISDBHSA-N 2 0 336.479 4.226 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423562612 1038281805 /nfs/dbraw/zinc/28/18/05/1038281805.db2.gz WRNNWJRCVNMWLF-NOVWEMISSA-N 2 0 340.433 4.004 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423539947 1038285537 /nfs/dbraw/zinc/28/55/37/1038285537.db2.gz JBVGCTAWOYZGGG-YZLZLFLDSA-N 2 0 328.500 4.001 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CC[C@@H]([NH2+]CCC3=CC[NH2+]CC3)C2)cc1 ZINC000423535388 1038286908 /nfs/dbraw/zinc/28/69/08/1038286908.db2.gz CWMPWANFXPQPPL-SJLPKXTDSA-N 2 0 338.417 4.241 20 0 EIADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1cccc(OCc2ccccc2)c1 ZINC000423573654 1038297211 /nfs/dbraw/zinc/29/72/11/1038297211.db2.gz ZIYMTYJHUSFSOY-GOSISDBHSA-N 2 0 336.479 4.226 20 0 EIADRP C[C@@H](c1ccc(Br)cc1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000490159718 1038363462 /nfs/dbraw/zinc/36/34/62/1038363462.db2.gz YSIDTTKBVJRFJP-AWEZNQCLSA-N 2 0 339.321 4.174 20 0 EIADRP CCC1(C[NH2+][C@H](C)c2ccccn2)CC[NH+](Cc2ccccc2)CC1 ZINC000539041296 1038782844 /nfs/dbraw/zinc/78/28/44/1038782844.db2.gz ITDWLCLKBRAGJJ-LJQANCHMSA-N 2 0 337.511 4.425 20 0 EIADRP COc1cccc2c1CC[C@H](CCC[NH2+]C1CCC([NH+](C)C)CC1)C2 ZINC001168311964 1038787792 /nfs/dbraw/zinc/78/77/92/1038787792.db2.gz GNPOPQIRTSAKRF-KKXNLOMOSA-N 2 0 344.543 4.043 20 0 EIADRP Clc1ccc2c(c1)[C@@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)CC2 ZINC000539036494 1038789160 /nfs/dbraw/zinc/78/91/60/1038789160.db2.gz GOGYFVPPUSTWFG-FQEVSTJZSA-N 2 0 341.886 4.229 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cc1Cl ZINC000539052648 1038801081 /nfs/dbraw/zinc/80/10/81/1038801081.db2.gz NXEMFGUBIGTKKJ-HZPDHXFCSA-N 2 0 338.923 4.367 20 0 EIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H](CC2CC2)c2ccccc2)C[C@@H](C)O1 ZINC000539071185 1038821030 /nfs/dbraw/zinc/82/10/30/1038821030.db2.gz FRCBNMYLFVGSSE-OPYAIIAOSA-N 2 0 330.516 4.007 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(F)cc1Cl ZINC000539072150 1038822415 /nfs/dbraw/zinc/82/24/15/1038822415.db2.gz VEDDCVFJGJBYBI-KFWWJZLASA-N 2 0 342.886 4.019 20 0 EIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+][C@H]1C[C@H]1Cc1ccccc1 ZINC000539088420 1038830247 /nfs/dbraw/zinc/83/02/47/1038830247.db2.gz SHKGEYDSSOOHOU-QQUTXWOLSA-N 2 0 334.507 4.118 20 0 EIADRP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000504895218 1038841763 /nfs/dbraw/zinc/84/17/63/1038841763.db2.gz RPSWJSRATSZUBD-DYESRHJHSA-N 2 0 338.495 4.274 20 0 EIADRP Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000504911853 1038847424 /nfs/dbraw/zinc/84/74/24/1038847424.db2.gz MTSGYTIAUAYPQQ-FXAWDEMLSA-N 2 0 338.495 4.274 20 0 EIADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000504911855 1038848141 /nfs/dbraw/zinc/84/81/41/1038848141.db2.gz MTSGYTIAUAYPQQ-XLIONFOSSA-N 2 0 338.495 4.274 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(C)cc2C)[C@H](C)C1 ZINC000480887604 1038853597 /nfs/dbraw/zinc/85/35/97/1038853597.db2.gz FMIFRNMICOYHPG-DYXWJJEUSA-N 2 0 332.532 4.091 20 0 EIADRP CC(C)[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1cccc(C(F)(F)F)c1 ZINC000539162850 1038865636 /nfs/dbraw/zinc/86/56/36/1038865636.db2.gz MLXCARWRSAMKGX-KBXCAEBGSA-N 2 0 340.433 4.476 20 0 EIADRP CC[N@@H+](Cc1cccc2cc[nH]c21)CC1CCN(c2ccccn2)CC1 ZINC000537617398 1038899042 /nfs/dbraw/zinc/89/90/42/1038899042.db2.gz IUPAVVGEMCQHIB-UHFFFAOYSA-N 2 0 348.494 4.301 20 0 EIADRP C[C@H](c1cccc(Br)c1)[N@H+](C)C1CCC([NH+](C)C)CC1 ZINC001168328748 1038946713 /nfs/dbraw/zinc/94/67/13/1038946713.db2.gz CAXJOUQSNDZUNR-NVPAJSRCSA-N 2 0 339.321 4.315 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000555232555 1038999942 /nfs/dbraw/zinc/99/99/42/1038999942.db2.gz HVPRVHXZAGIKNW-NMTNEYKDSA-N 2 0 348.534 4.333 20 0 EIADRP C[NH+]1CCC2(CC1)C[C@H]([NH2+]CCC1=CCCCC1)c1ccccc1O2 ZINC000539370215 1039013520 /nfs/dbraw/zinc/01/35/20/1039013520.db2.gz XRGHEFNQZFNSBO-FQEVSTJZSA-N 2 0 340.511 4.455 20 0 EIADRP COc1cccc([C@H](Cc2cc(C)cc(C)c2)[NH2+]CCn2ccnc2)c1 ZINC000539359776 1039019027 /nfs/dbraw/zinc/01/90/27/1039019027.db2.gz HMGVDYUWKIDSEX-QFIPXVFZSA-N 2 0 349.478 4.082 20 0 EIADRP Fc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H]2CCC[NH2+]CC2)CCC3)cc1 ZINC000643522396 1039036314 /nfs/dbraw/zinc/03/63/14/1039036314.db2.gz MLKXBJDLBMRLCJ-JKSUJKDBSA-N 2 0 345.487 4.058 20 0 EIADRP Cc1ccc(-c2ncc(C[NH2+]Cc3ccc([C@@H](C)[NH3+])cc3)s2)o1 ZINC000414808142 1039036339 /nfs/dbraw/zinc/03/63/39/1039036339.db2.gz KITYFWQBGBODLI-CYBMUJFWSA-N 2 0 327.453 4.021 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1ccccc1OC ZINC000120445652 1039110550 /nfs/dbraw/zinc/11/05/50/1039110550.db2.gz PRMWEUXDLVBEKK-QGZVFWFLSA-N 2 0 326.484 4.388 20 0 EIADRP Cc1cccnc1[C@@H](NC1CC[NH+](C2CCCCC2)CC1)C(C)C ZINC000120458465 1039114976 /nfs/dbraw/zinc/11/49/76/1039114976.db2.gz KAHFGFZKGXCMKB-FQEVSTJZSA-N 2 0 329.532 4.474 20 0 EIADRP C([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@@H]1CCC2(CCCCC2)O1 ZINC000477858130 1039134687 /nfs/dbraw/zinc/13/46/87/1039134687.db2.gz KVVUNBFYQABDLN-FQEVSTJZSA-N 2 0 334.548 4.255 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2ccc3ccccc3c2OC(F)F)C1 ZINC000481296911 1039235949 /nfs/dbraw/zinc/23/59/49/1039235949.db2.gz BDIMYOLMVBQDEG-CABCVRRESA-N 2 0 348.437 4.434 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CCCCc3ccccc32)c1 ZINC000481316565 1039291555 /nfs/dbraw/zinc/29/15/55/1039291555.db2.gz ATIWLVULRFIZRB-JOCHJYFZSA-N 2 0 338.495 4.184 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CC(C)(C)c3ccccc32)c1 ZINC000481326524 1039301004 /nfs/dbraw/zinc/30/10/04/1039301004.db2.gz ZUNDOIVSOWLHHL-NRFANRHFSA-N 2 0 338.495 4.139 20 0 EIADRP CC[C@@H]([NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)c1c(C)noc1C ZINC000090886816 1039319902 /nfs/dbraw/zinc/31/99/02/1039319902.db2.gz WAYLEPBLWRAWKC-IFXJQAMLSA-N 2 0 345.487 4.034 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCc3c2cccc3F)c1 ZINC000513858976 1039338677 /nfs/dbraw/zinc/33/86/77/1039338677.db2.gz GNHWIQMOWWUXGZ-NRFANRHFSA-N 2 0 326.459 4.445 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)[C@H](C)c2nc3ccccc3s2)CC1 ZINC000121732450 1039443709 /nfs/dbraw/zinc/44/37/09/1039443709.db2.gz FFXBBTJKPNOBST-HOTGVXAUSA-N 2 0 345.556 4.500 20 0 EIADRP CCC[C@H](C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2CCOC)c1ccccc1 ZINC000552392094 1039444605 /nfs/dbraw/zinc/44/46/05/1039444605.db2.gz GGYJHKJKEKNJBM-IZCSPVGOSA-N 2 0 344.543 4.144 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cc3ccccc3s2)[C@@H](C)C1 ZINC000550856240 1039653131 /nfs/dbraw/zinc/65/31/31/1039653131.db2.gz ITARHSAFPBFCMO-QFBILLFUSA-N 2 0 346.540 4.128 20 0 EIADRP C[N@H+](CC1CCN(c2cc[nH+]cc2)CC1)C[C@H]1CCCC(F)(F)C1 ZINC000514145209 1039655507 /nfs/dbraw/zinc/65/55/07/1039655507.db2.gz LQLODPYZYOTTRC-KRWDZBQOSA-N 2 0 337.458 4.055 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(-c2ccccc2F)s1 ZINC000643534437 1039716443 /nfs/dbraw/zinc/71/64/43/1039716443.db2.gz VEGUYOKCDDUYBJ-FZKQIMNGSA-N 2 0 330.472 4.347 20 0 EIADRP Fc1ccc([C@H]([NH2+][C@@H]2CC23CC[NH2+]CC3)c2ccccc2Cl)cc1 ZINC000643536267 1039744377 /nfs/dbraw/zinc/74/43/77/1039744377.db2.gz SIHDWNGWBVJCSV-MOPGFXCFSA-N 2 0 344.861 4.300 20 0 EIADRP COc1ccc(F)cc1[C@H](C)[NH2+][C@@H](C)c1cccc(C[NH+](C)C)c1 ZINC000924706956 1039775433 /nfs/dbraw/zinc/77/54/33/1039775433.db2.gz RXHKRAQBIQZVDW-GJZGRUSLSA-N 2 0 330.447 4.308 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000414850112 1039779964 /nfs/dbraw/zinc/77/99/64/1039779964.db2.gz YTEOIKWXDPUECS-ZBFHGGJFSA-N 2 0 328.422 4.006 20 0 EIADRP CCC[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccccc1 ZINC000481724733 1039789203 /nfs/dbraw/zinc/78/92/03/1039789203.db2.gz NPIQQBZZDYKPSX-FQEVSTJZSA-N 2 0 326.484 4.258 20 0 EIADRP Cc1cc([C@H]([NH2+]Cc2cccc(C[NH+](C)C)c2)C2CC2)ccc1F ZINC000552746133 1039793122 /nfs/dbraw/zinc/79/31/22/1039793122.db2.gz KLYQKGWDCOQCED-OAQYLSRUSA-N 2 0 326.459 4.437 20 0 EIADRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2ccc3cc(OC)ccc3c2)C1 ZINC000537647471 1039808151 /nfs/dbraw/zinc/80/81/51/1039808151.db2.gz OGEZZRWBZKTVDE-SFHVURJKSA-N 2 0 326.484 4.012 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccc(OC(F)F)cc1 ZINC000550883272 1039810288 /nfs/dbraw/zinc/81/02/88/1039810288.db2.gz XRTOKGMXSLCSAU-OAHLLOKOSA-N 2 0 326.431 4.205 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC000122963438 1039836487 /nfs/dbraw/zinc/83/64/87/1039836487.db2.gz PHXDUVDOYBBEOO-CQSZACIVSA-N 2 0 326.431 4.203 20 0 EIADRP CC[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+][C@H]1CC12CC[NH2+]CC2 ZINC000666954198 1039861438 /nfs/dbraw/zinc/86/14/38/1039861438.db2.gz RXQGTVLRLYFYAN-HOCLYGCPSA-N 2 0 327.299 4.046 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2CC23CC[NH2+]CC3)cc1 ZINC000666954262 1039861700 /nfs/dbraw/zinc/86/17/00/1039861700.db2.gz SUDJWKZZLCXDIX-GVDBMIGSSA-N 2 0 338.417 4.073 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H](C)c2ccc(CC(C)C)cc2)CC1 ZINC000481909782 1039897207 /nfs/dbraw/zinc/89/72/07/1039897207.db2.gz PFMOXEYTTHUZDY-GOSISDBHSA-N 2 0 332.532 4.037 20 0 EIADRP c1c2ccccc2sc1C[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000537692196 1039906460 /nfs/dbraw/zinc/90/64/60/1039906460.db2.gz GKCMHQRFDBPXSI-QFBILLFUSA-N 2 0 326.509 4.350 20 0 EIADRP C[C@@H](CC[NH+](C)C)[NH2+][C@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000481976519 1039923522 /nfs/dbraw/zinc/92/35/22/1039923522.db2.gz ZKVNESKRTDIRKC-BBRMVZONSA-N 2 0 347.503 4.256 20 0 EIADRP C[C@@H](N[C@@H](C)CC[NH+](C)C)c1ccc2ccccc2c1OC(F)F ZINC000481962676 1039928445 /nfs/dbraw/zinc/92/84/45/1039928445.db2.gz PXLDXRCXIUKOJG-UONOGXRCSA-N 2 0 336.426 4.432 20 0 EIADRP CCO[C@H](C[NH2+][C@H]1CCN(C)[C@@H](c2ccccc2)C1)c1ccccc1 ZINC000551174993 1040020220 /nfs/dbraw/zinc/02/02/20/1040020220.db2.gz DXBBAXBMINPPBH-BHDDXSALSA-N 2 0 338.495 4.189 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CC[C@](C)(c2ccc(C)cc2)C1 ZINC000435034227 1040023188 /nfs/dbraw/zinc/02/31/88/1040023188.db2.gz CDTYTEKXAVOXKE-QFIPXVFZSA-N 2 0 346.478 4.048 20 0 EIADRP CC(C)=CCC[C@H](C)CC[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1 ZINC000482212062 1040079945 /nfs/dbraw/zinc/07/99/45/1040079945.db2.gz PIJOPUDUOKVABO-SESVDKBCSA-N 2 0 336.564 4.117 20 0 EIADRP Clc1cccc(Cl)c1CCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000482242598 1040098497 /nfs/dbraw/zinc/09/84/97/1040098497.db2.gz UEZDIMZSLIVIRF-KGLIPLIRSA-N 2 0 327.299 4.142 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2cccc(Cl)c2Cl)CC[NH+](C)CC1 ZINC000514696605 1040145927 /nfs/dbraw/zinc/14/59/27/1040145927.db2.gz NBDBYSDKSSDQQF-LBPRGKRZSA-N 2 0 347.355 4.471 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](CN[C@@H](C)c2ccccc2Br)C1 ZINC000482362198 1040199842 /nfs/dbraw/zinc/19/98/42/1040199842.db2.gz VSZBVVZWTSTGKC-GJZGRUSLSA-N 2 0 339.321 4.220 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(OC(F)(F)F)cc2)C1 ZINC000482360662 1040200992 /nfs/dbraw/zinc/20/09/92/1040200992.db2.gz PWNPKNDLFDULPH-LSDHHAIUSA-N 2 0 344.421 4.356 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+]C/C(C)=C/c2cccc(C(F)(F)F)c2)C1 ZINC000514812796 1040255093 /nfs/dbraw/zinc/25/50/93/1040255093.db2.gz UEQQHFQKQQGNJF-IUYQLWOBSA-N 2 0 340.433 4.430 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CC(C)(C)c3ccc(Br)cc32)CC1 ZINC000479402072 1040304718 /nfs/dbraw/zinc/30/47/18/1040304718.db2.gz KEKJVMCBKYCQMS-QGZVFWFLSA-N 2 0 349.316 4.023 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](CCO)CC1)c1ccc(C2CCCCC2)cc1 ZINC000482545031 1040345812 /nfs/dbraw/zinc/34/58/12/1040345812.db2.gz WPUVOLVCQCOOBP-SFHVURJKSA-N 2 0 344.543 4.089 20 0 EIADRP Cc1cc2[nH]c(C[NH2+]CC3CCN(c4cc[nH+]cc4)CC3)cc2c(C)c1 ZINC000479454580 1040362705 /nfs/dbraw/zinc/36/27/05/1040362705.db2.gz LZTBPUCJWYQMLI-UHFFFAOYSA-N 2 0 348.494 4.186 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cc(C)cc(C)c2)[C@@H](C)C1 ZINC000482647709 1040408358 /nfs/dbraw/zinc/40/83/58/1040408358.db2.gz BMAQCEUHBIJGKV-ZVDOUQERSA-N 2 0 332.532 4.091 20 0 EIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H]3CCC[C@@H](C4CC4)C3)cc2)CC1 ZINC000551573449 1040423065 /nfs/dbraw/zinc/42/30/65/1040423065.db2.gz RNQMNTMCBUGNSN-WOJBJXKFSA-N 2 0 342.527 4.218 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH2+]CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000515053379 1040452682 /nfs/dbraw/zinc/45/26/82/1040452682.db2.gz VGZHNNVULHVELB-MRXNPFEDSA-N 2 0 342.458 4.055 20 0 EIADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccccc1OCc1ccccc1 ZINC000539507422 1040486190 /nfs/dbraw/zinc/48/61/90/1040486190.db2.gz NHGFOPPWVAPIHX-GOSISDBHSA-N 2 0 336.479 4.178 20 0 EIADRP Cc1ccc(CC[C@@H](C)[NH2+]Cc2ccccc2Cn2ccnc2)cc1 ZINC000515149797 1040509584 /nfs/dbraw/zinc/50/95/84/1040509584.db2.gz KLPPMLVGLNADJX-LJQANCHMSA-N 2 0 333.479 4.351 20 0 EIADRP CCN(Cc1nc(C)c(-c2ccc(Cl)cc2)o1)[C@@H]1CCC[NH2+]CC1 ZINC000435630135 1040511310 /nfs/dbraw/zinc/51/13/10/1040511310.db2.gz ZSQVKUNXUAKUAX-QGZVFWFLSA-N 2 0 347.890 4.267 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000482894194 1040553150 /nfs/dbraw/zinc/55/31/50/1040553150.db2.gz RVKYCRROCPPJAX-YLJYHZDGSA-N 2 0 338.495 4.008 20 0 EIADRP CCc1nc2c(s1)[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)CCC2 ZINC000482948829 1040589122 /nfs/dbraw/zinc/58/91/22/1040589122.db2.gz SOIDTOXTMIOMNC-INIZCTEOSA-N 2 0 335.561 4.329 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000551794592 1040607097 /nfs/dbraw/zinc/60/70/97/1040607097.db2.gz ZJEXLTYQQGJPLB-VLCRHTCISA-N 2 0 344.543 4.289 20 0 EIADRP c1ccc(CCN2CCC([NH2+]C3(Cc4ccccc4)CCC3)CC2)cc1 ZINC000539656756 1040653624 /nfs/dbraw/zinc/65/36/24/1040653624.db2.gz KCMJFTUOZFOYRH-UHFFFAOYSA-N 2 0 348.534 4.449 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)c1cccs1)c1ccc(OCC[NH+](C)C)cc1 ZINC000483151980 1040738250 /nfs/dbraw/zinc/73/82/50/1040738250.db2.gz QZLJFPUPHFCFKU-INIZCTEOSA-N 2 0 346.540 4.317 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2ccc(CC)cc2)[C@@H](C)C1 ZINC000479876916 1040740322 /nfs/dbraw/zinc/74/03/22/1040740322.db2.gz VJCIZYFQVPBEGG-UEXGIBASSA-N 2 0 332.532 4.037 20 0 EIADRP C[C@@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1cccc(OC(F)F)c1 ZINC000483201213 1040759671 /nfs/dbraw/zinc/75/96/71/1040759671.db2.gz PKQSOPNNXDTTFM-CZUORRHYSA-N 2 0 328.447 4.305 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)ccc1SC ZINC000483204027 1040760883 /nfs/dbraw/zinc/76/08/83/1040760883.db2.gz RXSIJQNSJBXHRJ-KSSFIOAISA-N 2 0 338.561 4.434 20 0 EIADRP COc1cc(C)c([C@@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)cc1OC ZINC000483186472 1040764199 /nfs/dbraw/zinc/76/41/99/1040764199.db2.gz UWQQKGYNCZKONE-BEFAXECRSA-N 2 0 336.520 4.029 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCN([C@@H](C)c2cccc(Br)c2)C1 ZINC000483209515 1040767872 /nfs/dbraw/zinc/76/78/72/1040767872.db2.gz BVGDNQKOEJWQNO-GJZGRUSLSA-N 2 0 339.321 4.174 20 0 EIADRP CCC[N@H+](C)C[C@@H]1CCN(Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000483295836 1040808629 /nfs/dbraw/zinc/80/86/29/1040808629.db2.gz ZZIIQRCVOXXBNU-HNNXBMFYSA-N 2 0 348.437 4.389 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cc(Cl)cc(Cl)c2OC)C[C@@H]1C ZINC000539816807 1040809531 /nfs/dbraw/zinc/80/95/31/1040809531.db2.gz DIRFXEZYNUPJKL-WFASDCNBSA-N 2 0 345.314 4.307 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(C)c(OC(F)F)c(C)c2)C[C@@H]1C ZINC000539838132 1040818811 /nfs/dbraw/zinc/81/88/11/1040818811.db2.gz LAWFABGJPQUATP-DOTOQJQBSA-N 2 0 340.458 4.209 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(F)cc2C(F)(F)F)[C@H](C)C1 ZINC000539834797 1040828538 /nfs/dbraw/zinc/82/85/38/1040828538.db2.gz FZURXILMAVCPNV-MLGOLLRUSA-N 2 0 332.385 4.007 20 0 EIADRP COc1cccc(C[NH+]2CCC(CCC[NH+](C)C)CC2)c1OC(C)C ZINC000539852220 1040849217 /nfs/dbraw/zinc/84/92/17/1040849217.db2.gz RIOGCRYLYMNFGC-UHFFFAOYSA-N 2 0 348.531 4.036 20 0 EIADRP CCC[C@H]([NH2+][C@@H]1CC[N@H+](CCCOCC)C[C@@H]1C)c1ccccc1 ZINC000480034156 1040869569 /nfs/dbraw/zinc/86/95/69/1040869569.db2.gz JJSHPFSSAUJFHH-TYPHKJRUSA-N 2 0 332.532 4.254 20 0 EIADRP CCC[C@H]([NH2+][C@H]1CC[N@H+](CCCOCC)C[C@@H]1C)c1ccccc1 ZINC000480034154 1040871026 /nfs/dbraw/zinc/87/10/26/1040871026.db2.gz JJSHPFSSAUJFHH-JBACZVJFSA-N 2 0 332.532 4.254 20 0 EIADRP CC[NH+]1CCC(CC[NH2+]Cc2cc(Cl)cc(Cl)c2OC)CC1 ZINC000462768901 1040922753 /nfs/dbraw/zinc/92/27/53/1040922753.db2.gz OXYWCKSBEKPOHV-UHFFFAOYSA-N 2 0 345.314 4.214 20 0 EIADRP CCN1CCC[C@H]1C[NH2+][C@H](C)c1ccc(SCC(F)F)cc1 ZINC000480089328 1040926011 /nfs/dbraw/zinc/92/60/11/1040926011.db2.gz HFZBJLNIILNJHZ-HIFRSBDPSA-N 2 0 328.472 4.179 20 0 EIADRP CC[C@H]1CCC[C@H]([NH2+]CC2CC[NH+](Cc3ccc(OC)cc3)CC2)C1 ZINC000462772426 1040927033 /nfs/dbraw/zinc/92/70/33/1040927033.db2.gz JZUWGSGSURZVFM-RXVVDRJESA-N 2 0 344.543 4.466 20 0 EIADRP CC[C@@H]1CCC[C@@H]([NH2+]CC2CC[NH+](Cc3ccc(OC)cc3)CC2)C1 ZINC000462772427 1040928266 /nfs/dbraw/zinc/92/82/66/1040928266.db2.gz JZUWGSGSURZVFM-WIYYLYMNSA-N 2 0 344.543 4.466 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccc(Cl)s1 ZINC000537991009 1040969938 /nfs/dbraw/zinc/96/99/38/1040969938.db2.gz QBXCBWGKXUQIKK-YJBOKZPZSA-N 2 0 348.943 4.444 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H]2CCCc3c(O)cccc32)CC1 ZINC000462803672 1040971956 /nfs/dbraw/zinc/97/19/56/1040971956.db2.gz CBBFOHAIEOMYAZ-FQEVSTJZSA-N 2 0 330.516 4.117 20 0 EIADRP c1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH2+][C@H]4CCCSCC4)C[C@@H]3C2)cc1 ZINC000898519252 1040973109 /nfs/dbraw/zinc/97/31/09/1040973109.db2.gz OBFQDPVLDUINKF-JSXRDJHFSA-N 2 0 344.568 4.162 20 0 EIADRP COc1cccc2c1CC[C@H]2[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000537968845 1040974212 /nfs/dbraw/zinc/97/42/12/1040974212.db2.gz ZOBLZEISBXJOGS-OAQYLSRUSA-N 2 0 338.495 4.313 20 0 EIADRP CC1([NH+]2CCCC2)CCC([NH2+][C@H]2CCC[C@H](c3cccnc3)C2)CC1 ZINC000903254161 1040991606 /nfs/dbraw/zinc/99/16/06/1040991606.db2.gz QJNSDBJFIDWOHW-YOLZPYMBSA-N 2 0 341.543 4.495 20 0 EIADRP CSC1(C[NH2+][C@H](c2ccc(Cl)cc2)C(C)C)CC[NH+](C)CC1 ZINC000515716680 1041008103 /nfs/dbraw/zinc/00/81/03/1041008103.db2.gz RJEDJABETOUILW-KRWDZBQOSA-N 2 0 340.964 4.454 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)ccc1F ZINC000436255584 1041011132 /nfs/dbraw/zinc/01/11/32/1041011132.db2.gz YAXLLKDGJQGNLH-AZUAARDMSA-N 2 0 326.459 4.313 20 0 EIADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(SCC(F)F)cc1 ZINC000480160225 1041014426 /nfs/dbraw/zinc/01/44/26/1041014426.db2.gz OAEHRQGQDBIPNG-CQSZACIVSA-N 2 0 328.472 4.180 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccc(Sc2ccc(F)cc2)cc1 ZINC000538097056 1041045892 /nfs/dbraw/zinc/04/58/92/1041045892.db2.gz OHMYDKFSQMEMBG-FOIQADDNSA-N 2 0 344.499 4.407 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)CC(C)(C)c2c[nH]c3ccccc32)C1 ZINC000462889309 1041050337 /nfs/dbraw/zinc/05/03/37/1041050337.db2.gz SJINKFOZHFMYAK-IAGOWNOFSA-N 2 0 327.516 4.156 20 0 EIADRP C[C@@H]([NH2+]CC1(c2ccccc2)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000480192818 1041050883 /nfs/dbraw/zinc/05/08/83/1041050883.db2.gz FYHNIASELBCUOI-GOSISDBHSA-N 2 0 338.495 4.009 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CCC[NH+]1CCCC1 ZINC000462884101 1041069134 /nfs/dbraw/zinc/06/91/34/1041069134.db2.gz YZWOQEJJDWPBRQ-KRWDZBQOSA-N 2 0 327.516 4.300 20 0 EIADRP Fc1cccc([C@H]2C[C@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)c1 ZINC000436307111 1041076819 /nfs/dbraw/zinc/07/68/19/1041076819.db2.gz JWUAOWFSHBAIBL-IRJFHVNHSA-N 2 0 330.491 4.458 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc(Cl)cn1 ZINC000480232908 1041109154 /nfs/dbraw/zinc/10/91/54/1041109154.db2.gz YFOWFDDJVUIRTI-AWEZNQCLSA-N 2 0 349.931 4.359 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CCc2ccc(Oc3ccc(F)cc3)cc2)CC[N@@H+]1C ZINC000540140583 1041160235 /nfs/dbraw/zinc/16/02/35/1041160235.db2.gz PCYQAEVBTZYWLR-VQIMIIECSA-N 2 0 342.458 4.233 20 0 EIADRP CC[C@@H]([NH2+]CC1(CC)CC[NH+](Cc2ccccc2)CC1)[C@@H]1CCOC1 ZINC000540143267 1041165735 /nfs/dbraw/zinc/16/57/35/1041165735.db2.gz OEAZXJIIGDBTEB-NHCUHLMSSA-N 2 0 344.543 4.084 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H](C)c2ccc3c(c2)COC3)CC1 ZINC000484301178 1041202798 /nfs/dbraw/zinc/20/27/98/1041202798.db2.gz UZSFHTPAMOIRBD-QGZVFWFLSA-N 2 0 330.516 4.126 20 0 EIADRP c1ccc(C[C@H]2CC[C@@H]([NH2+]CC3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000436401415 1041206315 /nfs/dbraw/zinc/20/63/15/1041206315.db2.gz PDVVMOACFIUGQX-FGZHOGPDSA-N 2 0 349.522 4.299 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCC1 ZINC000540163762 1041227464 /nfs/dbraw/zinc/22/74/64/1041227464.db2.gz JQNRLHHFLQVDPH-DYVFJYSZSA-N 2 0 341.326 4.345 20 0 EIADRP CC(C)CC[C@@H](C)[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538268483 1041228152 /nfs/dbraw/zinc/22/81/52/1041228152.db2.gz IPWGAYMBBALKIE-MJGOQNOKSA-N 2 0 330.516 4.389 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC(C)(C)c1c(F)cccc1Cl ZINC000540188950 1041231786 /nfs/dbraw/zinc/23/17/86/1041231786.db2.gz MXWPAJHLSJZFEN-IOASZLSFSA-N 2 0 326.887 4.075 20 0 EIADRP C[C@H](NC1(C[NH2+][C@@H]2CCC23CCOCC3)CCCC1)c1ccccc1 ZINC000554559546 1041244119 /nfs/dbraw/zinc/24/41/19/1041244119.db2.gz DFEYIPKKNDJOLT-AZUAARDMSA-N 2 0 342.527 4.199 20 0 EIADRP C[C@H]1C[C@H]([NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)C[C@@H](C)C1 ZINC000538297611 1041247965 /nfs/dbraw/zinc/24/79/65/1041247965.db2.gz WWTGKOCALYLKSG-XFKSJGNHSA-N 2 0 342.527 4.389 20 0 EIADRP COc1cccc2c1CC[C@H]2[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000484486600 1041255676 /nfs/dbraw/zinc/25/56/76/1041255676.db2.gz CATBJLQJFNHLKW-HXUWFJFHSA-N 2 0 328.500 4.069 20 0 EIADRP COCCC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)CCCC1 ZINC000484508610 1041291692 /nfs/dbraw/zinc/29/16/92/1041291692.db2.gz PZOPMQYWSOVDFT-FPOVZHCZSA-N 2 0 344.543 4.084 20 0 EIADRP C[N@H+]1CC=C(C[NH2+]Cc2ccc(-c3cccc(Cl)c3)s2)CC1 ZINC000538445468 1041351955 /nfs/dbraw/zinc/35/19/55/1041351955.db2.gz MZVQMHUEJLAXLE-UHFFFAOYSA-N 2 0 332.900 4.420 20 0 EIADRP c1ccc(C[N@@H+]2CC[C@]3(CC[NH+]([C@@H]4C[C@@H]4c4ccccc4)C3)C2)cc1 ZINC000463195391 1041410548 /nfs/dbraw/zinc/41/05/48/1041410548.db2.gz WXQLQIMQIKDFFF-ZLNRFVROSA-N 2 0 332.491 4.141 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1cc(F)c(F)c(F)c1 ZINC000480608295 1041420838 /nfs/dbraw/zinc/42/08/38/1041420838.db2.gz HASRFIHMWRTNMT-CQSZACIVSA-N 2 0 328.422 4.267 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc2c(c1)COC2 ZINC000480612955 1041423945 /nfs/dbraw/zinc/42/39/45/1041423945.db2.gz RPJSHZXXKGXWNW-KURKYZTESA-N 2 0 330.516 4.126 20 0 EIADRP COc1ccc(OC)c([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)c1 ZINC000480617994 1041427811 /nfs/dbraw/zinc/42/78/11/1041427811.db2.gz VRBMIILHSPLWRZ-IRXDYDNUSA-N 2 0 334.504 4.009 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1cc(F)c(F)c(F)c1 ZINC000480630604 1041434537 /nfs/dbraw/zinc/43/45/37/1041434537.db2.gz KOSYQUUAICONBP-KGLIPLIRSA-N 2 0 328.422 4.409 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(F)cc1N(C)C ZINC000480638495 1041450721 /nfs/dbraw/zinc/45/07/21/1041450721.db2.gz IXZQRFUQUVQIIR-SJORKVTESA-N 2 0 335.511 4.197 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCc2ccc3[nH]ccc3c2)CCN1Cc1ccccc1 ZINC000463262584 1041459610 /nfs/dbraw/zinc/45/96/10/1041459610.db2.gz ZKCOIRDQSKPOTC-GCJKJVERSA-N 2 0 347.506 4.353 20 0 EIADRP CC[N@H+](CCC1CC[NH+](CCC(=O)c2ccccc2)CC1)CC1CC1 ZINC000538628743 1041460977 /nfs/dbraw/zinc/46/09/77/1041460977.db2.gz PMIBTJFONBNRTA-UHFFFAOYSA-N 2 0 342.527 4.093 20 0 EIADRP COCCC[C@@H](C)[NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000480693540 1041476041 /nfs/dbraw/zinc/47/60/41/1041476041.db2.gz CMYZSRXIODLASE-CEXWTWQISA-N 2 0 332.532 4.069 20 0 EIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3cnc(-c4ccsc4)s3)C2)CC1 ZINC000554879289 1041476254 /nfs/dbraw/zinc/47/62/54/1041476254.db2.gz QAXRWIXRIZJOJK-HNNXBMFYSA-N 2 0 347.553 4.035 20 0 EIADRP CCC[C@H](C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)c1ccccc1 ZINC000540480076 1041483846 /nfs/dbraw/zinc/48/38/46/1041483846.db2.gz GBIDSRSSLKMGOI-OAQYLSRUSA-N 2 0 344.543 4.147 20 0 EIADRP COCCC[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000480723743 1041490670 /nfs/dbraw/zinc/49/06/70/1041490670.db2.gz FCPDDIBIHIVNBU-QRVBRYPASA-N 2 0 332.532 4.069 20 0 EIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H]2C[C@@H](c3ccccc3)C2(C)C)C[C@H](C)O1 ZINC000464059663 1041844976 /nfs/dbraw/zinc/84/49/76/1041844976.db2.gz ZCTOVZJSENYSTE-IZZBFERCSA-N 2 0 344.543 4.048 20 0 EIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H]2C[C@H](c3ccccc3)C2(C)C)C[C@H](C)O1 ZINC000464059664 1041845110 /nfs/dbraw/zinc/84/51/10/1041845110.db2.gz ZCTOVZJSENYSTE-KOUHRCEDSA-N 2 0 344.543 4.048 20 0 EIADRP [NH3+]CCCC[NH2+]Cc1ccc(-c2ccccc2Br)s1 ZINC000414912489 1041892360 /nfs/dbraw/zinc/89/23/60/1041892360.db2.gz UWMXDEQSLUSDGP-UHFFFAOYSA-N 2 0 339.302 4.006 20 0 EIADRP C[C@]1(c2ccccc2)CC[C@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000437779845 1041897871 /nfs/dbraw/zinc/89/78/71/1041897871.db2.gz CKZDCUHKZCIBPI-GMAHTHKFSA-N 2 0 349.522 4.398 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]CCCCOc3ccccc3)CC2)CC1 ZINC000437775333 1041906245 /nfs/dbraw/zinc/90/62/45/1041906245.db2.gz OWKLEZQCOHBISM-UHFFFAOYSA-N 2 0 344.543 4.478 20 0 EIADRP C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1cc(-n2ccnc2)cs1 ZINC000541537122 1041999248 /nfs/dbraw/zinc/99/92/48/1041999248.db2.gz JUYVNUGDSYWPNH-LBPRGKRZSA-N 2 0 333.407 4.405 20 0 EIADRP c1ccc(OCCCCC[N@@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc1 ZINC000438132264 1042059876 /nfs/dbraw/zinc/05/98/76/1042059876.db2.gz YJQWRVYEXPEWEX-HXUWFJFHSA-N 2 0 330.516 4.044 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000425951434 1042067397 /nfs/dbraw/zinc/06/73/97/1042067397.db2.gz MQKMNCBRCRUQQP-CABCVRRESA-N 2 0 331.529 4.275 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)CC1 ZINC000438178542 1042072102 /nfs/dbraw/zinc/07/21/02/1042072102.db2.gz OSJDILNUWKQMNW-IRXDYDNUSA-N 2 0 334.470 4.455 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H]3CCCc4cc(N)ccc43)CC2)C1 ZINC000414928334 1042158681 /nfs/dbraw/zinc/15/86/81/1042158681.db2.gz MVGZCRAKIBUJSF-BSLALVQMSA-N 2 0 341.543 4.279 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1ccc(NC(C)=O)cc1 ZINC000541917672 1042178646 /nfs/dbraw/zinc/17/86/46/1042178646.db2.gz DBDWLGMDTQFXOB-LRQRDZAKSA-N 2 0 345.531 4.196 20 0 EIADRP C[C@@H](c1ccccn1)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC000293490065 1042265988 /nfs/dbraw/zinc/26/59/88/1042265988.db2.gz YXFKJUXNCULONF-IBGZPJMESA-N 2 0 335.495 4.131 20 0 EIADRP CCCCOc1cc(CN(C)C2CC[NH+](C(C)C)CC2)ccc1OC ZINC000506340853 1042327290 /nfs/dbraw/zinc/32/72/90/1042327290.db2.gz JAHVETRSYXVXMG-UHFFFAOYSA-N 2 0 348.531 4.179 20 0 EIADRP CC(C)c1ccc(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000303163338 1042336766 /nfs/dbraw/zinc/33/67/66/1042336766.db2.gz HMOFLKCZQMTPBV-QFIPXVFZSA-N 2 0 336.523 4.464 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000438830241 1042372329 /nfs/dbraw/zinc/37/23/29/1042372329.db2.gz NLRUFDRDKXFAOK-FQEVSTJZSA-N 2 0 325.500 4.316 20 0 EIADRP COc1ccc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cc1 ZINC000438840783 1042377877 /nfs/dbraw/zinc/37/78/77/1042377877.db2.gz ZTIYNFMBTCADST-UHFFFAOYSA-N 2 0 338.495 4.228 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C(C)(C)CCc1ccccc1 ZINC000542322660 1042389683 /nfs/dbraw/zinc/38/96/83/1042389683.db2.gz WWBCLHDYFSZBSZ-UHFFFAOYSA-N 2 0 334.467 4.077 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2ccc3c(c2)CCCC3)cc1F ZINC000491358390 1042431858 /nfs/dbraw/zinc/43/18/58/1042431858.db2.gz FMLPNVXAAUMMOL-UHFFFAOYSA-N 2 0 326.459 4.056 20 0 EIADRP COc1ccc2cc(C[NH2+]CCCC[N@@H+]3CCC[C@H](C)C3)ccc2c1 ZINC000518268148 1042442108 /nfs/dbraw/zinc/44/21/08/1042442108.db2.gz YYNYCYQOIQAUGO-SFHVURJKSA-N 2 0 340.511 4.450 20 0 EIADRP CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]CC1CC[NH+](CCC(C)C)CC1 ZINC000491872513 1042510235 /nfs/dbraw/zinc/51/02/35/1042510235.db2.gz POJRRQJKEHLWNZ-WIYYLYMNSA-N 2 0 332.532 4.110 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+][C@@H]2CCCc3ccc(C)cc32)[C@@H](C)C1 ZINC000426289008 1042514412 /nfs/dbraw/zinc/51/44/12/1042514412.db2.gz FJHMJMMQTCHPLV-VLCRHTCISA-N 2 0 344.543 4.099 20 0 EIADRP C[C@H](NC1(C[NH2+][C@@H](C)c2ccccc2)CCOCC1)c1ccccc1 ZINC000173434126 1042572545 /nfs/dbraw/zinc/57/25/45/1042572545.db2.gz MIIUGACFOAMCMQ-OALUTQOASA-N 2 0 338.495 4.237 20 0 EIADRP Cc1nc2ccc(C[NH+]3CCC(CCC[NH+](C)C)CC3)cc2s1 ZINC000426401052 1042653570 /nfs/dbraw/zinc/65/35/70/1042653570.db2.gz MRHKRZDHWFYSND-UHFFFAOYSA-N 2 0 331.529 4.159 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)[C@H](C)c1ccc(C)cc1C ZINC000542465029 1042831545 /nfs/dbraw/zinc/83/15/45/1042831545.db2.gz ZQAZKIFKFATBCZ-GOSISDBHSA-N 2 0 334.467 4.386 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310537055 1042839315 /nfs/dbraw/zinc/83/93/15/1042839315.db2.gz RNGFZEDVUMOLHA-SQGPQFPESA-N 2 0 326.459 4.387 20 0 EIADRP COC[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc(Cl)cc1 ZINC000493895419 1042977623 /nfs/dbraw/zinc/97/76/23/1042977623.db2.gz WXZLXWUYUILZAN-LJQANCHMSA-N 2 0 338.923 4.129 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[N@H+](C)CC1CC[NH2+]CC1 ZINC000262124522 1042992197 /nfs/dbraw/zinc/99/21/97/1042992197.db2.gz CHTOFHGJSWFVIZ-INIZCTEOSA-N 2 0 343.540 4.419 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCc2ccc(F)cc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168006687 1043008327 /nfs/dbraw/zinc/00/83/27/1043008327.db2.gz OFAHIWAUDSCHNX-OPMZPASUSA-N 2 0 340.486 4.399 20 0 EIADRP Cc1nc2ccc(C[NH2+]CCCCC[NH+]3CCCCC3)cc2s1 ZINC000494134609 1043020822 /nfs/dbraw/zinc/02/08/22/1043020822.db2.gz FRLLENHLRICYMO-UHFFFAOYSA-N 2 0 331.529 4.351 20 0 EIADRP CCCc1csc(CN[C@H](C)c2ccc(-n3ccnc3C)cc2)n1 ZINC000494152126 1043023326 /nfs/dbraw/zinc/02/33/26/1043023326.db2.gz HSSPAVDNZZIPGQ-CQSZACIVSA-N 2 0 340.496 4.441 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000183185655 1043039835 /nfs/dbraw/zinc/03/98/35/1043039835.db2.gz ILTAOIGWUOPEKF-JENIJYKNSA-N 2 0 330.516 4.389 20 0 EIADRP CCC[NH+]1CCC(N(C)Cc2ccc(Oc3ccccc3)o2)CC1 ZINC000507810213 1043042368 /nfs/dbraw/zinc/04/23/68/1043042368.db2.gz GOIOOXUAOVCOLB-UHFFFAOYSA-N 2 0 328.456 4.378 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2cscc2Br)CC1 ZINC000512083720 1043084711 /nfs/dbraw/zinc/08/47/11/1043084711.db2.gz LRGSKANUSKTIMA-UHFFFAOYSA-N 2 0 345.350 4.112 20 0 EIADRP Cc1cncc([C@@H](C)[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)c1 ZINC000184346021 1043091778 /nfs/dbraw/zinc/09/17/78/1043091778.db2.gz VZTRWRWAINVFMC-LJQANCHMSA-N 2 0 337.511 4.473 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2scnc2C2CC2)CC1)CC1CC1 ZINC000495028019 1043099541 /nfs/dbraw/zinc/09/95/41/1043099541.db2.gz MASAJUYUVDSLQL-UHFFFAOYSA-N 2 0 347.572 4.355 20 0 EIADRP Cc1cccc2c(NC3CC[NH+](Cc4ccccn4)CC3)c(C)c[nH+]c12 ZINC000185276271 1043169833 /nfs/dbraw/zinc/16/98/33/1043169833.db2.gz GWZZVUXWVKPJDC-UHFFFAOYSA-N 2 0 346.478 4.323 20 0 EIADRP CCSc1cccc(C[NH2+]Cc2ccccc2OCC[NH+](C)C)c1 ZINC000185499483 1043191614 /nfs/dbraw/zinc/19/16/14/1043191614.db2.gz UWSREGFHCCYSEZ-UHFFFAOYSA-N 2 0 344.524 4.029 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2cnc3ccccc3c2)C1 ZINC000727467011 1043225950 /nfs/dbraw/zinc/22/59/50/1043225950.db2.gz LOFLVANVEKGTRC-QZTJIDSGSA-N 2 0 325.500 4.083 20 0 EIADRP C[NH+](C/C=C\C[N@@H+](C)Cc1cccc(F)c1)Cc1cccc(F)c1 ZINC000613366034 1043256591 /nfs/dbraw/zinc/25/65/91/1043256591.db2.gz SQGKZNXQACHGGP-ARJAWSKDSA-N 2 0 330.422 4.085 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)C[C@@H]1C ZINC000674005782 1043271011 /nfs/dbraw/zinc/27/10/11/1043271011.db2.gz OKTPLRBLDJJRIR-YJBOKZPZSA-N 2 0 342.449 4.443 20 0 EIADRP Cc1nccn1CCCC[N@@H+]1CCC[C@H](c2ccc(F)c(F)c2)C1 ZINC000625658421 1043320203 /nfs/dbraw/zinc/32/02/03/1043320203.db2.gz YYTYHBFDNTXYLD-KRWDZBQOSA-N 2 0 333.426 4.130 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCC[C@H]2[C@@H]2CCOC2)c1 ZINC000474029118 1043441912 /nfs/dbraw/zinc/44/19/12/1043441912.db2.gz LEEKHBHTUFICGT-BHIFYINESA-N 2 0 344.543 4.212 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1ccc(Oc2ccccc2)cn1 ZINC000521025734 1043497700 /nfs/dbraw/zinc/49/77/00/1043497700.db2.gz IVTPZZSCZLWDME-TWOQFEAHSA-N 2 0 325.456 4.042 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1C[C@H](c2ccccc2C)C[C@@H]1C ZINC000346197012 1043656082 /nfs/dbraw/zinc/65/60/82/1043656082.db2.gz DCWIQCSVWHXZCT-PKOBYXMFSA-N 2 0 346.478 4.262 20 0 EIADRP C[C@H](NC1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1)c1ccc(F)cn1 ZINC001168013738 1043664839 /nfs/dbraw/zinc/66/48/39/1043664839.db2.gz IYTDXOCYFHABTD-ULQDDVLXSA-N 2 0 341.474 4.313 20 0 EIADRP Cc1cccc2c1CCC[C@@H]2[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000665283665 1043688037 /nfs/dbraw/zinc/68/80/37/1043688037.db2.gz RYTLIWNDYGFXNR-QZNHQXDQSA-N 2 0 348.490 4.218 20 0 EIADRP C[C@H](CC[NH2+][C@@H]1CCCC[C@@H]1[C@H]1CCOC1)[N@H+](C)Cc1ccccc1 ZINC000474035177 1043694620 /nfs/dbraw/zinc/69/46/20/1043694620.db2.gz OWLPQOXPLDYQJO-FVTFTPSCSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccccn1 ZINC000658065421 1043722598 /nfs/dbraw/zinc/72/25/98/1043722598.db2.gz BIWYQXROUGCDMJ-PELRDEGISA-N 2 0 337.511 4.218 20 0 EIADRP CC(C)[C@H]([NH2+]CC[C@@H](C)[NH+]1CCCCC1)c1ccc2[nH]c(=O)oc2c1 ZINC000542487821 1043799227 /nfs/dbraw/zinc/79/92/27/1043799227.db2.gz HPTICCGNSLVHSQ-BEFAXECRSA-N 2 0 345.487 4.085 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000521814053 1043981715 /nfs/dbraw/zinc/98/17/15/1043981715.db2.gz UOXPCCXHFAEPSI-OAHLLOKOSA-N 2 0 332.488 4.376 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000193973987 1044225906 /nfs/dbraw/zinc/22/59/06/1044225906.db2.gz SYSNDIKJARECGP-GDBMZVCRSA-N 2 0 340.433 4.100 20 0 EIADRP CS[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C)C(C)(C)C ZINC000542499937 1044228711 /nfs/dbraw/zinc/22/87/11/1044228711.db2.gz RTNWSLRFRBTEIY-YTQUADARSA-N 2 0 334.573 4.264 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cc(Br)cs2)C1 ZINC000194027918 1044244057 /nfs/dbraw/zinc/24/40/57/1044244057.db2.gz FBVDPBPAPAFXNI-STQMWFEESA-N 2 0 345.350 4.282 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@H]2Cc3cccc(Cl)c3C2)CC1 ZINC001168714744 1044272239 /nfs/dbraw/zinc/27/22/39/1044272239.db2.gz KYLPZLLQLOQXJN-SZMVWBNQSA-N 2 0 332.919 4.322 20 0 EIADRP c1sc(C2CCCC2)nc1CN1CCC(C[NH+]2CCCC2)CC1 ZINC000194537530 1044320521 /nfs/dbraw/zinc/32/05/21/1044320521.db2.gz HOCQTEKBAJGJLG-UHFFFAOYSA-N 2 0 333.545 4.109 20 0 EIADRP COCC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1 ZINC000347930242 1044328756 /nfs/dbraw/zinc/32/87/56/1044328756.db2.gz KOMGPTOIUAIAAY-DSKINZAPSA-N 2 0 330.516 4.007 20 0 EIADRP CC(C)C[C@H]1CCC[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C1 ZINC000657538372 1044382340 /nfs/dbraw/zinc/38/23/40/1044382340.db2.gz ZQPKXSXOLNFLLZ-WOJBJXKFSA-N 2 0 336.564 4.072 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCCC[C@H]2[C@@H]2CCOC2)c1 ZINC000474085258 1044416627 /nfs/dbraw/zinc/41/66/27/1044416627.db2.gz WSHNGWGHGGVVFO-BHIFYINESA-N 2 0 344.543 4.213 20 0 EIADRP CC1CC[NH+](CCC[NH2+][C@H](C[C@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000494880278 1044463936 /nfs/dbraw/zinc/46/39/36/1044463936.db2.gz RXSSHALTDWKEBC-WIYYLYMNSA-N 2 0 348.506 4.005 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OC2CCCCC2)cc1)C1CC[NH+](C)CC1 ZINC000675796513 1044492094 /nfs/dbraw/zinc/49/20/94/1044492094.db2.gz CPHMLYPWVNQWMQ-KRWDZBQOSA-N 2 0 330.516 4.218 20 0 EIADRP CCC[NH+]1CCC([NH2+]Cc2c(C)cc(Br)cc2C)CC1 ZINC000675790246 1044502858 /nfs/dbraw/zinc/50/28/58/1044502858.db2.gz YXXYITYVFHELFA-UHFFFAOYSA-N 2 0 339.321 4.030 20 0 EIADRP Cc1cccc(C(=[NH2+])NC2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)c1 ZINC001168022679 1044532213 /nfs/dbraw/zinc/53/22/13/1044532213.db2.gz AWSYDFILNBJKKO-QZTJIDSGSA-N 2 0 335.495 4.352 20 0 EIADRP CS[C@H](C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1)C(C)(C)C ZINC000543426728 1044576313 /nfs/dbraw/zinc/57/63/13/1044576313.db2.gz JIEFLLTXSNFHKC-CRAIPNDOSA-N 2 0 338.561 4.055 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H](c2ccccc2C)C2CCCC2)CC1 ZINC000495060850 1044625669 /nfs/dbraw/zinc/62/56/69/1044625669.db2.gz RWJITJLDKPSRSN-JOCHJYFZSA-N 2 0 344.543 4.317 20 0 EIADRP Cc1ccccc1[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H]1CO)C1CCCC1 ZINC000495081003 1044648568 /nfs/dbraw/zinc/64/85/68/1044648568.db2.gz FLTKWKNGFHJEMQ-RBBKRZOGSA-N 2 0 344.543 4.053 20 0 EIADRP Cc1c(C[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)sc2nc(C)nc(C)c12 ZINC000734849728 1044702324 /nfs/dbraw/zinc/70/23/24/1044702324.db2.gz JGTHMFIMWVWTLN-MRXNPFEDSA-N 2 0 348.560 4.073 20 0 EIADRP Cc1c(C[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)sc2nc(C)nc(C)c12 ZINC000734849727 1044702686 /nfs/dbraw/zinc/70/26/86/1044702686.db2.gz JGTHMFIMWVWTLN-INIZCTEOSA-N 2 0 348.560 4.073 20 0 EIADRP C[C@@H]([NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1)c1ccc(N)cc1 ZINC001168028537 1044747688 /nfs/dbraw/zinc/74/76/88/1044747688.db2.gz PGIKSLUUXRPRBE-OKZBNKHCSA-N 2 0 337.511 4.361 20 0 EIADRP CS[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCCC2)C1 ZINC000735324616 1044795592 /nfs/dbraw/zinc/79/55/92/1044795592.db2.gz VXTOYVODHJRUCC-VQTJNVASSA-N 2 0 332.557 4.436 20 0 EIADRP C[C@@H]1CC(n2cnc3cccc(C[NH3+])c32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168030727 1044804683 /nfs/dbraw/zinc/80/46/83/1044804683.db2.gz WZWCNBLAHDZBBJ-IAGOWNOFSA-N 2 0 348.494 4.109 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)[C@@H]1CCCO1 ZINC000544362331 1044823096 /nfs/dbraw/zinc/82/30/96/1044823096.db2.gz CSIPBKRVDJOBMW-VGSWGCGISA-N 2 0 338.495 4.072 20 0 EIADRP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000673600219 1044861332 /nfs/dbraw/zinc/86/13/32/1044861332.db2.gz WPAXHEQWJOTUKX-IOTGCTKJSA-N 2 0 338.417 4.325 20 0 EIADRP Cc1ccc(-c2csc(C[NH+]3CCC(CC[NH+](C)C)CC3)n2)cc1 ZINC000509263401 1044869162 /nfs/dbraw/zinc/86/91/62/1044869162.db2.gz LPCJVRVYSWYBBV-UHFFFAOYSA-N 2 0 343.540 4.282 20 0 EIADRP COC1CCC(CC[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)CC1 ZINC000543594953 1044878323 /nfs/dbraw/zinc/87/83/23/1044878323.db2.gz KILIBTDAZDLRDC-OMZYAQQMSA-N 2 0 336.564 4.214 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2ccsc2Br)CC1 ZINC000922847257 1044994129 /nfs/dbraw/zinc/99/41/29/1044994129.db2.gz YGNVUBPQYHJYFT-UHFFFAOYSA-N 2 0 343.334 4.007 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1sc2nc(C)nc(C)c2c1C ZINC000915225909 1045196729 /nfs/dbraw/zinc/19/67/29/1045196729.db2.gz FZHMRGISHANQCM-CYBMUJFWSA-N 2 0 348.560 4.217 20 0 EIADRP c1nc(C2CC2)c(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000486962210 1045221783 /nfs/dbraw/zinc/22/17/83/1045221783.db2.gz DGVNBSWQQUHVHY-UHFFFAOYSA-N 2 0 341.524 4.022 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1Cc2cccc(Cl)c2C1 ZINC001168741227 1045229987 /nfs/dbraw/zinc/22/99/87/1045229987.db2.gz XLFIOEUITOUGAD-RCCFBDPRSA-N 2 0 332.919 4.146 20 0 EIADRP CC[N@@H+]1CC[C@H](N[C@H]2CCOc3c(Cl)c(Cl)ccc32)[C@H](C)C1 ZINC000766259418 1045251508 /nfs/dbraw/zinc/25/15/08/1045251508.db2.gz YLSAAUYOGXAUSR-UGFHNGPFSA-N 2 0 343.298 4.137 20 0 EIADRP CCCCCCOc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000915681642 1045446859 /nfs/dbraw/zinc/44/68/59/1045446859.db2.gz FMOHFPITTWQQBT-PMACEKPBSA-N 2 0 330.516 4.362 20 0 EIADRP C[C@@H](Cc1cccc(F)c1)[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001168498142 1045454919 /nfs/dbraw/zinc/45/49/19/1045454919.db2.gz QTXMWMNPGDULOT-RXVVDRJESA-N 2 0 340.486 4.211 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000397502239 1045588352 /nfs/dbraw/zinc/58/83/52/1045588352.db2.gz ADQMEQXQKONREJ-KRWDZBQOSA-N 2 0 326.459 4.389 20 0 EIADRP Brc1ccc(C[NH2+]CCCCCCC[NH+]2CCCC2)o1 ZINC000790960632 1045636879 /nfs/dbraw/zinc/63/68/79/1045636879.db2.gz YFWVRRBMBRMBFN-UHFFFAOYSA-N 2 0 343.309 4.178 20 0 EIADRP C[C@H]1C[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CCC[C@H]1C[NH3+] ZINC001206026685 1045712280 /nfs/dbraw/zinc/71/22/80/1045712280.db2.gz TZBDZPMOSDNFDY-JQWIXIFHSA-N 2 0 335.706 4.454 20 0 EIADRP CCC(CC)[N@@H+](C1CC(C)(C)N(O)C(C)(C)C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001169984085 1045722079 /nfs/dbraw/zinc/72/20/79/1045722079.db2.gz CSWPIYFPWDDUHH-JCNLHEQBSA-N 2 0 339.568 4.158 20 0 EIADRP Cc1cccc2c1CC[C@H]2[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000105496501 1045738033 /nfs/dbraw/zinc/73/80/33/1045738033.db2.gz GVVDNKDIVRQJSP-JOCHJYFZSA-N 2 0 338.495 4.103 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CCN(Cc2ccccn2)C[C@H]1C)c1ccc(F)cc1 ZINC000247175546 1045842784 /nfs/dbraw/zinc/84/27/84/1045842784.db2.gz YUXAGVUGMOHNIQ-TYCQWZJGSA-N 2 0 341.474 4.172 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(-n2ccnc2)cc1 ZINC000247201891 1045843110 /nfs/dbraw/zinc/84/31/10/1045843110.db2.gz WIKYXDQVCGRQDY-RTBURBONSA-N 2 0 340.515 4.035 20 0 EIADRP CC[C@H]([NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1OC ZINC000248407630 1045872284 /nfs/dbraw/zinc/87/22/84/1045872284.db2.gz UNTAPTLJWLZMII-UWVAXJGDSA-N 2 0 330.516 4.389 20 0 EIADRP c1cc(-c2ccccc2)oc1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459389133 1045880154 /nfs/dbraw/zinc/88/01/54/1045880154.db2.gz LWYIOIVPYGTXPN-UHFFFAOYSA-N 2 0 333.435 4.100 20 0 EIADRP C[N@@H+]1CCC[C@H]1CCN1CCc2sccc2[C@@H]1c1cccs1 ZINC000163310362 1045939616 /nfs/dbraw/zinc/93/96/16/1045939616.db2.gz QLLIYAYUFKRJRM-KBXCAEBGSA-N 2 0 332.538 4.241 20 0 EIADRP C[C@@H](Cc1ccccc1Cl)[NH+]1CCC(C2CC[NH+](C)CC2)CC1 ZINC001170285586 1045991868 /nfs/dbraw/zinc/99/18/68/1045991868.db2.gz SMBKZHKHCDFOGU-INIZCTEOSA-N 2 0 334.935 4.325 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CC1 ZINC000161612811 1046007783 /nfs/dbraw/zinc/00/77/83/1046007783.db2.gz BTFUURMQZUDJHZ-CPUCHLNUSA-N 2 0 340.433 4.055 20 0 EIADRP CCc1nc(CN2CCC(C[NH2+][C@@H](C)C3CCCC3)CC2)cs1 ZINC000161793067 1046035987 /nfs/dbraw/zinc/03/59/87/1046035987.db2.gz HJIZKSDJRSXEBT-HNNXBMFYSA-N 2 0 335.561 4.086 20 0 EIADRP Cc1oc(-c2ccsc2)nc1C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123423552 1046050468 /nfs/dbraw/zinc/05/04/68/1046050468.db2.gz OUKLIXBOJKGCGE-UHFFFAOYSA-N 2 0 347.528 4.265 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[N@H+](C)C[C@H]1CCC[NH2+]C1 ZINC000261932082 1046165291 /nfs/dbraw/zinc/16/52/91/1046165291.db2.gz LROFGFGVTRBGQM-IRXDYDNUSA-N 2 0 343.540 4.419 20 0 EIADRP C[C@@]1(C[NH+]2CCC(c3nc4cc(Cl)ccc4s3)CC2)CC[NH2+]C1 ZINC000262127010 1046178759 /nfs/dbraw/zinc/17/87/59/1046178759.db2.gz XUSQHGUBGMEHFK-GOSISDBHSA-N 2 0 349.931 4.129 20 0 EIADRP CC[N@H+](C)C[C@H]1CC[NH+](CCCCc2cccc(C(F)(F)F)c2)C1 ZINC000476006474 1046250990 /nfs/dbraw/zinc/25/09/90/1046250990.db2.gz BURJBNOXFDPDCB-QGZVFWFLSA-N 2 0 342.449 4.302 20 0 EIADRP C[C@@H](Nc1cccc(C[NH+](C)C)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508688663 1046321741 /nfs/dbraw/zinc/32/17/41/1046321741.db2.gz DLAGTOFQMIXOFR-WIYYLYMNSA-N 2 0 337.511 4.071 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](C)Cc1cccs1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508692943 1046323746 /nfs/dbraw/zinc/32/37/46/1046323746.db2.gz XMTQOQCIZQMNIP-NSHGMRRFSA-N 2 0 342.552 4.427 20 0 EIADRP CCc1ccc([C@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)s1 ZINC000162524408 1046324144 /nfs/dbraw/zinc/32/41/44/1046324144.db2.gz MDUOYVLALMBPPX-HNNXBMFYSA-N 2 0 332.513 4.102 20 0 EIADRP COc1cc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1C ZINC000508698030 1046329828 /nfs/dbraw/zinc/32/98/28/1046329828.db2.gz KSTQEXQRXZCKPL-GHTZIAJQSA-N 2 0 338.495 4.004 20 0 EIADRP C[N@H+](CCC[NH2+]C1CCC(C(F)(F)F)CC1)Cc1ccccc1 ZINC000125888058 1046363839 /nfs/dbraw/zinc/36/38/39/1046363839.db2.gz HHRSPACMJQIPJK-UHFFFAOYSA-N 2 0 328.422 4.219 20 0 EIADRP C[C@H]([NH2+]CCc1cccc(F)c1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508710052 1046364841 /nfs/dbraw/zinc/36/48/41/1046364841.db2.gz KVEZBTYQWLFUND-QFBILLFUSA-N 2 0 344.449 4.008 20 0 EIADRP C[C@@H]([NH2+]CC1(c2ccccc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508710704 1046370330 /nfs/dbraw/zinc/37/03/30/1046370330.db2.gz NRFRVNSJNRLIAS-TZIWHRDSSA-N 2 0 334.507 4.218 20 0 EIADRP COCc1ccccc1/C=C(\C)CN(C)CC[C@H]1CCCC[N@@H+]1C ZINC000508742995 1046493625 /nfs/dbraw/zinc/49/36/25/1046493625.db2.gz IOKVETOHESQPCX-BKBDBRRMSA-N 2 0 330.516 4.043 20 0 EIADRP COCc1ccccc1/C=C(/C)CN(C)CC[C@H]1CCCC[N@@H+]1C ZINC000508743000 1046493897 /nfs/dbraw/zinc/49/38/97/1046493897.db2.gz IOKVETOHESQPCX-WOBAJENOSA-N 2 0 330.516 4.043 20 0 EIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CC[N@@H+](C3CC3)C1)CCCO2 ZINC000126535265 1046494120 /nfs/dbraw/zinc/49/41/20/1046494120.db2.gz XDDJVTJLBSAVKD-OXJNMPFZSA-N 2 0 328.500 4.098 20 0 EIADRP C[NH+]1C(C)(C)CC(Nc2cc(OCC(F)(F)F)cc[nH+]2)CC1(C)C ZINC001170454808 1046551283 /nfs/dbraw/zinc/55/12/83/1046551283.db2.gz ZOXKMZNCLZUSBS-UHFFFAOYSA-N 2 0 345.409 4.086 20 0 EIADRP CCOc1ccccc1[C@@H](CC)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459400677 1046597423 /nfs/dbraw/zinc/59/74/23/1046597423.db2.gz NAICUZXUJLTZDA-HXUWFJFHSA-N 2 0 339.483 4.190 20 0 EIADRP C[C@H](C[NH2+]C1CCN(C2CC2)CC1)c1c(Cl)cccc1Cl ZINC000459400553 1046599170 /nfs/dbraw/zinc/59/91/70/1046599170.db2.gz MPOZQEPELXBVRC-GFCCVEGCSA-N 2 0 327.299 4.313 20 0 EIADRP CCCCOc1cc(C[N@H+](C)[C@@H]2CC[NH+](CC)C[C@H]2C)ccc1OC ZINC000536658859 1046622859 /nfs/dbraw/zinc/62/28/59/1046622859.db2.gz PPTKFBNCRVCPAE-IEBWSBKVSA-N 2 0 348.531 4.036 20 0 EIADRP c1cc(-c2ccccc2)sc1C[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000536658921 1046623396 /nfs/dbraw/zinc/62/33/96/1046623396.db2.gz UUPHRPZXIRCPNO-KRWDZBQOSA-N 2 0 326.509 4.333 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(C)c(OC(F)F)c(C)c2)[C@@H](C)C1 ZINC000536660000 1046624494 /nfs/dbraw/zinc/62/44/94/1046624494.db2.gz SASDIZZBPCSPCK-DOTOQJQBSA-N 2 0 340.458 4.067 20 0 EIADRP c1ccc(SC2(C[NH2+]C3CCN(C4CC4)CC3)CCCC2)cc1 ZINC000459414416 1046640495 /nfs/dbraw/zinc/64/04/95/1046640495.db2.gz YYISOHHFJQLFGJ-UHFFFAOYSA-N 2 0 330.541 4.308 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(OC(F)F)c(Cl)c2)[C@@H](C)C1 ZINC000536678538 1046664665 /nfs/dbraw/zinc/66/46/65/1046664665.db2.gz CASQGRBTSJJWQA-SWLSCSKDSA-N 2 0 346.849 4.104 20 0 EIADRP FC(F)(F)[C@H]1CCCC[C@H]1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459433671 1046667940 /nfs/dbraw/zinc/66/79/40/1046667940.db2.gz HFUDTFDPYDCCAK-YOEHRIQHSA-N 2 0 341.421 4.009 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc3cc(OC)ccc3c2)[C@@H](C)C1 ZINC000536682260 1046683598 /nfs/dbraw/zinc/68/35/98/1046683598.db2.gz BJCDJJXDORATLU-HRAATJIYSA-N 2 0 326.484 4.011 20 0 EIADRP CC[NH+](CC)C[C@H]1CC[N@H+](Cc2c(OC)ccc3ccccc32)C1 ZINC000536697294 1046694456 /nfs/dbraw/zinc/69/44/56/1046694456.db2.gz OLWWFHGSSIAAOT-QGZVFWFLSA-N 2 0 326.484 4.012 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCCC2(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000379651225 1046742999 /nfs/dbraw/zinc/74/29/99/1046742999.db2.gz UJEQNTIMWVEJHV-NZSAHSFTSA-N 2 0 336.470 4.455 20 0 EIADRP Cc1cc([NH+]2CCCCCC2)ccc1NC1CC[NH+](C2CC2)CC1 ZINC000459538709 1046778859 /nfs/dbraw/zinc/77/88/59/1046778859.db2.gz DVTRWSXIMQXITR-UHFFFAOYSA-N 2 0 327.516 4.414 20 0 EIADRP C/C=C/COc1ccc(CC[C@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)cc1 ZINC000536856406 1046825787 /nfs/dbraw/zinc/82/57/87/1046825787.db2.gz GCLZODXEFNJSOS-UEKDZROGSA-N 2 0 344.543 4.425 20 0 EIADRP C[C@@H]([NH2+]Cc1cnc2ccccc2c1)c1cccc(OCC[NH+](C)C)c1 ZINC000536859148 1046826832 /nfs/dbraw/zinc/82/68/32/1046826832.db2.gz RTUGVHXGOQDZBI-QGZVFWFLSA-N 2 0 349.478 4.026 20 0 EIADRP COc1cccc2c1C[C@@H]([NH2+][C@@H](C)c1ccc(-n3ccnc3C)cc1)C2 ZINC000459722639 1046864580 /nfs/dbraw/zinc/86/45/80/1046864580.db2.gz IDSVSYGRCBUHQY-KXBFYZLASA-N 2 0 347.462 4.007 20 0 EIADRP Cc1cc(NC2CC[NH+](C3CCCCC3)CC2)ccc1C[NH+](C)C ZINC000459771326 1046881262 /nfs/dbraw/zinc/88/12/62/1046881262.db2.gz RPFAFEODGJBTSN-UHFFFAOYSA-N 2 0 329.532 4.266 20 0 EIADRP CC[C@@H]([NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)C(C)(C)C ZINC000537197947 1047019944 /nfs/dbraw/zinc/01/99/44/1047019944.db2.gz NMYYXLDYGNPYMW-PKOBYXMFSA-N 2 0 330.516 4.389 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2ncc(-c3ccccc3)s2)CC1 ZINC000537205700 1047040158 /nfs/dbraw/zinc/04/01/58/1047040158.db2.gz NNZRZPSPWVHFMR-UHFFFAOYSA-N 2 0 343.540 4.364 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2cc3cccc(OC)c3o2)CC1 ZINC000537294003 1047076062 /nfs/dbraw/zinc/07/60/62/1047076062.db2.gz PVIJCCYQLFXRCY-OAHLLOKOSA-N 2 0 330.472 4.214 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000537304358 1047084753 /nfs/dbraw/zinc/08/47/53/1047084753.db2.gz ONCJFIBCMAMQBO-OAQYLSRUSA-N 2 0 342.433 4.100 20 0 EIADRP CC(C)[C@@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(F)cn1 ZINC000497868100 1047142718 /nfs/dbraw/zinc/14/27/18/1047142718.db2.gz NCHZGTDXJKDSPA-MBOZVWFJSA-N 2 0 335.511 4.266 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CCO1 ZINC000537406714 1047199378 /nfs/dbraw/zinc/19/93/78/1047199378.db2.gz IAAGTFBSTJYNCM-NMIHRBCNSA-N 2 0 344.543 4.080 20 0 EIADRP CC(C)[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@@H](O)c1ccccc1 ZINC000788622280 1047251853 /nfs/dbraw/zinc/25/18/53/1047251853.db2.gz QPYNIWDAVGRGJV-YADHBBJMSA-N 2 0 344.543 4.131 20 0 EIADRP COc1ccc([C@H]([NH2+]CC2(C)CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000327842334 1047404345 /nfs/dbraw/zinc/40/43/45/1047404345.db2.gz RQGAXNIFQIGAAS-OAQYLSRUSA-N 2 0 338.495 4.106 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000129650718 1047457253 /nfs/dbraw/zinc/45/72/53/1047457253.db2.gz MGBXCGXGFDUUGO-XUWVNRHRSA-N 2 0 332.454 4.350 20 0 EIADRP Clc1ccccc1C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)C1CC1 ZINC000556177615 1047539654 /nfs/dbraw/zinc/53/96/54/1047539654.db2.gz DZJIEXWOOOMPFB-FQEVSTJZSA-N 2 0 332.919 4.125 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2c(Cl)cccc2C(F)(F)F)CC1 ZINC001168298317 1047673384 /nfs/dbraw/zinc/67/33/84/1047673384.db2.gz MIBLIVOHJGGWQG-UHFFFAOYSA-N 2 0 334.813 4.321 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c(C)s1 ZINC000556408031 1047739508 /nfs/dbraw/zinc/73/95/08/1047739508.db2.gz TYNYPZWDSZSRGC-UHFFFAOYSA-N 2 0 344.524 4.128 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000556589893 1047834747 /nfs/dbraw/zinc/83/47/47/1047834747.db2.gz QPMLMMWPJMIJCC-XWDORNJCSA-N 2 0 330.516 4.041 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000131294632 1047860185 /nfs/dbraw/zinc/86/01/85/1047860185.db2.gz YUTBIOTUFKSOFJ-MSOLQXFVSA-N 2 0 342.531 4.342 20 0 EIADRP CC1(C)[C@@H]2C[C@H]([N@H+](Cc3ccc(F)cc3)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170736418 1047923511 /nfs/dbraw/zinc/92/35/11/1047923511.db2.gz MFKIEMXTVLUVBN-CCQCEHTISA-N 2 0 330.491 4.332 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171066046 1047938586 /nfs/dbraw/zinc/93/85/86/1047938586.db2.gz GCPPFZDAVBWWOB-PCKAHOCUSA-N 2 0 341.326 4.313 20 0 EIADRP C[C@@]1(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)CC1(Cl)Cl ZINC000824971539 1048013095 /nfs/dbraw/zinc/01/30/95/1048013095.db2.gz SWKIQCWAHZRGIZ-MRXNPFEDSA-N 2 0 333.347 4.347 20 0 EIADRP C[C@H](c1ccccc1C(F)(F)F)[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000824988014 1048017478 /nfs/dbraw/zinc/01/74/78/1048017478.db2.gz GAFOGGJIRFEOCB-MGLUKCQKSA-N 2 0 340.433 4.412 20 0 EIADRP C[NH+](C)[C@H]1CC[C@@H]([NH2+][C@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171073501 1048026909 /nfs/dbraw/zinc/02/69/09/1048026909.db2.gz GCPPFZDAVBWWOB-HRCADAONSA-N 2 0 341.326 4.313 20 0 EIADRP C[N@H+](Cc1ccco1)[C@H]1CCC12CC[NH+]([C@@H]1C[C@@H]3[C@H](C1)C3(C)C)CC2 ZINC001170752068 1048065738 /nfs/dbraw/zinc/06/57/38/1048065738.db2.gz IMINEGUHDLPFIH-FFGOWVMKSA-N 2 0 342.527 4.391 20 0 EIADRP C[C@@H](CCc1ccc(F)cc1F)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000556865745 1048071934 /nfs/dbraw/zinc/07/19/34/1048071934.db2.gz YKWNMRSVIPKPDK-HNNXBMFYSA-N 2 0 332.438 4.137 20 0 EIADRP CN(C)c1ccccc1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499126486 1048304474 /nfs/dbraw/zinc/30/44/74/1048304474.db2.gz WPPIZEHJKPAYEC-KOUNCHBCSA-N 2 0 349.522 4.038 20 0 EIADRP Cc1ccsc1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499147373 1048352989 /nfs/dbraw/zinc/35/29/89/1048352989.db2.gz PXPXOHKJJSHVOD-LDLYASANSA-N 2 0 326.509 4.342 20 0 EIADRP FC1(F)C[C@@]12CC[NH+](CCCCCC[N@H+]1CC[C@]3(CC3(F)F)C1)C2 ZINC000844470879 1048356050 /nfs/dbraw/zinc/35/60/50/1048356050.db2.gz MCXCVOUUDILSJK-IYBDPMFKSA-N 2 0 348.428 4.009 20 0 EIADRP Oc1cccc2c1CC[C@@H]2[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499153571 1048363380 /nfs/dbraw/zinc/36/33/80/1048363380.db2.gz RVFXRCBDDJZJFB-VWNVYAMZSA-N 2 0 348.490 4.165 20 0 EIADRP CCCC[NH+]1CCC(N(C)Cc2cc(F)c(OCC)c(F)c2)CC1 ZINC001144036664 1048384503 /nfs/dbraw/zinc/38/45/03/1048384503.db2.gz PPUKDSOMPHIYMZ-UHFFFAOYSA-N 2 0 340.458 4.060 20 0 EIADRP CCCCc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1 ZINC000132797155 1048498607 /nfs/dbraw/zinc/49/86/07/1048498607.db2.gz MAFKPMIZKIMRNM-UYAOXDASSA-N 2 0 344.543 4.181 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+][C@@H]3CCCOCC3)[C@@H](C)C2)CC[C@@H]1[NH3+] ZINC001170793290 1048520443 /nfs/dbraw/zinc/52/04/43/1048520443.db2.gz XZMUMOWOUKDTHA-GCBPXECTSA-N 2 0 336.564 4.104 20 0 EIADRP Cc1cc(F)ccc1[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000815622221 1048547638 /nfs/dbraw/zinc/54/76/38/1048547638.db2.gz PRERQPXJGDLASI-MJGOQNOKSA-N 2 0 326.459 4.307 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)c1cc(Cl)c(N)c(Cl)c1 ZINC000844923934 1048549240 /nfs/dbraw/zinc/54/92/40/1048549240.db2.gz ISYUSILBQILPGF-NSHDSACASA-N 2 0 338.282 4.146 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1cc(C)c(OC)c(Cl)c1 ZINC000844924856 1048549459 /nfs/dbraw/zinc/54/94/59/1048549459.db2.gz RJZKQDZQHXUYPG-CQSZACIVSA-N 2 0 332.875 4.227 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1cc(Cl)c(N)c(Cl)c1 ZINC000815647266 1048571021 /nfs/dbraw/zinc/57/10/21/1048571021.db2.gz DQTMIUNNXXYEAN-CYBMUJFWSA-N 2 0 344.330 4.492 20 0 EIADRP CSc1ccc(C[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)s1 ZINC000810155965 1048662132 /nfs/dbraw/zinc/66/21/32/1048662132.db2.gz NIOMCDINBMIROY-IBGZPJMESA-N 2 0 346.565 4.472 20 0 EIADRP CSc1ccc(C[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)s1 ZINC000810155966 1048662582 /nfs/dbraw/zinc/66/25/82/1048662582.db2.gz NIOMCDINBMIROY-LJQANCHMSA-N 2 0 346.565 4.472 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CC[C@]2(C)C[C@@]2(F)Cl)CC1 ZINC000846030935 1048796598 /nfs/dbraw/zinc/79/65/98/1048796598.db2.gz GGJQATBDRDJMCF-SPUZQDLCSA-N 2 0 330.919 4.324 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC[C@@]1(C)C[C@]1(F)Cl ZINC000846188818 1048838903 /nfs/dbraw/zinc/83/89/03/1048838903.db2.gz JTERVABTEPDIAM-XGXHKWSGSA-N 2 0 338.898 4.191 20 0 EIADRP Cc1nn(CC(C)C)c(Cl)c1[C@@H]1CCC[N@@H+]1CCCCCC[NH3+] ZINC000846219416 1048843639 /nfs/dbraw/zinc/84/36/39/1048843639.db2.gz QLOXHHPYNDYYQU-INIZCTEOSA-N 2 0 340.943 4.157 20 0 EIADRP C[C@@H]1C[C@H]1c1ccc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)o1 ZINC000237465442 1048947816 /nfs/dbraw/zinc/94/78/16/1048947816.db2.gz WSDCITNNYSFAOU-DNVCBOLYSA-N 2 0 344.524 4.466 20 0 EIADRP C[C@H](C[C@H]1CCCCC[NH2+]1)[NH2+][C@H](c1ccccc1)C1CCOCC1 ZINC000817893255 1049053990 /nfs/dbraw/zinc/05/39/90/1049053990.db2.gz DENAWHDATNESNL-DUXKGJEZSA-N 2 0 330.516 4.055 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c2ccccc21 ZINC000817912501 1049059623 /nfs/dbraw/zinc/05/96/23/1049059623.db2.gz VHKANXZUNWIEED-BTIFBSDPSA-N 2 0 334.463 4.080 20 0 EIADRP Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)CCCO2 ZINC000817950278 1049063344 /nfs/dbraw/zinc/06/33/44/1049063344.db2.gz XQWVEDYKZPTWKZ-IBGZPJMESA-N 2 0 344.886 4.153 20 0 EIADRP Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000817948411 1049063560 /nfs/dbraw/zinc/06/35/60/1049063560.db2.gz JIMRGFDQSCDWFJ-LJQANCHMSA-N 2 0 344.886 4.153 20 0 EIADRP [NH3+]CCc1ccc(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)cc1 ZINC000817947987 1049065064 /nfs/dbraw/zinc/06/50/64/1049065064.db2.gz HWSXKIVPYVSDAT-LJQANCHMSA-N 2 0 348.412 4.448 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)[C@@H](C)c1nc2ccccc2s1 ZINC000817949545 1049065210 /nfs/dbraw/zinc/06/52/10/1049065210.db2.gz RAWABMYBUQWWNN-HUUCEWRRSA-N 2 0 339.508 4.079 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@H]2CCCC[C@@H]2C[NH3+])ccc1SC(F)F ZINC000817960107 1049068490 /nfs/dbraw/zinc/06/84/90/1049068490.db2.gz KNYMNEZWLGMZAZ-YUTCNCBUSA-N 2 0 344.471 4.178 20 0 EIADRP FC(F)Sc1ccc2c(c1)CCC[C@@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000817967840 1049072037 /nfs/dbraw/zinc/07/20/37/1049072037.db2.gz CSNFXXATLNUJKQ-CJNGLKHVSA-N 2 0 326.456 4.110 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)ccc1SC(F)F ZINC000817980999 1049078682 /nfs/dbraw/zinc/07/86/82/1049078682.db2.gz OSSRBKKESGROKV-TZMCWYRMSA-N 2 0 344.471 4.193 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ccnc(Cl)c2Cl)C1 ZINC000811474206 1049093527 /nfs/dbraw/zinc/09/35/27/1049093527.db2.gz FJOIUHUBXYAABB-ZIAGYGMSSA-N 2 0 344.330 4.236 20 0 EIADRP Clc1nccc(C[NH2+]CCCCC[NH+]2CCCCC2)c1Cl ZINC000811477685 1049097372 /nfs/dbraw/zinc/09/73/72/1049097372.db2.gz CIVYKWHMZFCMHX-UHFFFAOYSA-N 2 0 330.303 4.134 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CC2)[C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170911501 1049195313 /nfs/dbraw/zinc/19/53/13/1049195313.db2.gz XXXKVWWTYHVKKL-BZSNNMDCSA-N 2 0 332.919 4.179 20 0 EIADRP Cc1ccc(C)c(N([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)[nH+]1 ZINC001170644106 1049264926 /nfs/dbraw/zinc/26/49/26/1049264926.db2.gz BCGOKGPPWFQVSE-NSKBAKJYSA-N 2 0 335.495 4.331 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H]2CCc3cc(F)cc(F)c3C2)CC1 ZINC001170669681 1049390569 /nfs/dbraw/zinc/39/05/69/1049390569.db2.gz MHHDJKQCWLNUMR-ADKAHSJRSA-N 2 0 336.470 4.065 20 0 EIADRP CCC(CC)[NH+]1CCC([NH2+][C@H]2CCc3cc(F)cc(F)c3C2)CC1 ZINC001170677655 1049468096 /nfs/dbraw/zinc/46/80/96/1049468096.db2.gz RFFURAHGLHPMQH-KRWDZBQOSA-N 2 0 336.470 4.065 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@@H]2CCc3c(F)cc(F)cc3C2)CC1(C)C ZINC001171349277 1049499762 /nfs/dbraw/zinc/49/97/62/1049499762.db2.gz HNXQYSDOQXXJRK-OAHLLOKOSA-N 2 0 336.470 4.063 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H](Cc2ccccc2Cl)c2ccoc2)CC1 ZINC000820810350 1049553690 /nfs/dbraw/zinc/55/36/90/1049553690.db2.gz VLIVBTUIBRZEOI-LJQANCHMSA-N 2 0 332.875 4.148 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@@H]2CCc3cc(F)cc(F)c3C2)CC1 ZINC001170685409 1049567723 /nfs/dbraw/zinc/56/77/23/1049567723.db2.gz MHHDJKQCWLNUMR-KURKYZTESA-N 2 0 336.470 4.065 20 0 EIADRP Fc1cccc2c1CC[C@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)C2 ZINC001171411892 1049646870 /nfs/dbraw/zinc/64/68/70/1049646870.db2.gz PDNQTUYUKTXOLA-SFHVURJKSA-N 2 0 330.491 4.070 20 0 EIADRP Fc1cccc2c1CC[C@@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)C2 ZINC001171411889 1049647092 /nfs/dbraw/zinc/64/70/92/1049647092.db2.gz PDNQTUYUKTXOLA-GOSISDBHSA-N 2 0 330.491 4.070 20 0 EIADRP CC(C)(C)C[NH+]1CCC(C[NH2+][C@@H]2CCc3cccc(F)c3C2)CC1 ZINC001170969432 1049671880 /nfs/dbraw/zinc/67/18/80/1049671880.db2.gz IARSHQPBAUWPJW-GOSISDBHSA-N 2 0 332.507 4.031 20 0 EIADRP Fc1cccc2c1CC[C@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001171434018 1049674865 /nfs/dbraw/zinc/67/48/65/1049674865.db2.gz PMPLLEMGYBUIAV-MOPGFXCFSA-N 2 0 330.491 4.023 20 0 EIADRP CN1CCC([N@H+](C2CCCC2)[C@@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171500529 1049736725 /nfs/dbraw/zinc/73/67/25/1049736725.db2.gz QXTFAFZHSANXCG-LJQANCHMSA-N 2 0 348.481 4.161 20 0 EIADRP C[NH+]1C(C)(C)CC(NC[C@@H](c2ccccc2)[NH+]2CCCC2)CC1(C)C ZINC001171619505 1049767084 /nfs/dbraw/zinc/76/70/84/1049767084.db2.gz NECXGGKIWTUBJM-FQEVSTJZSA-N 2 0 343.559 4.065 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc(OC(F)F)cc2)CC1(C)C ZINC001171619795 1049767206 /nfs/dbraw/zinc/76/72/06/1049767206.db2.gz QLRPWAIAPAZPIZ-UHFFFAOYSA-N 2 0 326.431 4.029 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CCCCCCCCCCO)CC1(C)C ZINC001171623572 1049767644 /nfs/dbraw/zinc/76/76/44/1049767644.db2.gz CPVTWLRMWRNQKZ-UHFFFAOYSA-N 2 0 326.569 4.341 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]Cc2ccc(-c3ccccn3)cc2)CC1(C)C ZINC001171624784 1049768137 /nfs/dbraw/zinc/76/81/37/1049768137.db2.gz XMIAHQVPWWENRI-UHFFFAOYSA-N 2 0 337.511 4.490 20 0 EIADRP C[NH+]1C(C)(C)CC(NC2CC[NH+](C3CCCCC3)CC2)CC1(C)C ZINC001171625862 1049768435 /nfs/dbraw/zinc/76/84/35/1049768435.db2.gz PDYOJXLJKUIXRS-UHFFFAOYSA-N 2 0 335.580 4.025 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1nc2c(s1)CCCC2 ZINC000245535849 1049768792 /nfs/dbraw/zinc/76/87/92/1049768792.db2.gz KSBHPZQJGDIKMT-JKSUJKDBSA-N 2 0 335.561 4.185 20 0 EIADRP C[NH+]1C(C)(C)CC(NC(=[NH2+])c2ccc(F)c(Cl)c2)CC1(C)C ZINC001171626912 1049769620 /nfs/dbraw/zinc/76/96/20/1049769620.db2.gz GUXNYERZSPEHLZ-UHFFFAOYSA-N 2 0 325.859 4.045 20 0 EIADRP C[C@@H](C[NH3+])C[N@H+](C)C1CCC(c2ccc(Br)cc2)CC1 ZINC001171648207 1049769878 /nfs/dbraw/zinc/76/98/78/1049769878.db2.gz QNVULFCTQMFYHT-KTAKPFMOSA-N 2 0 339.321 4.002 20 0 EIADRP Cc1ccc(CC[C@@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cc1 ZINC001171657576 1049770414 /nfs/dbraw/zinc/77/04/14/1049770414.db2.gz IMBMDZARJGMFTR-LJQANCHMSA-N 2 0 340.511 4.046 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cc1 ZINC001171657572 1049770601 /nfs/dbraw/zinc/77/06/01/1049770601.db2.gz IMBMDZARJGMFTR-IBGZPJMESA-N 2 0 340.511 4.046 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706775 1049776210 /nfs/dbraw/zinc/77/62/10/1049776210.db2.gz MACDXJRERGAPMZ-IPMKNSEASA-N 2 0 348.481 4.161 20 0 EIADRP CC1CC(C[NH+]2CCC3(CC[NH+](Cc4ccccc4)CC3)CC2)C1 ZINC001171642156 1049779813 /nfs/dbraw/zinc/77/98/13/1049779813.db2.gz ROGPMOLSDWQDIX-UHFFFAOYSA-N 2 0 326.528 4.411 20 0 EIADRP C[NH+]1C(C)(C)CC([NH+]2CCC(Oc3ccc(F)cc3)CC2)CC1(C)C ZINC001171637900 1049779881 /nfs/dbraw/zinc/77/98/81/1049779881.db2.gz RNUZKSLCKTUEMU-UHFFFAOYSA-N 2 0 348.506 4.320 20 0 EIADRP CC[NH+]1CCC(CC2CC[NH+]([C@@H]3Cc4cccc(F)c4C3)CC2)CC1 ZINC001171808639 1049808016 /nfs/dbraw/zinc/80/80/16/1049808016.db2.gz BVKHFZVKVNSHOE-HXUWFJFHSA-N 2 0 344.518 4.127 20 0 EIADRP CC1(C)C[C@H]([NH2+]CCCc2ccccn2)CC[N@@H+]1Cc1ccccc1 ZINC001171971919 1049835142 /nfs/dbraw/zinc/83/51/42/1049835142.db2.gz LEVBAVDLKOXTKC-OAQYLSRUSA-N 2 0 337.511 4.047 20 0 EIADRP CC(C)(N[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1ccccn1 ZINC001171975967 1049837620 /nfs/dbraw/zinc/83/76/20/1049837620.db2.gz OFTLBQPBLHBJIW-IBGZPJMESA-N 2 0 337.511 4.350 20 0 EIADRP CC1(C)C[C@H]([NH+]2CC[C@H](c3ccccn3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171983811 1049840248 /nfs/dbraw/zinc/84/02/48/1049840248.db2.gz GWHZCPGRAPDMNJ-LEWJYISDSA-N 2 0 349.522 4.314 20 0 EIADRP CC(C)O[C@@H]1CC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172082431 1049847605 /nfs/dbraw/zinc/84/76/05/1049847605.db2.gz JWBQXKNRWMHQCY-CIAFKFPVSA-N 2 0 342.527 4.071 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CCc3ccc(Br)cc31)C2 ZINC001172100724 1049849689 /nfs/dbraw/zinc/84/96/89/1049849689.db2.gz SAJLWFITLYEEDK-CUSZFKRNSA-N 2 0 349.316 4.041 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@@H]1CCc3ccc(Br)cc31)C2 ZINC001172100726 1049850189 /nfs/dbraw/zinc/85/01/89/1049850189.db2.gz SAJLWFITLYEEDK-KYHPRHEASA-N 2 0 349.316 4.041 20 0 EIADRP F[C@@H]1CCC[C@H]1C[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172067768 1049851377 /nfs/dbraw/zinc/85/13/77/1049851377.db2.gz NRWYAYXCTPVMCF-JRSUCEMESA-N 2 0 330.491 4.300 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CCc1ccc(Cl)c(Cl)c1)C2 ZINC001172103124 1049855726 /nfs/dbraw/zinc/85/57/26/1049855726.db2.gz SEEYHHSUAYRGKP-QKDCVEJESA-N 2 0 327.299 4.141 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H](n1cc(C3CC[NH2+]CC3)c3ccccc31)C2 ZINC001172120926 1049858025 /nfs/dbraw/zinc/85/80/25/1049858025.db2.gz HRMYIYPYHACMCT-REPLKXPHSA-N 2 0 337.511 4.296 20 0 EIADRP C[N@H+](Cc1cccc(C(F)(F)F)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172124293 1049859846 /nfs/dbraw/zinc/85/98/46/1049859846.db2.gz KKJWEGURDRXURG-BJWYYQGGSA-N 2 0 326.406 4.153 20 0 EIADRP Clc1cccc2c1CC[C@@H]([NH2+]C1CC[NH+](C3CCCC3)CC1)C2 ZINC001171022025 1049863128 /nfs/dbraw/zinc/86/31/28/1049863128.db2.gz ISDIAFSEPZERBA-QGZVFWFLSA-N 2 0 332.919 4.194 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@H]2CSc3ccccc3C2)CC1 ZINC001172200073 1049869190 /nfs/dbraw/zinc/86/91/90/1049869190.db2.gz GGSULAYCOMXABS-BHIYHBOVSA-N 2 0 330.541 4.218 20 0 EIADRP CCC(CC)[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CSc2ccccc2C1 ZINC001172198578 1049869384 /nfs/dbraw/zinc/86/93/84/1049869384.db2.gz QIYFMZBLEHLFIW-WDSOQIARSA-N 2 0 332.557 4.464 20 0 EIADRP CCC(CC)[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CSc2ccccc2C1 ZINC001172198577 1049869907 /nfs/dbraw/zinc/86/99/07/1049869907.db2.gz QIYFMZBLEHLFIW-BHIYHBOVSA-N 2 0 332.557 4.464 20 0 EIADRP CC(C)C[NH+]1CCC(C[NH2+][C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171030019 1049875085 /nfs/dbraw/zinc/87/50/85/1049875085.db2.gz KODDRGSJHSWHAJ-GOSISDBHSA-N 2 0 334.935 4.155 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172315280 1049875558 /nfs/dbraw/zinc/87/55/58/1049875558.db2.gz BLJRQWGABSLJAU-UMBQZNGKSA-N 2 0 344.543 4.365 20 0 EIADRP CC[C@H](C)OCC[C@@H](C)[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1 ZINC001172353288 1049892952 /nfs/dbraw/zinc/89/29/52/1049892952.db2.gz MRBISUBCKLSHFM-UXHICEINSA-N 2 0 344.543 4.178 20 0 EIADRP CC(C)OCC[C@@H](C)[N@@H+]1CCC2(C1)CC[NH+](Cc1ccccc1)CC2 ZINC001172450546 1049914141 /nfs/dbraw/zinc/91/41/41/1049914141.db2.gz ISVVISJCXZMORL-HXUWFJFHSA-N 2 0 344.543 4.178 20 0 EIADRP CC(C)COCC[C@H](C)[NH2+]CCC1CC[NH+](Cc2ccccc2)CC1 ZINC001172459675 1049917627 /nfs/dbraw/zinc/91/76/27/1049917627.db2.gz KQAFKZBOCWYDMP-FQEVSTJZSA-N 2 0 346.559 4.330 20 0 EIADRP CCCCCC[C@H](CCCC)[NH2+]CC1(N(C)C)CC[NH+](C)CC1 ZINC001172518006 1049927894 /nfs/dbraw/zinc/92/78/94/1049927894.db2.gz VSXKYGFPADIJOU-IBGZPJMESA-N 2 0 325.585 4.131 20 0 EIADRP C[NH+]1CCC(C2CC[NH+]([C@@H]3CC[C@@H](c4ccccc4)C3)CC2)CC1 ZINC001172563643 1049934938 /nfs/dbraw/zinc/93/49/38/1049934938.db2.gz LNNQEKSDRKNVIY-FGZHOGPDSA-N 2 0 326.528 4.377 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC[C@H]1CCC[N@@H+]1C ZINC001172568173 1049938103 /nfs/dbraw/zinc/93/81/03/1049938103.db2.gz OXUPDLNJZHBXJM-GXTWGEPZSA-N 2 0 330.850 4.013 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[N@H+](C)CC1CC[NH+](C)CC1 ZINC001172573301 1049940310 /nfs/dbraw/zinc/94/03/10/1049940310.db2.gz GYBDOEWPTITXJT-CYBMUJFWSA-N 2 0 344.877 4.213 20 0 EIADRP Cc1cc(N2CC[NH+]([C@@H]3CCC[C@@H](c4ccccc4)C3)CC2)cc[nH+]1 ZINC001172548795 1049947500 /nfs/dbraw/zinc/94/75/00/1049947500.db2.gz IWNLKOJLOWECCP-NHCUHLMSSA-N 2 0 335.495 4.238 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@H](C)CCc2c(F)cc(Cl)cc2F)CC1 ZINC001172578095 1049951903 /nfs/dbraw/zinc/95/19/03/1049951903.db2.gz ZJIILZKAXHCPKD-CYBMUJFWSA-N 2 0 344.877 4.402 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC12CC[NH+](CC1)CC2 ZINC001172579442 1049952044 /nfs/dbraw/zinc/95/20/44/1049952044.db2.gz WDTBGHMUWXAEIF-ZDUSSCGKSA-N 2 0 342.861 4.015 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cnc3ccsc3c2)C1 ZINC000246356504 1049959067 /nfs/dbraw/zinc/95/90/67/1049959067.db2.gz ICLXUSJAOKYSIV-HZPDHXFCSA-N 2 0 331.529 4.315 20 0 EIADRP c1cc(C[NH2+]C2CCC3(CCCC3)CC2)cc(CN2CCOCC2)c1 ZINC001172724210 1049965770 /nfs/dbraw/zinc/96/57/70/1049965770.db2.gz DBZKWUMKVVEJOQ-UHFFFAOYSA-N 2 0 342.527 4.111 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+]C2CCC3(CCCC3)CC2)cc1 ZINC001172725181 1049966650 /nfs/dbraw/zinc/96/66/50/1049966650.db2.gz POQPHOGTSGQPMX-UHFFFAOYSA-N 2 0 330.516 4.220 20 0 EIADRP Clc1ccc2c(c1)C[C@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)C2 ZINC001172706367 1049971122 /nfs/dbraw/zinc/97/11/22/1049971122.db2.gz GNDLAQVWMUYHNP-OAQYLSRUSA-N 2 0 340.898 4.193 20 0 EIADRP Clc1ccc2c(c1)C[C@H]([NH2+]C1CC[NH+](CC3CCCCC3)CC1)C2 ZINC001172715253 1049972634 /nfs/dbraw/zinc/97/26/34/1049972634.db2.gz GRMNECHAXGCMBW-OAQYLSRUSA-N 2 0 346.946 4.442 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1cccs1 ZINC000247073243 1050012112 /nfs/dbraw/zinc/01/21/12/1050012112.db2.gz OJMWLTDNDWHDNS-IXDOHACOSA-N 2 0 344.524 4.208 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(-c3csc(C)n3)s2)[C@@H](C)C1 ZINC000248044620 1050039862 /nfs/dbraw/zinc/03/98/62/1050039862.db2.gz UPSCYLKKUSDFQV-XJKSGUPXSA-N 2 0 349.569 4.042 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000248397944 1050054183 /nfs/dbraw/zinc/05/41/83/1050054183.db2.gz ILTAOIGWUOPEKF-LNLFQRSKSA-N 2 0 330.516 4.389 20 0 EIADRP CCc1nc2c(s1)[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C3CCC3)C1)CCC2 ZINC000248408982 1050055457 /nfs/dbraw/zinc/05/54/57/1050055457.db2.gz WBEJTDBHONPFKX-YQQAZPJKSA-N 2 0 347.572 4.326 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([N@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172827719 1050166311 /nfs/dbraw/zinc/16/63/11/1050166311.db2.gz DJHSADCWHOYEPM-ACRUOGEOSA-N 2 0 328.544 4.470 20 0 EIADRP CC(C)(C)CC(C)(C)[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC001177185973 1050166995 /nfs/dbraw/zinc/16/69/95/1050166995.db2.gz APKIHBKYPVTYPQ-UHFFFAOYSA-N 2 0 332.532 4.466 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2ccc(F)cc2C(F)(F)F)CC1 ZINC001177294178 1050176890 /nfs/dbraw/zinc/17/68/90/1050176890.db2.gz HHEIGIGBXHTMPW-UHFFFAOYSA-N 2 0 346.412 4.446 20 0 EIADRP CCC1CCC([NH2+]Cc2ccccc2OCC[NH+](CC)CC)CC1 ZINC001177294897 1050178637 /nfs/dbraw/zinc/17/86/37/1050178637.db2.gz REKWBBVVNHHNDA-UHFFFAOYSA-N 2 0 332.532 4.466 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C)CC2 ZINC001172843754 1050181762 /nfs/dbraw/zinc/18/17/62/1050181762.db2.gz OKODCFULFVWSGI-FKBYEOEOSA-N 2 0 326.528 4.191 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H]([NH2+][C@H](C)Cc2c(F)cccc2Cl)[C@H](C)C1 ZINC001172849529 1050188481 /nfs/dbraw/zinc/18/84/81/1050188481.db2.gz NPSIXVIBKSUVMT-HBUWYVDXSA-N 2 0 326.887 4.119 20 0 EIADRP CCc1nc2c(s1)[C@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)CCC2 ZINC000090586938 1050190156 /nfs/dbraw/zinc/19/01/56/1050190156.db2.gz RQXDKKINSMBAAX-HZPDHXFCSA-N 2 0 335.561 4.041 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)[C@H](C)Cc2ccc(F)cc2Cl)CC1 ZINC001172869331 1050207887 /nfs/dbraw/zinc/20/78/87/1050207887.db2.gz ZKLOXGVHKKOTRY-OAHLLOKOSA-N 2 0 340.914 4.462 20 0 EIADRP C[C@@H](CSc1ccc(Cl)cc1)[NH2+]CCCC[NH+]1CCCC1 ZINC001172875400 1050215051 /nfs/dbraw/zinc/21/50/51/1050215051.db2.gz ONDNWTKZVXCJQA-HNNXBMFYSA-N 2 0 326.937 4.286 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H](C)CSc2ccc(Cl)cc2)CC1 ZINC001172876271 1050216671 /nfs/dbraw/zinc/21/66/71/1050216671.db2.gz YQFJMRCELPXJER-CQSZACIVSA-N 2 0 326.937 4.285 20 0 EIADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2cccc(Cl)c2Br)CC1 ZINC001206303142 1050217661 /nfs/dbraw/zinc/21/76/61/1050217661.db2.gz BQKGNFJEPUPLAJ-OAHLLOKOSA-N 2 0 345.712 4.053 20 0 EIADRP C[NH+](C)CCc1ccc(Nc2ccc(C3CC[NH+](C)CC3)cc2)cc1 ZINC001212691325 1050241301 /nfs/dbraw/zinc/24/13/01/1050241301.db2.gz KPKCFLDXGGUUSF-UHFFFAOYSA-N 2 0 337.511 4.344 20 0 EIADRP Cc1cc(Br)cc(C[NH2+]Cc2cccc(C[NH+](C)C)c2)c1 ZINC000774976402 1050243226 /nfs/dbraw/zinc/24/32/26/1050243226.db2.gz MRCRVIKKPXJAKD-UHFFFAOYSA-N 2 0 347.300 4.109 20 0 EIADRP C[NH+](C)CCCCCCC[NH2+]Cc1c(Cl)ccc2cccnc21 ZINC001177537066 1050244678 /nfs/dbraw/zinc/24/46/78/1050244678.db2.gz KJKAKVBZHCBRLR-UHFFFAOYSA-N 2 0 333.907 4.490 20 0 EIADRP CC(C)(C)C[NH+]1CCC(C[NH2+]C2CCC3(CCOCC3)CC2)CC1 ZINC001173044472 1050270710 /nfs/dbraw/zinc/27/07/10/1050270710.db2.gz CGVWVCANDMDWFW-UHFFFAOYSA-N 2 0 336.564 4.074 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1C1CCC2(CCOCC2)CC1 ZINC001173048797 1050274297 /nfs/dbraw/zinc/27/42/97/1050274297.db2.gz VEALEIWAGUGBCQ-PMACEKPBSA-N 2 0 334.548 4.065 20 0 EIADRP CCCOC1CCC([NH2+]C2CC[NH+](C[C@H]3CC=CCC3)CC2)CC1 ZINC001173095283 1050288385 /nfs/dbraw/zinc/28/83/85/1050288385.db2.gz BIWSQJHIKFVOCL-JSOIOWGOSA-N 2 0 334.548 4.135 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2cc(F)c(F)cc2Cl)CC1 ZINC001173102607 1050306272 /nfs/dbraw/zinc/30/62/72/1050306272.db2.gz BGOYLDJAECUJLE-UHFFFAOYSA-N 2 0 330.850 4.361 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2(Cc3ccccc3OC)CCC2)CC1 ZINC001173106088 1050308210 /nfs/dbraw/zinc/30/82/10/1050308210.db2.gz HDFNDHPIXXIFCI-UHFFFAOYSA-N 2 0 344.543 4.403 20 0 EIADRP CC[NH+](CC)C1CCC([N@H+](CC)CCc2ccc(OC)cc2)CC1 ZINC001173113857 1050309458 /nfs/dbraw/zinc/30/94/58/1050309458.db2.gz NDPWJVZUKSMWAC-UHFFFAOYSA-N 2 0 332.532 4.213 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CC[C@@H](Oc3ccccc3C)C2)CC1 ZINC001173112176 1050310068 /nfs/dbraw/zinc/31/00/68/1050310068.db2.gz ROXHEIFSZURQTL-SOAGJPPSSA-N 2 0 330.516 4.101 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@H](Sc3ccncc3)C2)CC1 ZINC001173114701 1050310633 /nfs/dbraw/zinc/31/06/33/1050310633.db2.gz QMJNCKDAZSINCW-QLOJAFMTSA-N 2 0 347.572 4.291 20 0 EIADRP CC[NH+](CC)C1CCC([N@H+](CC(=O)c2ccccc2)C(C)C)CC1 ZINC001173113260 1050311151 /nfs/dbraw/zinc/31/11/51/1050311151.db2.gz LWMCHSOWUZRHQX-UHFFFAOYSA-N 2 0 330.516 4.233 20 0 EIADRP Cc1cc(C)cc(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC001177835744 1050312691 /nfs/dbraw/zinc/31/26/91/1050312691.db2.gz VSAVRRDXEZICGM-UHFFFAOYSA-N 2 0 338.495 4.068 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@H]2Cc2ccc(F)cc2)CC1 ZINC001173117468 1050315247 /nfs/dbraw/zinc/31/52/47/1050315247.db2.gz MVJVJSOQYJVSGR-CBNMVNINSA-N 2 0 332.507 4.486 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+][C@@H]3CCO[C@@H](C)C3)[C@H](C)C2)CC[C@@H]1[NH3+] ZINC001173170155 1050347136 /nfs/dbraw/zinc/34/71/36/1050347136.db2.gz LYMXSDHTMGCEQE-FKGJNOFZSA-N 2 0 336.564 4.102 20 0 EIADRP CC[C@H]1CC[C@H]([N@H+](Cc2ccccc2OC)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173272788 1050391437 /nfs/dbraw/zinc/39/14/37/1050391437.db2.gz WWCPNVZHRMSPLC-LEAZDLGRSA-N 2 0 330.516 4.346 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2cccc(F)c2F)C[N@@H+]1Cc1ccccc1 ZINC001178208286 1050404370 /nfs/dbraw/zinc/40/43/70/1050404370.db2.gz KYQLEIDDVKHLAH-AEFFLSMTSA-N 2 0 344.449 4.355 20 0 EIADRP CC[N@H+](CCC1CC[NH+](C[C@H]2CC2(Cl)Cl)CC1)CC(C)C ZINC000773730258 1050415696 /nfs/dbraw/zinc/41/56/96/1050415696.db2.gz HGGIWIURGJIUHP-MRXNPFEDSA-N 2 0 335.363 4.260 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cccnc2Cl)CC1)CC(C)C ZINC000773730304 1050415827 /nfs/dbraw/zinc/41/58/27/1050415827.db2.gz ILCMJZAPDQQZQY-UHFFFAOYSA-N 2 0 337.939 4.315 20 0 EIADRP CC(C)Cc1ncc(C[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)s1 ZINC001178280405 1050426545 /nfs/dbraw/zinc/42/65/45/1050426545.db2.gz BGEBEESMVMWZOJ-UHFFFAOYSA-N 2 0 349.588 4.474 20 0 EIADRP Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)cc1 ZINC001178284840 1050428045 /nfs/dbraw/zinc/42/80/45/1050428045.db2.gz CTZVDLJPZFNAEF-DNVJHFABSA-N 2 0 334.507 4.385 20 0 EIADRP C[C@H]([NH2+]Cc1cccc2c1CCC2)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001178331334 1050439459 /nfs/dbraw/zinc/43/94/59/1050439459.db2.gz QCNMOXNMEMRELY-PGRDOPGGSA-N 2 0 334.507 4.176 20 0 EIADRP Cc1csc([C@@H](C)C[NH2+]CC(C)(C)C[N@H+](C)Cc2ccccc2)n1 ZINC001178445369 1050459670 /nfs/dbraw/zinc/45/96/70/1050459670.db2.gz VXHRNEOBIDIIFC-INIZCTEOSA-N 2 0 345.556 4.303 20 0 EIADRP COC(=O)CCCC[C@@H](C)[N@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173445650 1050462811 /nfs/dbraw/zinc/46/28/11/1050462811.db2.gz NPEUVRBXFQXUSA-ZHALLVOQSA-N 2 0 338.536 4.013 20 0 EIADRP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]CC12CC[NH+](CC1)CC2 ZINC001173538912 1050475925 /nfs/dbraw/zinc/47/59/25/1050475925.db2.gz JLWKXHYZSFYPEB-AWEZNQCLSA-N 2 0 341.326 4.390 20 0 EIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(Cl)s1 ZINC000092856921 1050481192 /nfs/dbraw/zinc/48/11/92/1050481192.db2.gz PJYJDVCUJAQHLB-ZDUSSCGKSA-N 2 0 335.904 4.364 20 0 EIADRP CC[N@H+]1C[C@@H]2C[NH+]([C@H](C)CCc3ccc(Cl)c(Cl)c3)C[C@@H]2C1 ZINC001173551149 1050487426 /nfs/dbraw/zinc/48/74/26/1050487426.db2.gz QYJWWIJXKUVYGU-BMFZPTHFSA-N 2 0 341.326 4.198 20 0 EIADRP CCOC(=O)C[C@@H]1CC[C@@H]([NH2+]CCCCCCCCCCC[NH3+])C1 ZINC001173654093 1050535870 /nfs/dbraw/zinc/53/58/70/1050535870.db2.gz RLVMMZGPRJMAIA-RTBURBONSA-N 2 0 340.552 4.168 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccccn2)ccc1OC ZINC000182194242 1050538115 /nfs/dbraw/zinc/53/81/15/1050538115.db2.gz DSVNDUSNPXTJJO-IRXDYDNUSA-N 2 0 341.499 4.344 20 0 EIADRP CCC[NH+]1C[C@H]2C[NH+](C3CCC4(CCc5ccccc54)CC3)C[C@@H]2C1 ZINC001173690880 1050542633 /nfs/dbraw/zinc/54/26/33/1050542633.db2.gz CENHUYCRFGJCRZ-VMDDHHINSA-N 2 0 338.539 4.087 20 0 EIADRP CC[N@H+](CCC[NH2+][C@H]1CCc2ccc(OC)cc2C1)C1CCCCC1 ZINC001179090989 1050629859 /nfs/dbraw/zinc/62/98/59/1050629859.db2.gz MVLUQULHJWRAJG-FQEVSTJZSA-N 2 0 344.543 4.187 20 0 EIADRP CO[C@@H]1CCC[C@@H]([NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001179278723 1050669188 /nfs/dbraw/zinc/66/91/88/1050669188.db2.gz YHBCDTKZVXKOED-FGZHOGPDSA-N 2 0 344.543 4.226 20 0 EIADRP CC(C)[C@H]1C[C@H]([NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC001179277990 1050669332 /nfs/dbraw/zinc/66/93/32/1050669332.db2.gz PZDFFLNSSHDBDE-FGZHOGPDSA-N 2 0 344.543 4.082 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1ccccc1N(C)C ZINC000093942347 1050723767 /nfs/dbraw/zinc/72/37/67/1050723767.db2.gz KKPAILRFHCQAGF-SFHVURJKSA-N 2 0 339.527 4.444 20 0 EIADRP FC(F)(F)CCC[N@@H+]1CC[C@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001179864171 1050809629 /nfs/dbraw/zinc/80/96/29/1050809629.db2.gz UNNOHOGNSPZZFI-SFHVURJKSA-N 2 0 340.433 4.317 20 0 EIADRP CCNc1ccccc1C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC001180123692 1050892528 /nfs/dbraw/zinc/89/25/28/1050892528.db2.gz DBATYEFKMSYONB-UHFFFAOYSA-N 2 0 329.532 4.206 20 0 EIADRP c1cc2c(cc1C[NH+]1CCC(C[NH+]3CCCCCC3)CC1)CCCO2 ZINC001180125186 1050893001 /nfs/dbraw/zinc/89/30/01/1050893001.db2.gz VCOMISZYCHJIES-UHFFFAOYSA-N 2 0 342.527 4.100 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc3c(n2)CCC3)CC1 ZINC001180225305 1050920916 /nfs/dbraw/zinc/92/09/16/1050920916.db2.gz QDSYIINWSJOSGH-GOSISDBHSA-N 2 0 341.543 4.047 20 0 EIADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC001180302567 1050943878 /nfs/dbraw/zinc/94/38/78/1050943878.db2.gz ZLYNMXDPUBINFN-KDXIVRHGSA-N 2 0 326.528 4.455 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21)C1CCCC1 ZINC001180301652 1050944703 /nfs/dbraw/zinc/94/47/03/1050944703.db2.gz OUDFYHZMGVUPNG-GUGJDKNPSA-N 2 0 326.528 4.455 20 0 EIADRP Cc1cc(C)cc(CC[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC001180350255 1050964546 /nfs/dbraw/zinc/96/45/46/1050964546.db2.gz WYNODVIKEGDCLT-REWPJTCUSA-N 2 0 336.523 4.346 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C2CCSCC2)cc1C[NH+]1CCCCC1 ZINC000183200649 1051013148 /nfs/dbraw/zinc/01/31/48/1051013148.db2.gz BCULLTSCEAWBKP-INIZCTEOSA-N 2 0 348.556 4.227 20 0 EIADRP COc1ccc(C[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)c2ccccc12 ZINC000620109492 1051025830 /nfs/dbraw/zinc/02/58/30/1051025830.db2.gz KHZHPTGZUARIME-SFHVURJKSA-N 2 0 340.511 4.450 20 0 EIADRP C[C@@]1(c2ccccc2)CC[C@@H]([NH+]2CCC([NH+]3CCCCC3)CC2)C1 ZINC001180540033 1051028416 /nfs/dbraw/zinc/02/84/16/1051028416.db2.gz FVJWQLOCJVAOIS-FGZHOGPDSA-N 2 0 326.528 4.447 20 0 EIADRP COc1ccc(SCC[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC001180795292 1051080413 /nfs/dbraw/zinc/08/04/13/1051080413.db2.gz UOTZOKJBQUHDPF-SJORKVTESA-N 2 0 348.556 4.030 20 0 EIADRP CCN(Cc1ccc(Cl)nc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076154976 1051117705 /nfs/dbraw/zinc/11/77/05/1051117705.db2.gz NXIQTPMSWCYOOB-LJQANCHMSA-N 2 0 343.902 4.079 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CCc2cccs2)ccc1OC ZINC000775362108 1051128004 /nfs/dbraw/zinc/12/80/04/1051128004.db2.gz FMCOVMPTNBNZIA-INIZCTEOSA-N 2 0 346.540 4.492 20 0 EIADRP CC(C)(C)[C@]1(C[NH2+][C@H]2CSC2(C)C)CC[N@H+](Cc2ccccc2)C1 ZINC001181204823 1051180228 /nfs/dbraw/zinc/18/02/28/1051180228.db2.gz IMBBSNPNWGJUDA-RXVVDRJESA-N 2 0 346.584 4.408 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)[C@H]1CC1(C)C ZINC001181656160 1051269719 /nfs/dbraw/zinc/26/97/19/1051269719.db2.gz PJGHGOIWTFLYIA-UXHICEINSA-N 2 0 330.516 4.074 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)[C@H]1CCCC[C@H]1C ZINC001181656517 1051271917 /nfs/dbraw/zinc/27/19/17/1051271917.db2.gz SBPXSERFGALTKE-HMFYCAOWSA-N 2 0 344.543 4.464 20 0 EIADRP C[C@H](C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)c1ccccc1 ZINC000716654491 1051276413 /nfs/dbraw/zinc/27/64/13/1051276413.db2.gz HYVSFXPFRWMOLX-IYSOMAHNSA-N 2 0 334.507 4.433 20 0 EIADRP COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc[nH]2)cc1C[NH+]1CCCCC1 ZINC000775425294 1051317139 /nfs/dbraw/zinc/31/71/39/1051317139.db2.gz XOENLWBRRLWMMG-IAGOWNOFSA-N 2 0 341.499 4.421 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cc1 ZINC000154873252 1051346964 /nfs/dbraw/zinc/34/69/64/1051346964.db2.gz UFPRYDRLQIXZSL-KRWDZBQOSA-N 2 0 326.484 4.386 20 0 EIADRP CC(C)[N@@H+]1CC[C@H](C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C)C1 ZINC001181982681 1051362879 /nfs/dbraw/zinc/36/28/79/1051362879.db2.gz JTSZWKLVWYKHCD-INIZCTEOSA-N 2 0 342.508 4.302 20 0 EIADRP CC(C)[C@H]1CCC[N@@H+]1CCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC001191204638 1051385646 /nfs/dbraw/zinc/38/56/46/1051385646.db2.gz UGOVLDFYEGCWGA-JOCHJYFZSA-N 2 0 328.544 4.452 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1cncs1 ZINC000268835722 1051396931 /nfs/dbraw/zinc/39/69/31/1051396931.db2.gz SFOQRWXVGBYLHK-HZPDHXFCSA-N 2 0 329.513 4.368 20 0 EIADRP c1ccc([C@@H]2C[C@@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)CCO2)cc1 ZINC000155269389 1051398668 /nfs/dbraw/zinc/39/86/68/1051398668.db2.gz RHVSVJWHKBVIDY-UNMCSNQZSA-N 2 0 342.527 4.293 20 0 EIADRP C[C@@H](CCc1ccccc1)[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001191233026 1051403780 /nfs/dbraw/zinc/40/37/80/1051403780.db2.gz KEEDDUCXBREVGG-NZQKXSOJSA-N 2 0 336.523 4.462 20 0 EIADRP C[N@@H+]1CCC[C@H](CC[NH2+]CCCCc2cccc(C(F)(F)F)c2)C1 ZINC001182251083 1051443649 /nfs/dbraw/zinc/44/36/49/1051443649.db2.gz LTJIVSLISCBGQP-QGZVFWFLSA-N 2 0 342.449 4.350 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2cc[nH]c2c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311009194 1051452072 /nfs/dbraw/zinc/45/20/72/1051452072.db2.gz WXUZODRPQNQOLU-LAUBAEHRSA-N 2 0 333.479 4.168 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCc2c(Cl)cccc2Cl)C[C@@H]1C ZINC001191417638 1051452548 /nfs/dbraw/zinc/45/25/48/1051452548.db2.gz PZSKEHNRLJOPMB-UONOGXRCSA-N 2 0 329.315 4.341 20 0 EIADRP C[C@H](CC[NH2+][C@H]1CC[N@H+](C)[C@@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000155863113 1051469544 /nfs/dbraw/zinc/46/95/44/1051469544.db2.gz NEGOSMYXOVFGLO-KEYYUXOJSA-N 2 0 328.422 4.271 20 0 EIADRP CC1(C)C(C[NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)C1(C)C ZINC000716674266 1051499504 /nfs/dbraw/zinc/49/95/04/1051499504.db2.gz XAOUHSXPEYKUCH-FHWLQOOXSA-N 2 0 326.528 4.311 20 0 EIADRP CCC1(O)CCC([NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)CC1 ZINC000671116498 1051687228 /nfs/dbraw/zinc/68/72/28/1051687228.db2.gz NSLWSNNRWRRECF-UHFFFAOYSA-N 2 0 344.543 4.103 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc2c(c1)OCCCO2 ZINC000157954604 1051687238 /nfs/dbraw/zinc/68/72/38/1051687238.db2.gz CTIPVIOBBJWKRF-ROUUACIJSA-N 2 0 346.515 4.011 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(SCC(F)F)cc1 ZINC000158103381 1051711936 /nfs/dbraw/zinc/71/19/36/1051711936.db2.gz BFFSAQLGOJJYKT-ZIAGYGMSSA-N 2 0 328.472 4.036 20 0 EIADRP C[C@@H](CCc1c[nH]c2ccccc12)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC001183074268 1051774529 /nfs/dbraw/zinc/77/45/29/1051774529.db2.gz CWGIHRTYRVKUCO-KRWDZBQOSA-N 2 0 339.527 4.201 20 0 EIADRP C[C@H](CC[NH2+]CC1(c2ccccc2)CC[NH+](C)CC1)c1ccccc1 ZINC001183355496 1051825912 /nfs/dbraw/zinc/82/59/12/1051825912.db2.gz RBQFDTFNVSOUFX-HXUWFJFHSA-N 2 0 336.523 4.433 20 0 EIADRP C[N@H+](CCCC[NH+]1CCCCC1)Cc1cccc(OC2CC2)c1F ZINC001183511917 1051861415 /nfs/dbraw/zinc/86/14/15/1051861415.db2.gz VRWJLGHGKQQPGL-UHFFFAOYSA-N 2 0 334.479 4.065 20 0 EIADRP C[C@@]1([NH3+])CCC[N@H+](Cc2ccc3cc(Br)ccc3c2)CC1 ZINC001205274271 1051864679 /nfs/dbraw/zinc/86/46/79/1051864679.db2.gz UPMQIGPKBUNHOA-GOSISDBHSA-N 2 0 347.300 4.306 20 0 EIADRP C[NH+](C)[C@@H]1CC[C@H]2C[N@H+](Cc3cc(F)cc(C(F)(F)F)c3)C[C@@H]2C1 ZINC001184303251 1051982802 /nfs/dbraw/zinc/98/28/02/1051982802.db2.gz NZSBTSAGSRRTRN-GRDNDAEWSA-N 2 0 344.396 4.007 20 0 EIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)c1 ZINC000163574376 1051996216 /nfs/dbraw/zinc/99/62/16/1051996216.db2.gz RNZOCDSJJSYAQY-QGZVFWFLSA-N 2 0 345.531 4.054 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+]C2CCN(c3ccccc3)CC2)CC1 ZINC000163587356 1051997892 /nfs/dbraw/zinc/99/78/92/1051997892.db2.gz KCWDDKPVHRXYLL-UHFFFAOYSA-N 2 0 343.559 4.003 20 0 EIADRP Cc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)CC34CCC(CC3)C4)C2)s1 ZINC001194152443 1052089410 /nfs/dbraw/zinc/08/94/10/1052089410.db2.gz BCRJKCUBJZEZDN-FDYSRKEFSA-N 2 0 332.557 4.391 20 0 EIADRP CCC[C@@H]([NH2+]C[C@H]1CN(Cc2ccccc2)CCCO1)C(C)(C)C ZINC001194426547 1052147248 /nfs/dbraw/zinc/14/72/48/1052147248.db2.gz LBWINWMPIAIAMK-VQTJNVASSA-N 2 0 332.532 4.082 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cc(Cl)ccc1O ZINC000184901179 1052298002 /nfs/dbraw/zinc/29/80/02/1052298002.db2.gz PGSKSQCAYGIBEG-OAHLLOKOSA-N 2 0 344.886 4.492 20 0 EIADRP c1nc(-c2ccccc2)sc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000171388830 1052421828 /nfs/dbraw/zinc/42/18/28/1052421828.db2.gz QEMMKDQTJWXTRA-UHFFFAOYSA-N 2 0 341.524 4.118 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2cccc3n[nH]cc32)C1 ZINC000623357957 1052630964 /nfs/dbraw/zinc/63/09/64/1052630964.db2.gz IXFVMUTVALEXQW-QGZVFWFLSA-N 2 0 348.494 4.085 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1CN[C@H]1CC[NH+](C)C(C)(C)C1 ZINC000623357838 1052632093 /nfs/dbraw/zinc/63/20/93/1052632093.db2.gz CAZRBZRLHWWQQM-RXVVDRJESA-N 2 0 343.559 4.023 20 0 EIADRP C[C@H]([NH2+]C1(CN[C@@H]2CC[N@H+](C)C(C)(C)C2)CCCC1)c1ccccc1 ZINC000623427613 1052654913 /nfs/dbraw/zinc/65/49/13/1052654913.db2.gz FTQLKYLPBODQAX-AZUAARDMSA-N 2 0 343.559 4.112 20 0 EIADRP C[C@@H](C[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(C(F)(F)F)cc1 ZINC000623503878 1052668144 /nfs/dbraw/zinc/66/81/44/1052668144.db2.gz RFACSZBYBDEXGN-XJKSGUPXSA-N 2 0 328.422 4.271 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CCOc1ccccc1-c1ccccc1 ZINC000177933360 1052694793 /nfs/dbraw/zinc/69/47/93/1052694793.db2.gz RGILGGXUTLPYBU-DBXWQHBBSA-N 2 0 338.495 4.051 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](C[C@@H](OC)C2CCCCC2)CC1 ZINC001307681292 1052730676 /nfs/dbraw/zinc/73/06/76/1052730676.db2.gz XVZPQBQRYKUCLX-OAQYLSRUSA-N 2 0 338.580 4.416 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1cc(-c2ccccc2)n(C)n1 ZINC000623849092 1052821950 /nfs/dbraw/zinc/82/19/50/1052821950.db2.gz VTTBUGXPEKVLRC-MSOLQXFVSA-N 2 0 342.531 4.248 20 0 EIADRP Cc1ccc(Br)cc1[C@H](C)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000623866016 1052825944 /nfs/dbraw/zinc/82/59/44/1052825944.db2.gz IJSORYRKXMLZGK-IMJJTQAJSA-N 2 0 337.305 4.035 20 0 EIADRP Cc1ccc(Br)cc1[C@H](C)[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000623866015 1052826090 /nfs/dbraw/zinc/82/60/90/1052826090.db2.gz IJSORYRKXMLZGK-CWRNSKLLSA-N 2 0 337.305 4.035 20 0 EIADRP CC[NH+](CC)Cc1cccc(CN[C@H]2CCCc3scnc32)c1 ZINC000623867323 1052830083 /nfs/dbraw/zinc/83/00/83/1052830083.db2.gz YBNRKUSUSILHAM-KRWDZBQOSA-N 2 0 329.513 4.152 20 0 EIADRP CC[C@H](C)c1ccc([C@H](C)[NH2+][C@@H]2CCN(C3CC[NH+](C)CC3)C2)cc1 ZINC000623893124 1052830566 /nfs/dbraw/zinc/83/05/66/1052830566.db2.gz GANPGBCJOPKCKM-BBTUJRGHSA-N 2 0 343.559 4.019 20 0 EIADRP CC[C@@H](C)Oc1cc(C[NH2+]C[C@@H](C)C[NH+]2CCCCC2)ccc1OC ZINC000624019773 1052853416 /nfs/dbraw/zinc/85/34/16/1052853416.db2.gz ZAKIFPTXTZLEKB-QZTJIDSGSA-N 2 0 348.531 4.084 20 0 EIADRP Cc1ccc(C(C)(C)C[NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)nc1 ZINC000624112846 1052865806 /nfs/dbraw/zinc/86/58/06/1052865806.db2.gz NHDFNVCOWVQAJD-PXNSSMCTSA-N 2 0 343.559 4.300 20 0 EIADRP CCOc1cccc2cc([C@@H](C)[NH2+]CCC3CC[NH+](C)CC3)oc21 ZINC000181698781 1052893643 /nfs/dbraw/zinc/89/36/43/1052893643.db2.gz IIBKIMMEGCFDGU-OAHLLOKOSA-N 2 0 330.472 4.214 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CCc2csc(-c3ccc(Cl)cc3)n2)CC[N@@H+]1C ZINC000181798873 1052898108 /nfs/dbraw/zinc/89/81/08/1052898108.db2.gz KQODMOVTXGVFBR-XJKSGUPXSA-N 2 0 349.931 4.078 20 0 EIADRP Fc1ccc2c(c1)CCC[C@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000183160113 1052965066 /nfs/dbraw/zinc/96/50/66/1052965066.db2.gz SMGFLLMDWGBFBM-OAQYLSRUSA-N 2 0 339.458 4.104 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1cccc(OCc2ccccc2)c1 ZINC000381210922 1053058086 /nfs/dbraw/zinc/05/80/86/1053058086.db2.gz UMPYGVHSJCBSQG-JBYIUTFZSA-N 2 0 338.495 4.084 20 0 EIADRP COc1ccc(CC[C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000119684117 1053090276 /nfs/dbraw/zinc/09/02/76/1053090276.db2.gz DXAZOJNMBLSJMM-NLWGTHIKSA-N 2 0 344.543 4.259 20 0 EIADRP FC1(F)CCCC[C@@H]1C[N@@H+]1C[C@@H]2CC[NH+](Cc3ccccc3)C[C@@H]2C1 ZINC000381874520 1053111938 /nfs/dbraw/zinc/11/19/38/1053111938.db2.gz JUQCFDHXBDZFCH-XUVXKRRUSA-N 2 0 348.481 4.266 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(Cl)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000382069725 1053135642 /nfs/dbraw/zinc/13/56/42/1053135642.db2.gz RWYAIVIHTITHSO-VQIMIIECSA-N 2 0 328.887 4.340 20 0 EIADRP c1ccc(C[C@H]2CCC[C@H]2[NH2+]C2CC[NH+](C3CCCCC3)CC2)nc1 ZINC000850387302 1053156590 /nfs/dbraw/zinc/15/65/90/1053156590.db2.gz QQGGLMOQBNZEKR-XMSQKQJNSA-N 2 0 341.543 4.180 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)CCC2 ZINC000339070520 1053341177 /nfs/dbraw/zinc/34/11/77/1053341177.db2.gz ZJWQYWOQQWEPRG-NRFANRHFSA-N 2 0 338.495 4.103 20 0 EIADRP C[C@H](Cc1ccc(F)cc1)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000385671935 1053540011 /nfs/dbraw/zinc/54/00/11/1053540011.db2.gz DXSHQXWENFQPIQ-OPYAIIAOSA-N 2 0 340.486 4.257 20 0 EIADRP COc1ccc2c(NC[C@H](c3cccs3)[NH+](C)C)cc[nH+]c2c1 ZINC000765452345 1053555683 /nfs/dbraw/zinc/55/56/83/1053555683.db2.gz FIDRKWZIJNXDGN-QGZVFWFLSA-N 2 0 327.453 4.020 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccc(Cl)c3cccnc23)CC1 ZINC000865765460 1053587894 /nfs/dbraw/zinc/58/78/94/1053587894.db2.gz WCNLULMJQIPHQZ-UHFFFAOYSA-N 2 0 331.891 4.241 20 0 EIADRP c1ccc(C[C@@H]2CCC[C@H]2[NH2+]CCCCC[NH+]2CCCCC2)nc1 ZINC000852566181 1053589837 /nfs/dbraw/zinc/58/98/37/1053589837.db2.gz DUYPSFSAHBFDAQ-PZJWPPBQSA-N 2 0 329.532 4.039 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](c2ccccn2)C(C)C)c1 ZINC000866237027 1053658668 /nfs/dbraw/zinc/65/86/68/1053658668.db2.gz GUGNOZWRHUHACN-NRFANRHFSA-N 2 0 325.500 4.410 20 0 EIADRP c1ccc(CSCC[NH2+]C2CCC([NH+]3CCCCC3)CC2)cc1 ZINC000797602562 1053668370 /nfs/dbraw/zinc/66/83/70/1053668370.db2.gz NBYMABPYSXFKAZ-UHFFFAOYSA-N 2 0 332.557 4.307 20 0 EIADRP C[C@H]([NH2+][C@H]1CCc2c1cccc2F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386578557 1053780116 /nfs/dbraw/zinc/78/01/16/1053780116.db2.gz ZGJCZCGMRKYEEG-CECAUBDESA-N 2 0 338.470 4.313 20 0 EIADRP CC[NH+](CC)Cc1cccc(N2C[C@@H](CC[NH3+])c3ccccc32)c1F ZINC001168547557 1053780564 /nfs/dbraw/zinc/78/05/64/1053780564.db2.gz FNGABIHKXBCKQY-MRXNPFEDSA-N 2 0 341.474 4.252 20 0 EIADRP Cn1cncc1CCC[N@@H+]1CC[C@@H](c2ccccc2Cl)C1(C)C ZINC001197313424 1053872168 /nfs/dbraw/zinc/87/21/68/1053872168.db2.gz ACPDFIQARNUJBK-KRWDZBQOSA-N 2 0 331.891 4.274 20 0 EIADRP CC(C)(C)OC[C@H]1CCC[N@@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001197630150 1053967303 /nfs/dbraw/zinc/96/73/03/1053967303.db2.gz MIIGCAQNGRNRIJ-OAQYLSRUSA-N 2 0 344.543 4.452 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCOC3(CCCC3)C2)c1 ZINC000872025963 1054340268 /nfs/dbraw/zinc/34/02/68/1054340268.db2.gz WQOLGIFZMPLIHP-FQEVSTJZSA-N 2 0 330.516 4.110 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCOC3(CCCC3)C2)c1 ZINC000872026461 1054344426 /nfs/dbraw/zinc/34/44/26/1054344426.db2.gz BIRSYYQICMPVIH-FQEVSTJZSA-N 2 0 330.516 4.108 20 0 EIADRP COc1ccsc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@H]1C ZINC001199267233 1054376783 /nfs/dbraw/zinc/37/67/83/1054376783.db2.gz NDDGJCMFBDJIEL-MRXNPFEDSA-N 2 0 344.524 4.421 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc(CC(F)(F)F)cc2)C1 ZINC001199346356 1054388934 /nfs/dbraw/zinc/38/89/34/1054388934.db2.gz ZDTOYXPKGINQLJ-MRXNPFEDSA-N 2 0 342.449 4.393 20 0 EIADRP C[C@H](C[NH2+]C[C@H](C)C[NH+]1CCCC1)Cc1ccc(C(C)(C)C)cc1 ZINC001199403019 1054406903 /nfs/dbraw/zinc/40/69/03/1054406903.db2.gz CPARZYLOOUFSPJ-OALUTQOASA-N 2 0 330.560 4.484 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CCO1 ZINC001199629672 1054434925 /nfs/dbraw/zinc/43/49/25/1054434925.db2.gz LRCRXIZUNPPZKK-YLJYHZDGSA-N 2 0 330.516 4.108 20 0 EIADRP c1nc(C2CC2)sc1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC001199679391 1054443874 /nfs/dbraw/zinc/44/38/74/1054443874.db2.gz VPQJZDILMUJXJR-UHFFFAOYSA-N 2 0 341.524 4.022 20 0 EIADRP Cc1nc(CNCc2cccc(C[NH+]3CCCCCC3)c2)cs1 ZINC001199896907 1054483784 /nfs/dbraw/zinc/48/37/84/1054483784.db2.gz SSXWSCAXTUPFCI-UHFFFAOYSA-N 2 0 329.513 4.117 20 0 EIADRP Cc1nc(C(C)C)sc1[C@@H](C)[N@H+](C)Cc1cc2c(s1)CC[NH2+]C2 ZINC000873206965 1054508652 /nfs/dbraw/zinc/50/86/52/1054508652.db2.gz GYGIFIKACZOJHI-CYBMUJFWSA-N 2 0 349.569 4.475 20 0 EIADRP c1c(C[NH2+]Cc2ccccc2OC2CCCC2)sc2c1C[NH2+]CC2 ZINC000873211495 1054509872 /nfs/dbraw/zinc/50/98/72/1054509872.db2.gz AGFTYJASCVUBKN-UHFFFAOYSA-N 2 0 342.508 4.005 20 0 EIADRP FC(F)n1cc(C[NH2+]C2CC[NH+](CC3CC3)CC2)c2ccccc21 ZINC000858537926 1054510208 /nfs/dbraw/zinc/51/02/08/1054510208.db2.gz YPQULRYHZLENFI-UHFFFAOYSA-N 2 0 333.426 4.000 20 0 EIADRP CC(C)c1ccc(C2(O)CCC([NH2+][C@H]3CC[C@H](C[NH3+])CC3)CC2)cc1 ZINC000873240426 1054512286 /nfs/dbraw/zinc/51/22/86/1054512286.db2.gz QITZMUVKTDEHQR-KFZSOGQHSA-N 2 0 344.543 4.047 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253904 1054514753 /nfs/dbraw/zinc/51/47/53/1054514753.db2.gz GXVSPYBEHLZRHW-ITDIGPHOSA-N 2 0 335.904 4.160 20 0 EIADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000873249606 1054515707 /nfs/dbraw/zinc/51/57/07/1054515707.db2.gz BFYDZOASPCSQLG-ZFVVBOAOSA-N 2 0 326.406 4.059 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]C[C@H]3C[C@H]4CC[C@@H](C3)[NH2+]4)cs2)cs1 ZINC000873260300 1054517038 /nfs/dbraw/zinc/51/70/38/1054517038.db2.gz XODDLZMRAIQDMP-XABYNWHXSA-N 2 0 347.553 4.361 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+][C@@H](C)C3CC[NH2+]CC3)cs2)cs1 ZINC000873270841 1054520033 /nfs/dbraw/zinc/52/00/33/1054520033.db2.gz BJBWMVSZTQTLST-NWDGAFQWSA-N 2 0 335.542 4.219 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(OC)c(OC)c2)c1 ZINC000173387747 1054555993 /nfs/dbraw/zinc/55/59/93/1054555993.db2.gz CIUHDTVTKQXEAV-MRXNPFEDSA-N 2 0 342.483 4.006 20 0 EIADRP Cc1nc(C(C)C)ccc1C[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000859213005 1054645421 /nfs/dbraw/zinc/64/54/21/1054645421.db2.gz QEIAHNUJOXJELZ-UHFFFAOYSA-N 2 0 325.500 4.207 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000062426920 1054783439 /nfs/dbraw/zinc/78/34/39/1054783439.db2.gz XGEGJPYBAQUYKZ-HNNXBMFYSA-N 2 0 332.488 4.374 20 0 EIADRP Cc1noc(C)c1C[N@@H+]1CCCC12CC[NH+](C[C@@H]1CC=CCC1)CC2 ZINC001201412222 1054790473 /nfs/dbraw/zinc/79/04/73/1054790473.db2.gz VBWYCNHCACOQLZ-LJQANCHMSA-N 2 0 343.515 4.078 20 0 EIADRP C[N@H+](Cc1ccncc1)C1CC2(C1)CC[NH+](C[C@H]1CC=CCC1)CC2 ZINC001201410342 1054803215 /nfs/dbraw/zinc/80/32/15/1054803215.db2.gz JNPWZSICIFPOQF-IBGZPJMESA-N 2 0 339.527 4.114 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccnc(Cl)c1 ZINC000125488770 1054805219 /nfs/dbraw/zinc/80/52/19/1054805219.db2.gz XPTCZAILWSLWID-AWEZNQCLSA-N 2 0 349.931 4.359 20 0 EIADRP Cn1cnc2cccc(NC3=C[C@H]4CC[C@@H](C3)[N@@H+]4Cc3ccccc3)c21 ZINC001201478050 1054830669 /nfs/dbraw/zinc/83/06/69/1054830669.db2.gz SOHSCKHJEWTBIF-MOPGFXCFSA-N 2 0 344.462 4.306 20 0 EIADRP FC(F)(F)c1cccc(C[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC001201665291 1054878998 /nfs/dbraw/zinc/87/89/98/1054878998.db2.gz YOIFRCJSAIOCJQ-UHFFFAOYSA-N 2 0 349.400 4.107 20 0 EIADRP CSCCC[N@@H+]1CCCC2(CC[NH+](Cc3ccccc3)CC2)C1 ZINC001201697832 1054880627 /nfs/dbraw/zinc/88/06/27/1054880627.db2.gz QVFBEYPQPKRPGJ-UHFFFAOYSA-N 2 0 332.557 4.118 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+]Cc2cc3nc(Cl)ccc3s2)CC1 ZINC000876947565 1054986782 /nfs/dbraw/zinc/98/67/82/1054986782.db2.gz CJYUXMUIYQAKNK-UHFFFAOYSA-N 2 0 337.920 4.302 20 0 EIADRP Cc1noc(C)c1C[N@@H+]1CCCC12CC[NH+](CCC(C)(C)C)CC2 ZINC001202073140 1054998639 /nfs/dbraw/zinc/99/86/39/1054998639.db2.gz IGAHHUZQOLVJOJ-UHFFFAOYSA-N 2 0 333.520 4.158 20 0 EIADRP C[N@H+](Cc1ccncc1)C1CC2(C1)CC[NH+](CCC(C)(C)C)CC2 ZINC001202072780 1055005089 /nfs/dbraw/zinc/00/50/89/1055005089.db2.gz BVLDESYSTCJVNV-UHFFFAOYSA-N 2 0 329.532 4.194 20 0 EIADRP Clc1ccc2sc(C[NH2+]C3CC[NH+](C4CCCC4)CC3)cc2n1 ZINC000877086105 1055016112 /nfs/dbraw/zinc/01/61/12/1055016112.db2.gz YZGNBNRIPDMWFR-UHFFFAOYSA-N 2 0 349.931 4.446 20 0 EIADRP Cc1cccc2[nH]c(C[NH2+]C[C@]3(C)CC[N@H+](Cc4ccccc4)C3)cc21 ZINC001202220117 1055092327 /nfs/dbraw/zinc/09/23/27/1055092327.db2.gz MPMOIWXWVIETCR-QHCPKHFHSA-N 2 0 347.506 4.478 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(OCc2ccccc2)c1)C1CC[NH+](C)CC1 ZINC000381151885 1060207461 /nfs/dbraw/zinc/20/74/61/1060207461.db2.gz KWWJBUKAVLZJKL-SFHVURJKSA-N 2 0 338.495 4.086 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]CCC(c1ccccc1)c1ccccc1)C2 ZINC001169098611 1060638081 /nfs/dbraw/zinc/63/80/81/1060638081.db2.gz JSFIIWLFRAGESC-DKUWSORSSA-N 2 0 334.507 4.423 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+][C@@H]1CCCc3ccc(Br)cc31)C2 ZINC001169082349 1060641704 /nfs/dbraw/zinc/64/17/04/1060641704.db2.gz YRWLNMBMBHGLDI-XLMAVXFVSA-N 2 0 349.316 4.041 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1(c3ccc(Br)cc3)CCC1)C2 ZINC001169092140 1060646768 /nfs/dbraw/zinc/64/67/68/1060646768.db2.gz YKHIEHGREMMBFO-BJWYYQGGSA-N 2 0 349.316 4.043 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@@H]1CCCc3c(Br)cccc31)C2 ZINC001169118261 1060647894 /nfs/dbraw/zinc/64/78/94/1060647894.db2.gz GEZJYGDACRZKHT-KYZVSKTDSA-N 2 0 349.316 4.041 20 0 EIADRP CC1(C)C[C@H](Nc2cc(C[NH+]3CCCCC3)ccn2)C[C@](C)(C[NH3+])C1 ZINC001169140943 1060661052 /nfs/dbraw/zinc/66/10/52/1060661052.db2.gz ICECNJSBYUWCRV-RXVVDRJESA-N 2 0 344.547 4.023 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CC[C@@H](c3ccc(C(F)(F)F)cc3)C1)C2 ZINC001169147654 1060664840 /nfs/dbraw/zinc/66/48/40/1060664840.db2.gz VSUPYEFXNMBVGX-NRSFXHEJSA-N 2 0 338.417 4.120 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CC[C@@H](c3ccc(Cl)c(Cl)c3)C1)C2 ZINC001169147034 1060666625 /nfs/dbraw/zinc/66/66/25/1060666625.db2.gz RMUHRKPLVPREKM-LVQVYYBASA-N 2 0 339.310 4.408 20 0 EIADRP CC1(C)C[C@H](Nc2cc[nH+]c(N3CCCCC3)c2)C[C@@](C)(C[NH3+])C1 ZINC001169149342 1060668233 /nfs/dbraw/zinc/66/82/33/1060668233.db2.gz YXECWMXRBBJDKQ-FXAWDEMLSA-N 2 0 330.520 4.028 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1cc(N2CCCCC2)cc[nH+]1 ZINC001169685385 1060898674 /nfs/dbraw/zinc/89/86/74/1060898674.db2.gz PPPFCCVOUCAEGQ-LJQANCHMSA-N 2 0 336.483 4.312 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2c(F)cccc2F)CCCC1 ZINC000532219074 1032097452 /nfs/dbraw/zinc/09/74/52/1032097452.db2.gz KVGJJKXGTVTGDY-RVKKMQEKSA-N 2 0 336.470 4.095 20 0 EIADRP c1cc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cs1 ZINC000245690709 1032378052 /nfs/dbraw/zinc/37/80/52/1032378052.db2.gz KERXFEVETHJNSK-OWZKRDHZSA-N 2 0 326.509 4.076 20 0 EIADRP C[N@H+](Cc1ccccc1C[NH2+]Cc1ccc(F)cn1)C1CCCCC1 ZINC000529531920 1032421558 /nfs/dbraw/zinc/42/15/58/1032421558.db2.gz MKOWVZXCOKXMCY-UHFFFAOYSA-N 2 0 341.474 4.275 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1cnc2ccsc2c1 ZINC000120953808 1032482155 /nfs/dbraw/zinc/48/21/55/1032482155.db2.gz VHZIXUOWTUZURC-CYBMUJFWSA-N 2 0 343.471 4.348 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)c1ccccc1C(C)(C)C ZINC000533170060 1032528603 /nfs/dbraw/zinc/52/86/03/1032528603.db2.gz QQRGKZAJRKBGIA-ZWKOTPCHSA-N 2 0 344.543 4.136 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H](N[C@H](CC)c2ccccc2F)[C@H](C)C1 ZINC000245987137 1032575689 /nfs/dbraw/zinc/57/56/89/1032575689.db2.gz QEVVFDUQGNZUND-AHRSYUTCSA-N 2 0 336.495 4.003 20 0 EIADRP CCC[C@@H]([NH2+]Cc1cccc(CN2CCOCC2)c1)c1ccccc1 ZINC000163679949 1032674428 /nfs/dbraw/zinc/67/44/28/1032674428.db2.gz ALOMFHSNBXAENC-JOCHJYFZSA-N 2 0 338.495 4.150 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC000512416745 1032722893 /nfs/dbraw/zinc/72/28/93/1032722893.db2.gz VGIFYLFUVQALJD-VZWFDDOASA-N 2 0 330.516 4.090 20 0 EIADRP CCC[N@H+](CC)Cc1ccc(-c2nc([C@@H]([NH3+])CC(C)C)no2)cc1 ZINC000339392474 1018839388 /nfs/dbraw/zinc/83/93/88/1018839388.db2.gz FFIAJDWGVKSPBU-KRWDZBQOSA-N 2 0 330.476 4.014 20 0 EIADRP COc1ccc(CN2CCC[C@H]([NH+](C)C)CC2)cc1OCCC(C)C ZINC000432794717 1032819547 /nfs/dbraw/zinc/81/95/47/1032819547.db2.gz URGLHCNYCYIKTR-IBGZPJMESA-N 2 0 348.531 4.036 20 0 EIADRP Cc1cc(C[NH+]2CCC(CCC[NH+](C)C)CC2)c2ccccc2n1 ZINC000179704911 1019821288 /nfs/dbraw/zinc/82/12/88/1019821288.db2.gz REDFMEPFMSOHBV-UHFFFAOYSA-N 2 0 325.500 4.097 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000579869410 1019826330 /nfs/dbraw/zinc/82/63/30/1019826330.db2.gz DVIBUXJRQAABDP-JOCHJYFZSA-N 2 0 349.478 4.239 20 0 EIADRP C[C@H]1CC(C[N@H+](C)CC2CC[NH+](Cc3ccccc3)CC2)C[C@H](C)O1 ZINC001209390760 1020243336 /nfs/dbraw/zinc/24/33/36/1020243336.db2.gz NBRQFKHBKRMXKK-OALUTQOASA-N 2 0 344.543 4.034 20 0 EIADRP CN(c1ccccc1)c1ccc(C[N@@H+]2CCC[C@H]([NH+](C)C)CC2)cc1 ZINC000683357890 1020381617 /nfs/dbraw/zinc/38/16/17/1020381617.db2.gz PIPBENXUWPYRGY-FQEVSTJZSA-N 2 0 337.511 4.371 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c(C)o1 ZINC000340172970 1020548456 /nfs/dbraw/zinc/54/84/56/1020548456.db2.gz JXIROOSFKCSABP-MRXNPFEDSA-N 2 0 330.472 4.078 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000397497149 1020835359 /nfs/dbraw/zinc/83/53/59/1020835359.db2.gz BZJXSWNRMPYXFN-SFHVURJKSA-N 2 0 340.486 4.259 20 0 EIADRP C[C@H](Cc1ccc(F)cc1)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000397497148 1020835505 /nfs/dbraw/zinc/83/55/05/1020835505.db2.gz BZJXSWNRMPYXFN-GOSISDBHSA-N 2 0 340.486 4.259 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000683472272 1020849387 /nfs/dbraw/zinc/84/93/87/1020849387.db2.gz KEKPDQXLXKAYGQ-KRWDZBQOSA-N 2 0 328.431 4.049 20 0 EIADRP c1cc(-c2ccc(C[NH+]3CCN(c4cc[nH+]cc4)CC3)cc2)cs1 ZINC000683521357 1020861990 /nfs/dbraw/zinc/86/19/90/1020861990.db2.gz ULLFKCRKCSQEOL-UHFFFAOYSA-N 2 0 335.476 4.132 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000655805843 1020972215 /nfs/dbraw/zinc/97/22/15/1020972215.db2.gz LZAKWTACRMFALA-UAGQMJEPSA-N 2 0 341.524 4.117 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccccc1OCc1ccccc1 ZINC000655805477 1020976610 /nfs/dbraw/zinc/97/66/10/1020976610.db2.gz HVADBQPKXFBWOF-YSIASYRMSA-N 2 0 338.495 4.256 20 0 EIADRP CC(C)CC(CC(C)C)[NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC000397583974 1021018919 /nfs/dbraw/zinc/01/89/19/1021018919.db2.gz IEDYWGFSFICFRY-UHFFFAOYSA-N 2 0 346.559 4.064 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1ccncc1F ZINC000340471629 1021079656 /nfs/dbraw/zinc/07/96/56/1021079656.db2.gz DTRAZAOCUZTCEX-KRWDZBQOSA-N 2 0 341.474 4.303 20 0 EIADRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(Sc3ccccn3)o2)CC1 ZINC000511363545 1021302747 /nfs/dbraw/zinc/30/27/47/1021302747.db2.gz AFEZKJFAXCFOLS-UHFFFAOYSA-N 2 0 345.512 4.037 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3ccc4cnccc4c3)CC2)CC1 ZINC000683773973 1021469261 /nfs/dbraw/zinc/46/92/61/1021469261.db2.gz IIWBJUOXMGPFNJ-UHFFFAOYSA-N 2 0 337.511 4.368 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccc3cnccc3c2)C1 ZINC000683827229 1021723652 /nfs/dbraw/zinc/72/36/52/1021723652.db2.gz ADAVNNOGCLNGDG-QUCCMNQESA-N 2 0 337.511 4.321 20 0 EIADRP C[C@H](c1cccc2ccccc21)[NH+]1CCC([C@@H]2OCCC[C@H]2[NH3+])CC1 ZINC000580294956 1021826908 /nfs/dbraw/zinc/82/69/08/1021826908.db2.gz BTLCMYNLDKGBJS-HVETUWLQSA-N 2 0 338.495 4.119 20 0 EIADRP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000580362763 1021905392 /nfs/dbraw/zinc/90/53/92/1021905392.db2.gz BYCRSVREXAMZFJ-PTNGSMBKSA-N 2 0 340.433 4.382 20 0 EIADRP CC[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccc(OC(F)F)cc1 ZINC000414168504 1022016144 /nfs/dbraw/zinc/01/61/44/1022016144.db2.gz AFEPZGYBROJFMW-PBHICJAKSA-N 2 0 326.431 4.061 20 0 EIADRP COc1ccsc1[C@@H](C)NCC[C@H](C)[N@H+](C)Cc1ccccc1 ZINC000471580446 1022063389 /nfs/dbraw/zinc/06/33/89/1022063389.db2.gz IFUKFAYONTXUKZ-JKSUJKDBSA-N 2 0 332.513 4.318 20 0 EIADRP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414186498 1022071598 /nfs/dbraw/zinc/07/15/98/1022071598.db2.gz PBZYJVGPUMXIRN-ZDUSSCGKSA-N 2 0 329.831 4.237 20 0 EIADRP Clc1cc(Cl)cc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000668427728 1022093808 /nfs/dbraw/zinc/09/38/08/1022093808.db2.gz QORMKIXOBZIQAF-UHFFFAOYSA-N 2 0 336.266 4.147 20 0 EIADRP Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]Cc1ccc3c[nH+]cn3c1)CCCO2 ZINC000414198051 1022115842 /nfs/dbraw/zinc/11/58/42/1022115842.db2.gz YAYRBUQVIGBONE-SFHVURJKSA-N 2 0 341.842 4.300 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@@H]2Cc4ccccc42)C3)cc1 ZINC000245731164 1033033686 /nfs/dbraw/zinc/03/36/86/1033033686.db2.gz QFHAFYNRQRYZEP-MYGLTJDJSA-N 2 0 332.491 4.112 20 0 EIADRP COc1cc([C@H](C)[NH2+]CC2CC[NH+](C)CC2)ccc1OC1CCCC1 ZINC000892594613 1022389112 /nfs/dbraw/zinc/38/91/12/1022389112.db2.gz NHZBJSJPOHYSPU-INIZCTEOSA-N 2 0 346.515 4.009 20 0 EIADRP C[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(-n2ccnc2)cc1 ZINC000378389940 1022783786 /nfs/dbraw/zinc/78/37/86/1022783786.db2.gz BFWWKEGMRKPNMR-UCNVEGJOSA-N 2 0 347.462 4.301 20 0 EIADRP Brc1ccc([C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)C2CC2)cc1 ZINC000378431633 1022817304 /nfs/dbraw/zinc/81/73/04/1022817304.db2.gz ODKQNFPVEZOZLG-OKZBNKHCSA-N 2 0 349.316 4.117 20 0 EIADRP c1ccc(C[N@H+]2C[C@H]3[C@@H](C2)[C@H]2CC[C@@H]3[NH+](Cc3ccccc3)C2)cc1 ZINC000656404135 1022846131 /nfs/dbraw/zinc/84/61/31/1022846131.db2.gz WYQSTLLFJCLBJL-MLCQCVOFSA-N 2 0 332.491 4.029 20 0 EIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423386643 1022864624 /nfs/dbraw/zinc/86/46/24/1022864624.db2.gz MDRPMNGYTJLNEQ-OIMNJJJWSA-N 2 0 331.287 4.009 20 0 EIADRP C[NH+]1CCC2(CC[N@H+](Cc3ccc(Cl)cc3C(F)(F)F)C2)CC1 ZINC001143505444 1022889469 /nfs/dbraw/zinc/88/94/69/1022889469.db2.gz HZBTZVWQSJHKTG-UHFFFAOYSA-N 2 0 346.824 4.277 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCCc3nc(C)sc32)c1 ZINC000163564087 1022895666 /nfs/dbraw/zinc/89/56/66/1022895666.db2.gz BUAOZLZYUOKBGH-SFHVURJKSA-N 2 0 343.540 4.461 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCCc3nc(C)sc32)cc1 ZINC000163572138 1022925375 /nfs/dbraw/zinc/92/53/75/1022925375.db2.gz DQNYRWDDBUQBNH-SFHVURJKSA-N 2 0 343.540 4.461 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(OC)CCC(c3ccccc3)CC2)[C@H](C)C1 ZINC000581292418 1022969441 /nfs/dbraw/zinc/96/94/41/1022969441.db2.gz HVJXTFYSGNRFTE-NTYOPAKOSA-N 2 0 344.543 4.049 20 0 EIADRP CC(C)c1ccc(-c2ncc(C[N@@H+]3CCC[C@H]([C@@H](C)[NH3+])C3)s2)cc1 ZINC000430556797 1023005947 /nfs/dbraw/zinc/00/59/47/1023005947.db2.gz VKDCODRWJDXUEO-QAPCUYQASA-N 2 0 343.540 4.493 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cccc(F)c1 ZINC000187896891 1023022127 /nfs/dbraw/zinc/02/21/27/1023022127.db2.gz AXXLFSJKUIKUCY-IBGZPJMESA-N 2 0 330.447 4.007 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2cc3ccccc3s2)CC[NH+](C)CC1 ZINC000581340250 1023036115 /nfs/dbraw/zinc/03/61/15/1023036115.db2.gz MLQXJFDACGUHKW-AWEZNQCLSA-N 2 0 334.554 4.379 20 0 EIADRP C[C@]1(C[NH2+]Cc2cncc3ccccc32)CC[N@H+](Cc2ccccc2)C1 ZINC000311366689 1023129054 /nfs/dbraw/zinc/12/90/54/1023129054.db2.gz KHKSZDVIJYPLOR-HSZRJFAPSA-N 2 0 345.490 4.237 20 0 EIADRP Cc1c[nH+]ccc1N1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000584686516 1023187206 /nfs/dbraw/zinc/18/72/06/1023187206.db2.gz ZJWVALBPPQWTLR-UHFFFAOYSA-N 2 0 349.400 4.121 20 0 EIADRP CCC[C@@H]([NH2+]CC1CCN(Cc2nc(C)c(C)o2)CC1)[C@H]1CC1(C)C ZINC000417300621 1023248005 /nfs/dbraw/zinc/24/80/05/1023248005.db2.gz APGZBZMGTMJZCR-RTBURBONSA-N 2 0 347.547 4.308 20 0 EIADRP CCC[NH+]1CCC([NH2+]C[C@@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000188147449 1023295141 /nfs/dbraw/zinc/29/51/41/1023295141.db2.gz MZDPTOFGFSROQP-CQSZACIVSA-N 2 0 328.422 4.273 20 0 EIADRP Cc1cc2cc(C[NH2+]C[C@@H]3CCN(C)[C@H]3c3cccnc3)oc2cc1C ZINC000376966250 1023343603 /nfs/dbraw/zinc/34/36/03/1023343603.db2.gz FLQFOBILAKKCNW-AVRDEDQJSA-N 2 0 349.478 4.227 20 0 EIADRP CC(C)COc1ccc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000415048952 1023407745 /nfs/dbraw/zinc/40/77/45/1023407745.db2.gz GUZXSNOLHHGBQE-NRFANRHFSA-N 2 0 326.484 4.291 20 0 EIADRP CC(C)COc1ccc(C[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000415048953 1023408415 /nfs/dbraw/zinc/40/84/15/1023408415.db2.gz GUZXSNOLHHGBQE-OAQYLSRUSA-N 2 0 326.484 4.291 20 0 EIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1ccc(Cl)cn1 ZINC000549167903 1023411120 /nfs/dbraw/zinc/41/11/20/1023411120.db2.gz XUGZIVBRIWFBLC-IBGZPJMESA-N 2 0 343.902 4.125 20 0 EIADRP C[C@H]1C[C@@H](CC[NH2+]C2C[C@H]3CC[C@@H](C2)S3)C[N@@H+]1Cc1ccccc1 ZINC000925617566 1023411161 /nfs/dbraw/zinc/41/11/61/1023411161.db2.gz XGNRCHOAPCEBGI-VWWARQNISA-N 2 0 344.568 4.303 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H](c2ccc(Br)cc2)C2CCC2)CC1 ZINC000415077012 1023423051 /nfs/dbraw/zinc/42/30/51/1023423051.db2.gz DLUJAFDQRYTGKZ-JCYILVPMSA-N 2 0 337.305 4.150 20 0 EIADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+]Cc1cccc(COCc2ccccc2)c1 ZINC000415082731 1023432560 /nfs/dbraw/zinc/43/25/60/1023432560.db2.gz OSJVMIPGIYEDCR-GCJKJVERSA-N 2 0 338.495 4.024 20 0 EIADRP Clc1ccccc1OCc1ccccc1C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000415082953 1023433124 /nfs/dbraw/zinc/43/31/24/1023433124.db2.gz PEQKJPKBSOANAG-SFHVURJKSA-N 2 0 344.886 4.151 20 0 EIADRP Fc1ccc([C@@H]([NH2+]CC2CC[NH2+]CC2)c2ccccc2Cl)cc1 ZINC000415087968 1023437197 /nfs/dbraw/zinc/43/71/97/1023437197.db2.gz WSADBPQYNAQLQC-LJQANCHMSA-N 2 0 332.850 4.158 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(F)cc1 ZINC000656684045 1023441100 /nfs/dbraw/zinc/44/11/00/1023441100.db2.gz SPPHYPUKNQKGQJ-NRFANRHFSA-N 2 0 341.474 4.174 20 0 EIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+]C3CCC([NH3+])CC3)s2)cc1 ZINC000415105358 1023446160 /nfs/dbraw/zinc/44/61/60/1023446160.db2.gz LZVUEUUOHFMRNN-JQRITLKVSA-N 2 0 345.512 4.048 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ccc2c(c1)OCCCO2 ZINC000119956367 1023458922 /nfs/dbraw/zinc/45/89/22/1023458922.db2.gz YEISMWNZOZUPGT-IRXDYDNUSA-N 2 0 334.504 4.009 20 0 EIADRP CC[N@H+](C)C[C@H]1CC[NH+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500075196 1023483721 /nfs/dbraw/zinc/48/37/21/1023483721.db2.gz OOSYAWYCRPPOLI-LSDHHAIUSA-N 2 0 328.422 4.083 20 0 EIADRP Cc1ncc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)s1 ZINC000090400888 1023484495 /nfs/dbraw/zinc/48/44/95/1023484495.db2.gz DMHUZVXFDLZQEV-HNNXBMFYSA-N 2 0 329.513 4.288 20 0 EIADRP CCOc1ccc([C@@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1OCC ZINC000500077956 1023485883 /nfs/dbraw/zinc/48/58/83/1023485883.db2.gz BGFCANRRNSUHCE-OAHLLOKOSA-N 2 0 348.531 4.444 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C[C@@H]1C ZINC000341271622 1023486777 /nfs/dbraw/zinc/48/67/77/1023486777.db2.gz ONFUDJDZTKXOEE-AOIWGVFYSA-N 2 0 330.516 4.074 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Br)c(C)c2)C[C@@H]1C ZINC000500088700 1023494456 /nfs/dbraw/zinc/49/44/56/1023494456.db2.gz FQDAPNMFPWXYDZ-HOCLYGCPSA-N 2 0 339.321 4.062 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@@H](C[NH2+]C(C3CCC3)C3CCC3)C2)cc1 ZINC000549237397 1023514291 /nfs/dbraw/zinc/51/42/91/1023514291.db2.gz OMFZOSGKFQEAEF-IBGZPJMESA-N 2 0 326.528 4.109 20 0 EIADRP c1sc(C[NH+]2CCC([C@H]3CCC[NH2+]C3)CC2)nc1-c1ccccc1 ZINC000656786758 1023537189 /nfs/dbraw/zinc/53/71/89/1023537189.db2.gz XKALJJZGLQRQPI-SFHVURJKSA-N 2 0 341.524 4.022 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCNc1ccc(F)c(C[NH+]2CCCC2)c1 ZINC001167753036 1023629003 /nfs/dbraw/zinc/62/90/03/1023629003.db2.gz AWGDZHPKNVOKFZ-QGZVFWFLSA-N 2 0 333.495 4.098 20 0 EIADRP CC[C@H](c1ccccc1F)[N@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000377688603 1023688409 /nfs/dbraw/zinc/68/84/09/1023688409.db2.gz ACOOSTXBSHGQQG-WMQCIHAUSA-N 2 0 341.474 4.297 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+]C2CCC(F)(F)CC2)C[N@@H+]1Cc1ccccc1 ZINC000647196188 1023851438 /nfs/dbraw/zinc/85/14/38/1023851438.db2.gz RSAXFDRKKHQWMB-AEFFLSMTSA-N 2 0 336.470 4.455 20 0 EIADRP COc1cccc([C@@H](C)[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000430710903 1023966860 /nfs/dbraw/zinc/96/68/60/1023966860.db2.gz UYBMRFRSVCJWNL-QUCCMNQESA-N 2 0 338.495 4.210 20 0 EIADRP C[C@H](CCc1c(F)cccc1F)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000510653631 1024174172 /nfs/dbraw/zinc/17/41/72/1024174172.db2.gz SMXNTJGYXKPTDC-OAHLLOKOSA-N 2 0 332.438 4.137 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H]3CC[C@@H]3C3CCC3)CC2)cc1 ZINC000510665987 1024203695 /nfs/dbraw/zinc/20/36/95/1024203695.db2.gz PEXHESCOEGRYRZ-FGZHOGPDSA-N 2 0 342.527 4.076 20 0 EIADRP CC(C)C[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)c1ccc(F)cc1 ZINC000652153188 1024338413 /nfs/dbraw/zinc/33/84/13/1024338413.db2.gz CRMAPEHZSMWFDS-DYESRHJHSA-N 2 0 348.506 4.003 20 0 EIADRP CCSc1cccc(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC000473138876 1024380128 /nfs/dbraw/zinc/38/01/28/1024380128.db2.gz HGCCRADDZDMVMT-PXNSSMCTSA-N 2 0 330.541 4.247 20 0 EIADRP COCC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)(C)C ZINC000510959286 1024865789 /nfs/dbraw/zinc/86/57/89/1024865789.db2.gz GEZQVOSMCFXMIE-OTYNDTSQSA-N 2 0 344.543 4.223 20 0 EIADRP CC(C)COc1ccccc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000549822882 1033255520 /nfs/dbraw/zinc/25/55/20/1033255520.db2.gz YEIGPIOTAMZNOK-UHFFFAOYSA-N 2 0 330.516 4.029 20 0 EIADRP CC[C@@H](C)[C@@H](C)[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000341980437 1025019272 /nfs/dbraw/zinc/01/92/72/1025019272.db2.gz QGAYTACBDVALBY-RTBURBONSA-N 2 0 332.532 4.082 20 0 EIADRP Cc1nccn1CCC[NH2+][C@@H](CCc1ccccc1)Cc1ccccc1 ZINC000510990858 1025026863 /nfs/dbraw/zinc/02/68/63/1025026863.db2.gz FNPWIYQCKLCMMQ-QHCPKHFHSA-N 2 0 347.506 4.415 20 0 EIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(OCc3ccccc3)cc2)C1 ZINC000301193062 1025175091 /nfs/dbraw/zinc/17/50/91/1025175091.db2.gz PJOOXZBTHHVZNZ-OAQYLSRUSA-N 2 0 338.495 4.086 20 0 EIADRP CCC1(C[NH2+][C@H](C)COC(C)C)CC[NH+](Cc2ccccc2)CC1 ZINC000500445244 1025332776 /nfs/dbraw/zinc/33/27/76/1025332776.db2.gz GKRXNLSJDHWQQP-LJQANCHMSA-N 2 0 332.532 4.082 20 0 EIADRP c1ccc2c(c1)[nH]c1c2CCC[C@@H]1[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000663466122 1025393093 /nfs/dbraw/zinc/39/30/93/1025393093.db2.gz OGPKONRAAXYPMH-UTKZUKDTSA-N 2 0 337.511 4.257 20 0 EIADRP c1cncc([C@@H]([NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)C2CCCCC2)c1 ZINC000663467020 1025400416 /nfs/dbraw/zinc/40/04/16/1025400416.db2.gz YZWZURYEBFPYEW-UGKGYDQZSA-N 2 0 341.543 4.415 20 0 EIADRP COc1cc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)ccc1SC ZINC000663466976 1025401006 /nfs/dbraw/zinc/40/10/06/1025401006.db2.gz CIPIPSTWEQQFFB-DOTOQJQBSA-N 2 0 348.556 4.190 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1C[C@@H](c2ccc(C)cc2)C[C@@H]1C ZINC000426539583 1025490241 /nfs/dbraw/zinc/49/02/41/1025490241.db2.gz NEHVQJLHHAYKKK-PXNSSMCTSA-N 2 0 346.478 4.262 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000519138841 1025525557 /nfs/dbraw/zinc/52/55/57/1025525557.db2.gz CQRACFAFEZBJSZ-DAXOMENPSA-N 2 0 345.487 4.044 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1C[C@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 ZINC000643458773 1025557029 /nfs/dbraw/zinc/55/70/29/1025557029.db2.gz ZWUNBTARHTUDAG-NNYUYHANSA-N 2 0 334.348 4.003 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@H](Oc2cccc(OC)c2)C1 ZINC001167824728 1025583451 /nfs/dbraw/zinc/58/34/51/1025583451.db2.gz FZDOOYYTJGQFCV-RXVVDRJESA-N 2 0 348.531 4.049 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@H+]1C[C@H]2[C@@H](C1)CCC[C@H]2OCC1CC1 ZINC001167827662 1025667038 /nfs/dbraw/zinc/66/70/38/1025667038.db2.gz UNZHZGIPXRADAH-AYWYSENESA-N 2 0 336.564 4.024 20 0 EIADRP c1cncc([C@H]2CCC[C@@H]([NH2+]C3CC[NH+](CC4CCCC4)CC3)C2)c1 ZINC000500449340 1025693921 /nfs/dbraw/zinc/69/39/21/1025693921.db2.gz YXMRQDFBHAFWKO-SIKLNZKXSA-N 2 0 341.543 4.352 20 0 EIADRP C[N@H+](CCCOc1cccc2ccccc21)CC[C@H]1CCCC[NH+]1C ZINC001167508277 1025743949 /nfs/dbraw/zinc/74/39/49/1025743949.db2.gz FRTSUYTVKFESNC-HXUWFJFHSA-N 2 0 340.511 4.415 20 0 EIADRP c1c2ccncc2sc1C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000657297939 1025779078 /nfs/dbraw/zinc/77/90/78/1025779078.db2.gz QLDIFKGJUFADFS-UHFFFAOYSA-N 2 0 337.492 4.182 20 0 EIADRP C[C@@H](Cc1ccsc1)[NH2+]C[C@@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000690063469 1025853517 /nfs/dbraw/zinc/85/35/17/1025853517.db2.gz ZFVOCVKHCDQZRF-FXAWDEMLSA-N 2 0 328.525 4.181 20 0 EIADRP C[C@H](Cc1ccsc1)[NH2+]C[C@@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000690063473 1025853742 /nfs/dbraw/zinc/85/37/42/1025853742.db2.gz ZFVOCVKHCDQZRF-YLJYHZDGSA-N 2 0 328.525 4.181 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)n1c2ccc(F)cc2c2c1C[NH2+]CC2 ZINC001167841879 1025889143 /nfs/dbraw/zinc/88/91/43/1025889143.db2.gz SYHBZTSRSRWQQX-HNNXBMFYSA-N 2 0 331.479 4.109 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C1(c2ccc(Cl)cc2)CC1 ZINC000344078766 1025971393 /nfs/dbraw/zinc/97/13/93/1025971393.db2.gz ZCGOIAYZUAOZBI-UHFFFAOYSA-N 2 0 338.842 4.008 20 0 EIADRP Cc1ccccc1C(C)(C)C[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000585816355 1025998677 /nfs/dbraw/zinc/99/86/77/1025998677.db2.gz LNCGMNICBPCBHL-UHFFFAOYSA-N 2 0 340.511 4.003 20 0 EIADRP C[N@@H+]1CCC[C@H](CNc2[nH+]ccc3[nH]ccc32)[C@H]1c1cccs1 ZINC000663660329 1026062592 /nfs/dbraw/zinc/06/25/92/1026062592.db2.gz MBTLFTLPVWLIHX-DYVFJYSZSA-N 2 0 326.469 4.119 20 0 EIADRP COc1cc(C)c(C[N@@H+]2CCCC3(CC[NH2+]CC3)C2)cc1C(C)C ZINC001204743034 1026075714 /nfs/dbraw/zinc/07/57/14/1026075714.db2.gz XYSFUACWXVUFEY-UHFFFAOYSA-N 2 0 330.516 4.093 20 0 EIADRP Fc1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c(Cl)c1 ZINC001167972741 1026129483 /nfs/dbraw/zinc/12/94/83/1026129483.db2.gz ALMZMXQCJBXVNH-AYHJJNSGSA-N 2 0 336.882 4.017 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000657348550 1026221502 /nfs/dbraw/zinc/22/15/02/1026221502.db2.gz ZOJMXYRYQQBFFI-SFHVURJKSA-N 2 0 343.540 4.329 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(C3CCC3)cc2)[C@H](C)C1 ZINC000550138373 1026223444 /nfs/dbraw/zinc/22/34/44/1026223444.db2.gz DKRAVRWHUSBTAN-GCJKJVERSA-N 2 0 344.543 4.181 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1)C1CC[NH+](C)CC1 ZINC000684774096 1026246844 /nfs/dbraw/zinc/24/68/44/1026246844.db2.gz QNYJFTUBAVBIOS-OWQGQXMQSA-N 2 0 340.433 4.271 20 0 EIADRP CCOc1c(Cl)cccc1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000582157892 1026273407 /nfs/dbraw/zinc/27/34/07/1026273407.db2.gz GBIVTOKOBZMBKE-UHFFFAOYSA-N 2 0 338.923 4.291 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)cc1OC ZINC000467834281 1026294117 /nfs/dbraw/zinc/29/41/17/1026294117.db2.gz IEFSAHODHCTBLJ-FGTMMUONSA-N 2 0 348.531 4.113 20 0 EIADRP c1ccc2c(c1)OCCC[C@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000162925665 1026331947 /nfs/dbraw/zinc/33/19/47/1026331947.db2.gz BVNRWPMYEHWUAQ-OAQYLSRUSA-N 2 0 336.479 4.286 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1sccc1Br ZINC000582221045 1026345782 /nfs/dbraw/zinc/34/57/82/1026345782.db2.gz DZPYEMZTXFMDSY-LLVKDONJSA-N 2 0 343.334 4.036 20 0 EIADRP Clc1ccc([C@@H]2C[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167982175 1026388536 /nfs/dbraw/zinc/38/85/36/1026388536.db2.gz ZLDWSDAWESBIHG-HLKUOHOZSA-N 2 0 330.903 4.191 20 0 EIADRP FC(F)Oc1ccc(Cl)cc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000550262284 1026442095 /nfs/dbraw/zinc/44/20/95/1026442095.db2.gz CNEGDZWETFFAFZ-UHFFFAOYSA-N 2 0 346.849 4.297 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cccc3cc[nH]c32)C1 ZINC000512214513 1026477140 /nfs/dbraw/zinc/47/71/40/1026477140.db2.gz WOIPRMWVYADPDZ-QZTJIDSGSA-N 2 0 325.500 4.254 20 0 EIADRP CC[NH+]1CCC(C[NH2+]Cc2ccc(-c3cccc(F)c3C)o2)CC1 ZINC000582377785 1026519014 /nfs/dbraw/zinc/51/90/14/1026519014.db2.gz ZKCSGDYCXKZSSM-UHFFFAOYSA-N 2 0 330.447 4.216 20 0 EIADRP Fc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1-c1cccs1 ZINC000391397340 1026752496 /nfs/dbraw/zinc/75/24/96/1026752496.db2.gz NGACIKXWBJKFLW-JKSUJKDBSA-N 2 0 330.472 4.271 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)Cc1ccco1)c1ccccn1 ZINC000159212828 1026779916 /nfs/dbraw/zinc/77/99/16/1026779916.db2.gz RXSQKRMFTYRBAE-KRWDZBQOSA-N 2 0 335.451 4.157 20 0 EIADRP CC(C)Oc1ccc([C@H]2CCC[C@@H]2[NH2+]CC2(C)CC[NH+](C)CC2)cc1 ZINC000507452883 1026799053 /nfs/dbraw/zinc/79/90/53/1026799053.db2.gz YNGSAWSXKFWHSF-RTWAWAEBSA-N 2 0 344.543 4.431 20 0 EIADRP c1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH2+][C@@H](c4cccnc4)C4CC4)[C@@H]3C2)cc1 ZINC000507463487 1026803604 /nfs/dbraw/zinc/80/36/04/1026803604.db2.gz UCGSBTBJCOGUAY-GSPCLOLRSA-N 2 0 347.506 4.033 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)[C@H]1CCCOC1 ZINC000507491681 1026817009 /nfs/dbraw/zinc/81/70/09/1026817009.db2.gz CERWUDJOKKPDPX-MOXWOTFGSA-N 2 0 344.543 4.069 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)[C@H]1CCCOC1 ZINC000507513047 1026822109 /nfs/dbraw/zinc/82/21/09/1026822109.db2.gz QNKHQFOOXBDKMS-WEMPKCCASA-N 2 0 344.543 4.069 20 0 EIADRP C[C@@H](Cc1ccsc1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000582586268 1026834760 /nfs/dbraw/zinc/83/47/60/1026834760.db2.gz LHWAMJVGWAAZDD-DVWBAYGPSA-N 2 0 340.536 4.464 20 0 EIADRP C[C@@H]([NH2+]C1CC([NH+]2CCCCC2)C1)C1(c2ccccc2)CCCC1 ZINC000582629538 1026881692 /nfs/dbraw/zinc/88/16/92/1026881692.db2.gz IKZFRJQSVPHGKL-KMFTYDHNSA-N 2 0 326.528 4.493 20 0 EIADRP c1cnc2c(c1)CCC[C@@H]2[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000684953381 1026887937 /nfs/dbraw/zinc/88/79/37/1026887937.db2.gz FVHHUHSWWLVAHI-NRFANRHFSA-N 2 0 335.495 4.235 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+][C@H]2CCCc3cccnc32)C[N@@H+]1Cc1ccccc1 ZINC000684960979 1026899912 /nfs/dbraw/zinc/89/99/12/1026899912.db2.gz VVQREQUABORPIE-UZKOGDIHSA-N 2 0 349.522 4.349 20 0 EIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000474481253 1027116427 /nfs/dbraw/zinc/11/64/27/1027116427.db2.gz VZASRZINIPMTEZ-RBUKOAKNSA-N 2 0 332.532 4.289 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)C1CCSCC1 ZINC000474481214 1027117214 /nfs/dbraw/zinc/11/72/14/1027117214.db2.gz XBOMAEPZBSJEEF-KRWDZBQOSA-N 2 0 332.557 4.294 20 0 EIADRP C[C@@H]([NH2+]CCC[NH+]1CCC(C)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000474483089 1027119750 /nfs/dbraw/zinc/11/97/50/1027119750.db2.gz SBSIELAPTJGYQV-DLBZAZTESA-N 2 0 345.556 4.500 20 0 EIADRP C[C@H](C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@H]1C)c1ccc(C(F)(F)F)cc1 ZINC000188148778 1027164601 /nfs/dbraw/zinc/16/46/01/1027164601.db2.gz SEHWPXBTUMHCPE-VWPFQQQWSA-N 2 0 328.422 4.127 20 0 EIADRP CC(C)C1CCC([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)CC1 ZINC000657613111 1027287801 /nfs/dbraw/zinc/28/78/01/1027287801.db2.gz WCGAZLPBMIJMIP-UHFFFAOYSA-N 2 0 329.532 4.098 20 0 EIADRP COc1ccc(C[NH2+]CCCC[NH+]2CCC(C)CC2)c2ccccc12 ZINC000520204705 1027314388 /nfs/dbraw/zinc/31/43/88/1027314388.db2.gz BPJTYCLFYQCIDO-UHFFFAOYSA-N 2 0 340.511 4.450 20 0 EIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]CCN(C)C2CCCCC2)cc1OC ZINC000474629208 1027337944 /nfs/dbraw/zinc/33/79/44/1027337944.db2.gz CSVUBWNXCXJIII-IRXDYDNUSA-N 2 0 348.531 4.050 20 0 EIADRP CO[C@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)C(C)(C)C ZINC000520262622 1027370562 /nfs/dbraw/zinc/37/05/62/1027370562.db2.gz PCCGHGNNFCFVKQ-SOAGJPPSSA-N 2 0 332.532 4.080 20 0 EIADRP CC(C)OC1CCC([NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)CC1 ZINC000090772057 1027585798 /nfs/dbraw/zinc/58/57/98/1027585798.db2.gz YHNWNNLOVFKNPK-YLJXDBKYSA-N 2 0 336.564 4.355 20 0 EIADRP CC(C)OC1CCC([NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)CC1 ZINC000090771517 1027594788 /nfs/dbraw/zinc/59/47/88/1027594788.db2.gz AHSNWPQVUIUGER-QUWFBVPJSA-N 2 0 336.564 4.355 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)C1CCSCC1 ZINC000474879489 1027709961 /nfs/dbraw/zinc/70/99/61/1027709961.db2.gz QSEBCSBXVSYDQW-CMKODMSKSA-N 2 0 346.584 4.408 20 0 EIADRP CCOC[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000474874640 1027717504 /nfs/dbraw/zinc/71/75/04/1027717504.db2.gz BVESUQMUTGBEAR-FKVLARQCSA-N 2 0 344.543 4.082 20 0 EIADRP CCc1cc(NC2CC[NH+](Cc3ccccn3)CC2)c2ccccc2[nH+]1 ZINC000123858646 1027754011 /nfs/dbraw/zinc/75/40/11/1027754011.db2.gz UHBCMCZHUFBXQJ-UHFFFAOYSA-N 2 0 346.478 4.269 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1cnn(C)c1 ZINC000121629051 1027797615 /nfs/dbraw/zinc/79/76/15/1027797615.db2.gz PDRMSCTZGQGVBP-OAQYLSRUSA-N 2 0 340.515 4.037 20 0 EIADRP C[C@@H]([NH2+]C[C@H](C1CC1)N(C)Cc1ccccc1)C1CCSCC1 ZINC000474921570 1027802333 /nfs/dbraw/zinc/80/23/33/1027802333.db2.gz DAXZWKCQAKUHSH-OXQOHEQNSA-N 2 0 332.557 4.018 20 0 EIADRP CC(F)(F)CCC[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001167648719 1027850922 /nfs/dbraw/zinc/85/09/22/1027850922.db2.gz XLXFZCVLFLCJPK-OALUTQOASA-N 2 0 336.470 4.408 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@H](C)CCc2cccc(C(F)(F)F)c2)C1 ZINC000583052208 1027903908 /nfs/dbraw/zinc/90/39/08/1027903908.db2.gz XZOKBYUPMBPEDD-WBVHZDCISA-N 2 0 342.449 4.346 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000548786379 1027932906 /nfs/dbraw/zinc/93/29/06/1027932906.db2.gz UQZZIFGAYMJBOR-INIZCTEOSA-N 2 0 344.449 4.028 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc1F ZINC000123017188 1027982308 /nfs/dbraw/zinc/98/23/08/1027982308.db2.gz PEABYZICHXUVNX-INIZCTEOSA-N 2 0 342.458 4.281 20 0 EIADRP Cc1nc2c(s1)[C@H]([NH2+]Cc1cccc(C[NH+]3CCCC3)c1)CCC2 ZINC000123050488 1027985789 /nfs/dbraw/zinc/98/57/89/1027985789.db2.gz NAXWAQCUBHRVJV-GOSISDBHSA-N 2 0 341.524 4.215 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000188657912 1028014355 /nfs/dbraw/zinc/01/43/55/1028014355.db2.gz FWUYJXWUEOMHOY-JKIFEVAISA-N 2 0 340.433 4.055 20 0 EIADRP Fc1cc(Cl)ccc1C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000189235988 1028090421 /nfs/dbraw/zinc/09/04/21/1028090421.db2.gz FNBDJCIZIRGJOA-UHFFFAOYSA-N 2 0 332.850 4.365 20 0 EIADRP CCC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@H]1CCc2ccccc21 ZINC000346136971 1028290663 /nfs/dbraw/zinc/29/06/63/1028290663.db2.gz QBDKBGWUPDVCEZ-QFIPXVFZSA-N 2 0 346.478 4.475 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](c2cncc(F)c2)C2CC2)cc1 ZINC000281148785 1028400998 /nfs/dbraw/zinc/40/09/98/1028400998.db2.gz GKYZVILZKKYGNG-OAQYLSRUSA-N 2 0 341.474 4.303 20 0 EIADRP C[N@H+](CCCCOC(C)(C)C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000475048590 1028416640 /nfs/dbraw/zinc/41/66/40/1028416640.db2.gz IDKRSYOXVRRCRN-FQEVSTJZSA-N 2 0 332.532 4.036 20 0 EIADRP CC1(C)CC[C@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000346548779 1028508544 /nfs/dbraw/zinc/50/85/44/1028508544.db2.gz DUHNXEOCVYCBMS-FQEVSTJZSA-N 2 0 344.543 4.226 20 0 EIADRP [NH3+]C1CC[NH+](Cc2cccc(-c3ccccc3C(F)(F)F)c2)CC1 ZINC000629690245 1028641850 /nfs/dbraw/zinc/64/18/50/1028641850.db2.gz HJLXQJWIGLCITQ-UHFFFAOYSA-N 2 0 334.385 4.296 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](CCOc2ccc3ccccc3c2)CC1 ZINC000524156222 1028724163 /nfs/dbraw/zinc/72/41/63/1028724163.db2.gz WBGPMFRIXSBTJX-UHFFFAOYSA-N 2 0 340.511 4.271 20 0 EIADRP C[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1ccc(Oc2ccccc2)cn1 ZINC000635004761 1028815058 /nfs/dbraw/zinc/81/50/58/1028815058.db2.gz KNRMZCXWOWMFFB-BRWVUGGUSA-N 2 0 325.456 4.042 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]Cc2cccc3c2CC[NH2+]C3)c2ccsc2S1 ZINC000635012520 1028819168 /nfs/dbraw/zinc/81/91/68/1028819168.db2.gz VLTDHUSIBVEYLO-YVEFUNNKSA-N 2 0 330.522 4.109 20 0 EIADRP CC(C)[C@@H](Cc1ccccc1)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000427715382 1028880511 /nfs/dbraw/zinc/88/05/11/1028880511.db2.gz QFFAHFSCJZQTAW-JOCHJYFZSA-N 2 0 337.511 4.155 20 0 EIADRP Cc1nc(F)ccc1C[NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000278362702 1029000821 /nfs/dbraw/zinc/00/08/21/1029000821.db2.gz JKQIOODQUXRBOZ-UHFFFAOYSA-N 2 0 341.474 4.051 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CCC1(C[NH3+])CC1 ZINC000650744185 1029065647 /nfs/dbraw/zinc/06/56/47/1029065647.db2.gz IEWHTBVZKBWFPS-LBPRGKRZSA-N 2 0 333.476 4.037 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000650746867 1029085335 /nfs/dbraw/zinc/08/53/35/1029085335.db2.gz MNALQMLXXLUXDH-JKSUJKDBSA-N 2 0 326.406 4.060 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@H](c3ccncc3)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168053361 1029159899 /nfs/dbraw/zinc/15/98/99/1029159899.db2.gz OCGOLJUOUGSCFN-YDLSIGKMSA-N 2 0 349.522 4.313 20 0 EIADRP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650754816 1029179870 /nfs/dbraw/zinc/17/98/70/1029179870.db2.gz RUNVKPWWRSEBBI-LBPRGKRZSA-N 2 0 340.364 4.024 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000650757012 1029199375 /nfs/dbraw/zinc/19/93/75/1029199375.db2.gz MJDRILAWZKMMRE-UHOFOFEASA-N 2 0 334.916 4.403 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000650764296 1029279767 /nfs/dbraw/zinc/27/97/67/1029279767.db2.gz VIPSATQXCZTOJI-CYBMUJFWSA-N 2 0 349.400 4.207 20 0 EIADRP CCCN(CCC[NH+](C)C)C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168056819 1029311527 /nfs/dbraw/zinc/31/15/27/1029311527.db2.gz ITDSZQIWIRWWHC-WOJBJXKFSA-N 2 0 345.575 4.092 20 0 EIADRP C[NH+]1CC2(C1)CC[NH+](Cc1sccc1Oc1ccccc1)CC2 ZINC001142001471 1029419248 /nfs/dbraw/zinc/41/92/48/1029419248.db2.gz RJEMROHVBYPTPT-UHFFFAOYSA-N 2 0 328.481 4.068 20 0 EIADRP COC1CCC(C)(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)CC1 ZINC000475202327 1029432109 /nfs/dbraw/zinc/43/21/09/1029432109.db2.gz MBDIVHRJQGANHW-MAKTXDPSSA-N 2 0 336.564 4.214 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)[C@@H](C)c1nc2ccccc2s1 ZINC000475219545 1029453109 /nfs/dbraw/zinc/45/31/09/1029453109.db2.gz JQHFRWXYUAWFTH-HZPDHXFCSA-N 2 0 345.556 4.500 20 0 EIADRP C[C@@H]1[C@H]([NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000475278836 1029484205 /nfs/dbraw/zinc/48/42/05/1029484205.db2.gz XFRGCHVCJFGVPL-VOFXCDAESA-N 2 0 334.507 4.290 20 0 EIADRP C[N@H+](CCCCOC(C)(C)C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000475322301 1029519166 /nfs/dbraw/zinc/51/91/66/1029519166.db2.gz ARWGBQMEIYVHMS-UHFFFAOYSA-N 2 0 347.547 4.215 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)CCCS2 ZINC000446935333 1029644591 /nfs/dbraw/zinc/64/45/91/1029644591.db2.gz ZLBYZKDPEYRHCF-HDMKZQKVSA-N 2 0 334.529 4.085 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc(C(F)F)nc1 ZINC000657838530 1029720673 /nfs/dbraw/zinc/72/06/73/1029720673.db2.gz VJZVXJLEDXZHMQ-HNNXBMFYSA-N 2 0 325.447 4.182 20 0 EIADRP CC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@H](C)Cc1ccsc1 ZINC000428476863 1029943869 /nfs/dbraw/zinc/94/38/69/1029943869.db2.gz YSVGCEXMWMLHSZ-OAHLLOKOSA-N 2 0 340.496 4.090 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2sc(C)nc2C)cc1 ZINC000170972847 1029968987 /nfs/dbraw/zinc/96/89/87/1029968987.db2.gz UNZQUHZEPVHARJ-CQSZACIVSA-N 2 0 331.529 4.453 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1sc(C)nc1C ZINC000170972818 1029970120 /nfs/dbraw/zinc/97/01/20/1029970120.db2.gz HIBFFHSEOOMYOS-CQSZACIVSA-N 2 0 331.529 4.453 20 0 EIADRP Fc1ccc2c(c1)onc2C1CCN(CCC[NH+]2CCCCC2)CC1 ZINC000116479721 1030006966 /nfs/dbraw/zinc/00/69/66/1030006966.db2.gz NAHWGSVYXGNFDW-UHFFFAOYSA-N 2 0 345.462 4.022 20 0 EIADRP Cc1ccc(C)c([C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)c1 ZINC000392266652 1030077747 /nfs/dbraw/zinc/07/77/47/1030077747.db2.gz OQQNUZCYDRYQMX-WMZHIEFXSA-N 2 0 334.507 4.467 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(C(F)F)nc2)c1 ZINC000657872236 1030089438 /nfs/dbraw/zinc/08/94/38/1030089438.db2.gz PNQFDQSCILELDG-AWEZNQCLSA-N 2 0 333.426 4.322 20 0 EIADRP C[C@H](CCc1ccco1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447522307 1030116249 /nfs/dbraw/zinc/11/62/49/1030116249.db2.gz QDISWBXQPROLSE-AYWYSENESA-N 2 0 338.495 4.386 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccccc1OC(F)(F)F ZINC000447553090 1030133348 /nfs/dbraw/zinc/13/33/48/1030133348.db2.gz PLKWUYLRXXUXOD-CYBMUJFWSA-N 2 0 342.405 4.110 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cccc(C(F)(F)F)c1 ZINC000447569049 1030154206 /nfs/dbraw/zinc/15/42/06/1030154206.db2.gz NNGVQUURUMYXEW-CYBMUJFWSA-N 2 0 326.406 4.230 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)c2ccccc12 ZINC000447562520 1030170726 /nfs/dbraw/zinc/17/07/26/1030170726.db2.gz CZZNQFRMQJGDJB-MRXNPFEDSA-N 2 0 338.495 4.373 20 0 EIADRP C[C@@H]([NH2+]Cc1cnccc1C(C)(C)C)c1cccc(C[NH+](C)C)c1 ZINC000926581866 1030197493 /nfs/dbraw/zinc/19/74/93/1030197493.db2.gz HBDAEIVCWUIFLF-MRXNPFEDSA-N 2 0 325.500 4.292 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@H]1CC[NH2+]C12CCC2 ZINC000530217584 1030224255 /nfs/dbraw/zinc/22/42/55/1030224255.db2.gz UFJLZDBAGCGITE-KXBFYZLASA-N 2 0 325.500 4.098 20 0 EIADRP C[N@H+](Cc1ccc(-c2ccccc2F)s1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000470008224 1030231746 /nfs/dbraw/zinc/23/17/46/1030231746.db2.gz HJMDLJUNPRUAON-YIONKMFJSA-N 2 0 330.472 4.269 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000685455208 1030336971 /nfs/dbraw/zinc/33/69/71/1030336971.db2.gz JCNOLGUBXHZBKJ-GJZGRUSLSA-N 2 0 328.422 4.129 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000708566641 1030384422 /nfs/dbraw/zinc/38/44/22/1030384422.db2.gz RHWMYNHBYYZAGA-WAOWUJCRSA-N 2 0 340.486 4.114 20 0 EIADRP COC[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cccc(Cl)c1 ZINC000685645165 1030615947 /nfs/dbraw/zinc/61/59/47/1030615947.db2.gz KLIOHYXLUTZTLB-LPHOPBHVSA-N 2 0 338.923 4.129 20 0 EIADRP Cc1cc(F)ccc1C[NH2+][C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398051032 1030692836 /nfs/dbraw/zinc/69/28/36/1030692836.db2.gz XSMZPGYZINEKAE-LAUBAEHRSA-N 2 0 326.459 4.134 20 0 EIADRP Cc1cc(F)ccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000398051033 1030694840 /nfs/dbraw/zinc/69/48/40/1030694840.db2.gz XSMZPGYZINEKAE-UTKZUKDTSA-N 2 0 326.459 4.134 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000398133016 1030710713 /nfs/dbraw/zinc/71/07/13/1030710713.db2.gz KDLIBUYHNUNNGB-UWJYYQICSA-N 2 0 333.479 4.168 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1ccc(C(F)F)nc1 ZINC000658041826 1030793341 /nfs/dbraw/zinc/79/33/41/1030793341.db2.gz JCVLEWJOVVTAMN-OLMNPRSZSA-N 2 0 345.437 4.015 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H]2CCC[C@H](c3ccccc3)CC2)CC1 ZINC000527652807 1030812907 /nfs/dbraw/zinc/81/29/07/1030812907.db2.gz LGZYZEVBYSWGAM-SFTDATJTSA-N 2 0 344.543 4.193 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21)c1ccccn1 ZINC000658066536 1030813175 /nfs/dbraw/zinc/81/31/75/1030813175.db2.gz MJXQFIANKRHLSJ-MBWHEUGSSA-N 2 0 349.522 4.218 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2noc3ccccc32)CC1 ZINC000658067244 1030813803 /nfs/dbraw/zinc/81/38/03/1030813803.db2.gz TWKXKVPSLCGKKJ-UZLBHIALSA-N 2 0 341.499 4.003 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1ccccc1CC(C)C ZINC000527732382 1030829390 /nfs/dbraw/zinc/82/93/90/1030829390.db2.gz DVTNLCJTMIUVOY-UHFFFAOYSA-N 2 0 334.467 4.064 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2occc2c1)c1cccc(OCC[NH+](C)C)c1 ZINC000658120391 1030840320 /nfs/dbraw/zinc/84/03/20/1030840320.db2.gz RKESBWRYWLSYHO-INIZCTEOSA-N 2 0 338.451 4.224 20 0 EIADRP CCc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)s1 ZINC000658168891 1030863726 /nfs/dbraw/zinc/86/37/26/1030863726.db2.gz ZXUOAABZDFKARH-MRXNPFEDSA-N 2 0 343.540 4.268 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)[C@@H](C)c1ccccc1 ZINC000658168736 1030864039 /nfs/dbraw/zinc/86/40/39/1030864039.db2.gz YDWAEYOPHZOHAT-RTBURBONSA-N 2 0 337.511 4.075 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H](c1cccc(C)c1)C(C)C ZINC000527806808 1030865897 /nfs/dbraw/zinc/86/58/97/1030865897.db2.gz AXHKJCBSVLGUSH-OAQYLSRUSA-N 2 0 334.467 4.371 20 0 EIADRP C[C@]1(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1(F)F ZINC000658223150 1030885021 /nfs/dbraw/zinc/88/50/21/1030885021.db2.gz SPHGYKJKOYLGLR-OKYOBFRVSA-N 2 0 334.454 4.207 20 0 EIADRP C[C@@H]([NH2+]C1CCC2(CC2(F)F)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000658265791 1030920667 /nfs/dbraw/zinc/92/06/67/1030920667.db2.gz PXOAUMDXURDDIG-HSFDUWRESA-N 2 0 348.481 4.455 20 0 EIADRP c1ccc([C@H](C[C@H]2CCOC2)[NH2+]CCCCC[NH+]2CCCCC2)cc1 ZINC000166595328 1030921843 /nfs/dbraw/zinc/92/18/43/1030921843.db2.gz VMAXPOIJGGTOKK-IRLDBZIGSA-N 2 0 344.543 4.400 20 0 EIADRP CC(C)(C)O[C@@H]1C[C@@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C12CCC2 ZINC000658255851 1030929619 /nfs/dbraw/zinc/92/96/19/1030929619.db2.gz WOSDQJHISCPTBZ-RTBURBONSA-N 2 0 334.548 4.109 20 0 EIADRP C[C@@H](Cc1ccoc1)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658317263 1030979813 /nfs/dbraw/zinc/97/98/13/1030979813.db2.gz KBPMAQSBOBACFD-GHTZIAJQSA-N 2 0 338.495 4.103 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)c2ccsc2S1 ZINC000658357964 1031025336 /nfs/dbraw/zinc/02/53/36/1031025336.db2.gz WKGAINPULDTCLZ-SUMWQHHRSA-N 2 0 336.570 4.385 20 0 EIADRP c1ccc2c(c1)OC1(CCC1)C[C@@H]2[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658355527 1031025672 /nfs/dbraw/zinc/02/56/72/1031025672.db2.gz JKSSHWZUOKIPSN-FQEVSTJZSA-N 2 0 340.511 4.145 20 0 EIADRP c1cncc([C@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)C2CCCCC2)c1 ZINC000658353543 1031026354 /nfs/dbraw/zinc/02/63/54/1031026354.db2.gz OMONMQFCDZFRJU-JOCHJYFZSA-N 2 0 341.543 4.415 20 0 EIADRP C[C@@H](NC(C)(C)C[NH2+][C@@H]1CCc2cccnc2CC1)c1ccccc1 ZINC000421840424 1031035563 /nfs/dbraw/zinc/03/55/63/1031035563.db2.gz ZBOFTRMWXUKRCM-YLJYHZDGSA-N 2 0 337.511 4.048 20 0 EIADRP C[C@H]([NH2+]CCO[C@H]1CCCC[C@@H]1C)c1ccc(-n2ccnc2)cc1 ZINC000532448166 1031077303 /nfs/dbraw/zinc/07/73/03/1031077303.db2.gz SJQNLCLADFSNJH-ZWOKBUDYSA-N 2 0 327.472 4.118 20 0 EIADRP CC(C)C[NH+]1CCC(N[C@@H](C)c2sccc2Br)CC1 ZINC000532451616 1031085538 /nfs/dbraw/zinc/08/55/38/1031085538.db2.gz DPDZYDMZNJSTIH-LBPRGKRZSA-N 2 0 345.350 4.282 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccc(F)cc1 ZINC000532480468 1031216364 /nfs/dbraw/zinc/21/63/64/1031216364.db2.gz XMIIPMXKCAJVIN-SJORKVTESA-N 2 0 344.474 4.220 20 0 EIADRP C[C@H](CN1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1)c1cc(F)cc(F)c1 ZINC000449044071 1031394960 /nfs/dbraw/zinc/39/49/60/1031394960.db2.gz BJUZQIUZIQVOAR-STXHMFSFSA-N 2 0 334.454 4.017 20 0 EIADRP C[C@H](CN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1)c1cc(F)cc(F)c1 ZINC000449044070 1031396541 /nfs/dbraw/zinc/39/65/41/1031396541.db2.gz BJUZQIUZIQVOAR-SIFCLUCFSA-N 2 0 334.454 4.017 20 0 EIADRP CCC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)C1CCCC1 ZINC000449057034 1031408661 /nfs/dbraw/zinc/40/86/61/1031408661.db2.gz AIZUCXHAQQEEDB-JOCHJYFZSA-N 2 0 344.543 4.092 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccnn2C2CCCC2)cc1 ZINC000449067851 1031420105 /nfs/dbraw/zinc/42/01/05/1031420105.db2.gz OTTCYSMEXLLVSY-UHFFFAOYSA-N 2 0 340.515 4.130 20 0 EIADRP Clc1ccc(C2=CC[C@H]([NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)CC2)cc1 ZINC000449074348 1031426484 /nfs/dbraw/zinc/42/64/84/1031426484.db2.gz KPBATSWRXUUFFB-KXBFYZLASA-N 2 0 330.903 4.350 20 0 EIADRP C[C@H](Cc1cccs1)[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449078526 1031432169 /nfs/dbraw/zinc/43/21/69/1031432169.db2.gz YGZSEDMFURFVGN-QZTJIDSGSA-N 2 0 342.552 4.364 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000532626171 1031443680 /nfs/dbraw/zinc/44/36/80/1031443680.db2.gz MCVBXDINYMBSLK-IAGOWNOFSA-N 2 0 343.540 4.350 20 0 EIADRP Clc1ccc(C2=CC[C@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)CC2)cc1 ZINC000449089123 1031450322 /nfs/dbraw/zinc/45/03/22/1031450322.db2.gz JICCKKQQTOBXDY-ZCNNSNEGSA-N 2 0 330.903 4.492 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCc2ccc(C(C)C)cc2)[C@H](C)C1 ZINC000531676914 1031468787 /nfs/dbraw/zinc/46/87/87/1031468787.db2.gz PEJIBJQZBDGKJQ-KNQAVFIVSA-N 2 0 346.559 4.079 20 0 EIADRP C[C@@H](NC1(C[NH2+][C@H]2CCOC3(CCC3)C2)CCCC1)c1ccccc1 ZINC000449154732 1031483818 /nfs/dbraw/zinc/48/38/18/1031483818.db2.gz JJLDQHRMQUNESO-QUCCMNQESA-N 2 0 342.527 4.341 20 0 EIADRP CC(C)C[C@H](CCO)C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449172984 1031492896 /nfs/dbraw/zinc/49/28/96/1031492896.db2.gz KPUXMWGDEZIJHI-SFHVURJKSA-N 2 0 340.596 4.300 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3cc(OC)ccc32)c1 ZINC000123983142 1031497206 /nfs/dbraw/zinc/49/72/06/1031497206.db2.gz REQCLAOAXXXZQI-JOCHJYFZSA-N 2 0 338.495 4.314 20 0 EIADRP Cc1noc(C)c1C[C@@H](C)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449164154 1031504104 /nfs/dbraw/zinc/50/41/04/1031504104.db2.gz YEWHEYGESHBXOM-OAHLLOKOSA-N 2 0 349.563 4.491 20 0 EIADRP CCSCC[C@H](C)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449166130 1031507455 /nfs/dbraw/zinc/50/74/55/1031507455.db2.gz BYARVEZAMCZYJB-ROUUACIJSA-N 2 0 334.573 4.203 20 0 EIADRP Cc1nccn1CCCC[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449165878 1031508095 /nfs/dbraw/zinc/50/80/95/1031508095.db2.gz XXYOYJHCJCKUNE-UHFFFAOYSA-N 2 0 348.579 4.241 20 0 EIADRP CC[C@@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)C1CCOCC1 ZINC000449180868 1031519712 /nfs/dbraw/zinc/51/97/12/1031519712.db2.gz CRSNIUYKQMFGQF-LJQANCHMSA-N 2 0 338.580 4.460 20 0 EIADRP COc1cccc2c(C[NH2+]C3CCC(C[NH+](C)C)CC3)cccc12 ZINC000449199823 1031543885 /nfs/dbraw/zinc/54/38/85/1031543885.db2.gz GHSDIKWVACBNDR-UHFFFAOYSA-N 2 0 326.484 4.058 20 0 EIADRP CC(C)[C@@H]1C[C@@H]([NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CCO1 ZINC000449255026 1031572866 /nfs/dbraw/zinc/57/28/66/1031572866.db2.gz ZLEYEFMFUWYLHL-OALUTQOASA-N 2 0 338.580 4.459 20 0 EIADRP CC[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccccc1OC(F)F ZINC000125421953 1031596042 /nfs/dbraw/zinc/59/60/42/1031596042.db2.gz NDQJAAUYGWETGG-INIZCTEOSA-N 2 0 326.431 4.061 20 0 EIADRP CN(Cc1cnc(-c2ccccc2F)s1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000449321377 1031634584 /nfs/dbraw/zinc/63/45/84/1031634584.db2.gz LRBZTLLRPBBZOZ-YIONKMFJSA-N 2 0 345.487 4.006 20 0 EIADRP Fc1ccccc1-c1ncc(C[NH2+]CCCCC[NH+]2CCCC2)s1 ZINC000449345269 1031640279 /nfs/dbraw/zinc/64/02/79/1031640279.db2.gz VAPQAPLNBVZNOI-UHFFFAOYSA-N 2 0 347.503 4.305 20 0 EIADRP CC(C)[C@H]1C[C@@H](C[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)CCO1 ZINC000449494500 1031784714 /nfs/dbraw/zinc/78/47/14/1031784714.db2.gz NIUDHAQZSWKYAZ-YXYSEUPNSA-N 2 0 336.564 4.070 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCCC2CCOCC2)CC1 ZINC000453243245 1031799593 /nfs/dbraw/zinc/79/95/93/1031799593.db2.gz YVQOARCLAZCDOH-UHFFFAOYSA-N 2 0 344.543 4.226 20 0 EIADRP Cc1cc(Cl)ccc1C1=CC[N@H+](CCCc2cncn2C)CC1 ZINC000528743200 1031820266 /nfs/dbraw/zinc/82/02/66/1031820266.db2.gz RKMGNQNZSNXISG-UHFFFAOYSA-N 2 0 329.875 4.104 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000449560108 1031847422 /nfs/dbraw/zinc/84/74/22/1031847422.db2.gz GEUWPKXYXNJYOZ-NIZIRCGXSA-N 2 0 342.527 4.325 20 0 EIADRP COc1ccc2oc([C@H](C)NC3C[C@H]4CC[C@@H](C3)[N@H+]4C)c(C)c2c1 ZINC000453341978 1031868218 /nfs/dbraw/zinc/86/82/18/1031868218.db2.gz HVXUUJJGPJMZJP-HNSVSWJLSA-N 2 0 328.456 4.026 20 0 EIADRP COc1ccc([C@@H](CCC(C)C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000453363559 1031903885 /nfs/dbraw/zinc/90/38/85/1031903885.db2.gz RRFTVQNVIXLPME-SMLSOGCJSA-N 2 0 330.516 4.387 20 0 EIADRP CC(C)CCc1ccc(NC2CC[NH+](Cc3cccnc3)CC2)nc1 ZINC000449710471 1031948599 /nfs/dbraw/zinc/94/85/99/1031948599.db2.gz MULSICATFVUPIJ-UHFFFAOYSA-N 2 0 338.499 4.142 20 0 EIADRP c1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]([NH2+]CC4CCSCC4)[C@@H]3C2)cc1 ZINC000512612349 1033491555 /nfs/dbraw/zinc/49/15/55/1033491555.db2.gz OMBCFARABUWQKZ-PWRODBHTSA-N 2 0 344.568 4.020 20 0 EIADRP CCc1nocc1C[NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000645146260 1033829937 /nfs/dbraw/zinc/82/99/37/1033829937.db2.gz DSZLDWAGAQANJK-CALCHBBNSA-N 2 0 341.499 4.005 20 0 EIADRP Cc1nccn1CCC[N@@H+](C)[C@H](C)c1nc2ccccc2n1C(F)F ZINC000411403182 1033882473 /nfs/dbraw/zinc/88/24/73/1033882473.db2.gz VUZKSRKVSHIELL-CYBMUJFWSA-N 2 0 347.413 4.019 20 0 EIADRP c1ccc2c(c1)CCS[C@H]2C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000513042562 1034351143 /nfs/dbraw/zinc/35/11/43/1034351143.db2.gz RVXPAVUEJNHBAU-NRFANRHFSA-N 2 0 344.568 4.404 20 0 EIADRP C[N@H+](CCc1cc(Cl)cc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513127299 1034604554 /nfs/dbraw/zinc/60/45/54/1034604554.db2.gz GDIUIEAZMWNHLI-SJPCQFCGSA-N 2 0 327.299 4.093 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)cc2)cc1 ZINC000246556143 1034853496 /nfs/dbraw/zinc/85/34/96/1034853496.db2.gz WWXNLJCOCVAESK-SFTDATJTSA-N 2 0 336.479 4.079 20 0 EIADRP c1ccc(C(C[NH2+]CC2CC[NH+](C3CC3)CC2)c2ccccc2)cc1 ZINC000513280847 1034864939 /nfs/dbraw/zinc/86/49/39/1034864939.db2.gz GPYLEPZHSPFDPA-UHFFFAOYSA-N 2 0 334.507 4.283 20 0 EIADRP COc1ccsc1C[NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000513495370 1034986655 /nfs/dbraw/zinc/98/66/55/1034986655.db2.gz OWKUOZIHKDCVIU-FUHWJXTLSA-N 2 0 344.524 4.147 20 0 EIADRP COc1ccsc1C[NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000513495372 1034986691 /nfs/dbraw/zinc/98/66/91/1034986691.db2.gz OWKUOZIHKDCVIU-WMZOPIPTSA-N 2 0 344.524 4.147 20 0 EIADRP COc1ccc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cc1 ZINC000513513007 1035008284 /nfs/dbraw/zinc/00/82/84/1035008284.db2.gz QZNFYGCYPMSIMR-GHTZIAJQSA-N 2 0 338.495 4.086 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+]CCCC[NH+]1CCC(C)CC1 ZINC000509929202 1035011562 /nfs/dbraw/zinc/01/15/62/1035011562.db2.gz MIYVMCRMGOODTO-CAPFRKAQSA-N 2 0 344.543 4.338 20 0 EIADRP Cc1ccc([C@@H](Cn2ccnc2)[NH2+][C@@H](C)c2cccc(CO)c2)c(C)c1 ZINC000345246487 1035169584 /nfs/dbraw/zinc/16/95/84/1035169584.db2.gz HGFIOBNZYAMDBU-PGRDOPGGSA-N 2 0 349.478 4.084 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000501380187 1035430319 /nfs/dbraw/zinc/43/03/19/1035430319.db2.gz CUIZLRKKNOWIDT-YVGNARHYSA-N 2 0 338.417 4.183 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000501408071 1035440828 /nfs/dbraw/zinc/44/08/28/1035440828.db2.gz TXJQPTJSMYJFAH-OMCKNOPTSA-N 2 0 338.417 4.325 20 0 EIADRP [NH3+]CC[C@@H]1CCCCN1Cc1nc(-c2ccccc2Cl)cs1 ZINC000420314941 1035509676 /nfs/dbraw/zinc/50/96/76/1035509676.db2.gz LTHZWWDKGVFRBK-ZDUSSCGKSA-N 2 0 335.904 4.167 20 0 EIADRP C[C@H](c1ccc2ccccc2c1)[NH+]1CCC([C@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420383847 1035560320 /nfs/dbraw/zinc/56/03/20/1035560320.db2.gz FWFZXRZVOGUHEE-NPFVIJTESA-N 2 0 338.495 4.119 20 0 EIADRP Cc1sc([C@H](C)[NH2+]CC[C@@H]2CC[NH2+]C2)nc1-c1ccc(Cl)cc1 ZINC000420402243 1035575880 /nfs/dbraw/zinc/57/58/80/1035575880.db2.gz JXTADDPLBLRPPL-JSGCOSHPSA-N 2 0 349.931 4.422 20 0 EIADRP Cc1ccc(-c2cc(C[NH+]3CCC(CCC[NH+](C)C)CC3)on2)cc1 ZINC000501787361 1035593873 /nfs/dbraw/zinc/59/38/73/1035593873.db2.gz WKGDNWHQBLNWAD-UHFFFAOYSA-N 2 0 341.499 4.204 20 0 EIADRP COCC[N@H+](C)CCCC1CC[NH+](Cc2cc3ccccc3o2)CC1 ZINC000501795528 1035609484 /nfs/dbraw/zinc/60/94/84/1035609484.db2.gz ZDUUNIBXKJUSTL-UHFFFAOYSA-N 2 0 344.499 4.003 20 0 EIADRP CCS[C@@H]1CCC[C@@H]1[NH2+]C/C=C/C[NH2+][C@@H]1CCC[C@@H]1SCC ZINC000595484659 1035683793 /nfs/dbraw/zinc/68/37/93/1035683793.db2.gz MSXHEYCDOLYHMV-LSNRLGPVSA-N 2 0 342.618 4.070 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH2+]CC1)c1ccc2ccccc2c1OC(F)F ZINC000575114928 1035708152 /nfs/dbraw/zinc/70/81/52/1035708152.db2.gz MEXKHGGGSCSKCL-ZDUSSCGKSA-N 2 0 334.410 4.091 20 0 EIADRP CC(C)[N@H+](C)CC1CCN(c2ccnc3cc(Cl)ccc32)CC1 ZINC000601505386 1036121174 /nfs/dbraw/zinc/12/11/74/1036121174.db2.gz HWUMQMYDMITSJC-UHFFFAOYSA-N 2 0 331.891 4.445 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCCC(F)(F)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000502593151 1036387549 /nfs/dbraw/zinc/38/75/49/1036387549.db2.gz SBWKFVNKBMACOG-CVEARBPZSA-N 2 0 340.458 4.103 20 0 EIADRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1 ZINC000502708753 1036564518 /nfs/dbraw/zinc/56/45/18/1036564518.db2.gz LJXCKWWHDNEXGD-FCHUYYIVSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@@H](CSC(C)(C)C)[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000165313258 1036774348 /nfs/dbraw/zinc/77/43/48/1036774348.db2.gz PINRHQNEEJFJCZ-HKUYNNGSSA-N 2 0 334.573 4.061 20 0 EIADRP C[C@@H]([NH2+]Cc1cc2ccc(F)cc2[nH]1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000486719638 1036826325 /nfs/dbraw/zinc/82/63/25/1036826325.db2.gz HMXVBOGXCOTLFH-GDBMZVCRSA-N 2 0 329.463 4.050 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Cl)ccc1OC(F)F ZINC000421884975 1036833669 /nfs/dbraw/zinc/83/36/69/1036833669.db2.gz UNHSOIIPOXOBCV-LMWSTFAQSA-N 2 0 346.849 4.465 20 0 EIADRP CCOc1ccc([C@H](CC)[NH2+]C2CCC([NH+](C)C)CC2)cc1OCC ZINC000421889499 1036834859 /nfs/dbraw/zinc/83/48/59/1036834859.db2.gz XGVDJBYOSJXJDF-ACBHZAAOSA-N 2 0 348.531 4.398 20 0 EIADRP COc1cccc(Cl)c1CNCc1cccc(C[N@H+](C)C(C)C)c1 ZINC000237277038 1036841722 /nfs/dbraw/zinc/84/17/22/1036841722.db2.gz APVVABIGEXMQOP-UHFFFAOYSA-N 2 0 346.902 4.479 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc(OC(F)(F)F)cc1 ZINC000589836069 1036879902 /nfs/dbraw/zinc/87/99/02/1036879902.db2.gz FUQNOVJSRXLHHD-OAHLLOKOSA-N 2 0 344.421 4.329 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]Cc2cccc(COc3ccccc3)c2)[C@@H](C)C1 ZINC000469179837 1036880341 /nfs/dbraw/zinc/88/03/41/1036880341.db2.gz YONHYKHNMGEPCT-AVRDEDQJSA-N 2 0 338.495 4.086 20 0 EIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2cccc3[nH]ccc32)CC1 ZINC000503121265 1036919995 /nfs/dbraw/zinc/91/99/95/1036919995.db2.gz NTWFWTFDXFEFGK-HTAPYJJXSA-N 2 0 339.527 4.343 20 0 EIADRP c1cc2c(cccc2CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)[nH]1 ZINC000503117060 1036928190 /nfs/dbraw/zinc/92/81/90/1036928190.db2.gz BYGVIEUTKQWIGA-UHFFFAOYSA-N 2 0 325.500 4.097 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2[C@@H]3Cc4cc(F)ccc4[C@@H]32)CC1 ZINC000668744900 1037013866 /nfs/dbraw/zinc/01/38/66/1037013866.db2.gz RJFXWGKKGQPMKJ-IOWAXREISA-N 2 0 342.502 4.097 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)CC1 ZINC000271867009 1037041172 /nfs/dbraw/zinc/04/11/72/1037041172.db2.gz LSMOULNSPCTIJP-KRWDZBQOSA-N 2 0 339.508 4.039 20 0 EIADRP C[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CC1(C)C ZINC000487278189 1037093023 /nfs/dbraw/zinc/09/30/23/1037093023.db2.gz MJUYYNSVZYILNB-RXVVDRJESA-N 2 0 344.543 4.082 20 0 EIADRP CCC1(C[NH2+]C[C@@H]2CCSC2)CC[NH+](Cc2ccccc2)CC1 ZINC000487555370 1037137423 /nfs/dbraw/zinc/13/74/23/1037137423.db2.gz GIQAAWIBTOEXEL-IBGZPJMESA-N 2 0 332.557 4.022 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc2c(c1)COC2 ZINC000272691534 1037269169 /nfs/dbraw/zinc/26/91/69/1037269169.db2.gz PQQGJUYLHSHXRI-BQFCYCMXSA-N 2 0 328.500 4.020 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1C ZINC000272796096 1037298872 /nfs/dbraw/zinc/29/88/72/1037298872.db2.gz AAHKTFTVWNABEC-HNNXBMFYSA-N 2 0 330.447 4.055 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168418237 1037403961 /nfs/dbraw/zinc/40/39/61/1037403961.db2.gz WOOAPUASKNYOKM-JBACZVJFSA-N 2 0 330.491 4.198 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)CC[NH+](C)CC1 ZINC000573256010 1037456892 /nfs/dbraw/zinc/45/68/92/1037456892.db2.gz VKUILWVSQSRRKZ-LBPRGKRZSA-N 2 0 347.355 4.471 20 0 EIADRP C[NH+]1CCC(C[NH2+]Cc2ccc(-c3cccc(Cl)c3)s2)CC1 ZINC000591712856 1037543609 /nfs/dbraw/zinc/54/36/09/1037543609.db2.gz XPVILLAAPDZPNY-UHFFFAOYSA-N 2 0 334.916 4.500 20 0 EIADRP C[NH+]1CCC(CC[NH2+]Cc2ccc(-c3ccc(Cl)cc3)o2)CC1 ZINC000591709222 1037558051 /nfs/dbraw/zinc/55/80/51/1037558051.db2.gz YDJHRIHPDZTYJQ-UHFFFAOYSA-N 2 0 332.875 4.422 20 0 EIADRP c1sc(C2CCCCC2)nc1C[N@@H+]1CCC[C@H]([C@H]2CC[NH2+]C2)C1 ZINC000573497381 1037570301 /nfs/dbraw/zinc/57/03/01/1037570301.db2.gz XJIWWWTYHJCQNP-IRXDYDNUSA-N 2 0 333.545 4.012 20 0 EIADRP c1nc([C@H]2CCC[N@@H+](CCSC3CCCCC3)C2)n2c1CCCC2 ZINC000503371262 1037711977 /nfs/dbraw/zinc/71/19/77/1037711977.db2.gz HTTVEYFEGLBFRG-KRWDZBQOSA-N 2 0 347.572 4.465 20 0 EIADRP C[C@H]([NH3+])[C@H]1CC[N@H+](Cc2cccc(OCc3ccccc3Cl)c2)C1 ZINC000414663838 1037723227 /nfs/dbraw/zinc/72/32/27/1037723227.db2.gz RWETVPMXQOHTNH-RDJZCZTQSA-N 2 0 344.886 4.088 20 0 EIADRP CCCOCc1ccccc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000422697038 1037800519 /nfs/dbraw/zinc/80/05/19/1037800519.db2.gz TYSBQOTWRQOUJX-NJDAHSKKSA-N 2 0 330.516 4.014 20 0 EIADRP Cc1ccccc1[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)C1CC1 ZINC000422711916 1037804066 /nfs/dbraw/zinc/80/40/66/1037804066.db2.gz NJWNRHFFIJSOLT-MZYLBHOOSA-N 2 0 348.490 4.292 20 0 EIADRP c1ccc([C@@H]2CCC[C@@H]2[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422710969 1037804968 /nfs/dbraw/zinc/80/49/68/1037804968.db2.gz MBUKKSSYJFDNPG-ROQCDXFCSA-N 2 0 348.490 4.168 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1Cl ZINC000422689325 1037805900 /nfs/dbraw/zinc/80/59/00/1037805900.db2.gz FENXJWULJPDBFY-QMIHWGKISA-N 2 0 342.870 4.247 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000422733084 1037808519 /nfs/dbraw/zinc/80/85/19/1037808519.db2.gz QNSGJKIIMZSKIE-NWDGAFQWSA-N 2 0 337.389 4.279 20 0 EIADRP C[C@H]([NH2+]C(C)(C)CN[C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)c1ccccc1 ZINC000422733039 1037809528 /nfs/dbraw/zinc/80/95/28/1037809528.db2.gz QLWLXHJNNKYTJB-MJUUVYJYSA-N 2 0 343.559 4.016 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000422747401 1037823318 /nfs/dbraw/zinc/82/33/18/1037823318.db2.gz YLEUNGLZSPPJOR-HEHGZKQESA-N 2 0 347.503 4.296 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H](C)CCCC[NH3+] ZINC000422745140 1037824055 /nfs/dbraw/zinc/82/40/55/1037824055.db2.gz UOIBMBDLPJTDCZ-OLZOCXBDSA-N 2 0 335.492 4.426 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cc2ccccc2o1 ZINC000422768541 1037829005 /nfs/dbraw/zinc/82/90/05/1037829005.db2.gz NZUULJMBPZZYBU-VPKVUBIPSA-N 2 0 348.446 4.339 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422777827 1037830710 /nfs/dbraw/zinc/83/07/10/1037830710.db2.gz GHALVKVBOHPXRG-AZCLRUCKSA-N 2 0 336.479 4.296 20 0 EIADRP CC(C)[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1 ZINC000422776362 1037831097 /nfs/dbraw/zinc/83/10/97/1037831097.db2.gz AJAWCECDIATSAU-ILWGZMRPSA-N 2 0 336.479 4.229 20 0 EIADRP COc1cccc([C@H]([NH2+][C@H](C)CCC[NH3+])c2ccccc2Cl)c1 ZINC000422776015 1037831514 /nfs/dbraw/zinc/83/15/14/1037831514.db2.gz BVQRLMXSYKEFPU-KUHUBIRLSA-N 2 0 332.875 4.155 20 0 EIADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](c1cccs1)c1ccc(C(C)C)cc1 ZINC000422785208 1037833127 /nfs/dbraw/zinc/83/31/27/1037833127.db2.gz MWOZTSTVDIHXGJ-UYAOXDASSA-N 2 0 346.540 4.304 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H]3CC[NH2+]CC[C@H]3C)cc2)cs1 ZINC000422800629 1037836068 /nfs/dbraw/zinc/83/60/68/1037836068.db2.gz CLWURUFELMMDFY-QWQRMKEZSA-N 2 0 329.513 4.157 20 0 EIADRP C[C@@H](CC[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc(C(F)(F)F)c1 ZINC000422814880 1037836242 /nfs/dbraw/zinc/83/62/42/1037836242.db2.gz WIHNPOKDTOIZEH-QIXHYMPYSA-N 2 0 326.406 4.072 20 0 EIADRP c1cncc(-c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)cc2)c1 ZINC000422804313 1037838766 /nfs/dbraw/zinc/83/87/66/1037838766.db2.gz HJFFSRGAKQNWDR-BHDDXSALSA-N 2 0 335.495 4.149 20 0 EIADRP CCc1ccc(C(C)(C)C[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)cc1 ZINC000422832312 1037843189 /nfs/dbraw/zinc/84/31/89/1037843189.db2.gz FPDWOPFJRICSAD-OAHLLOKOSA-N 2 0 325.500 4.040 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CCCC[C@H]2[NH2+]C2CC[NH2+]CC2)cc1 ZINC000422831609 1037843206 /nfs/dbraw/zinc/84/32/06/1037843206.db2.gz WVLAQMDYYBJLML-DLBZAZTESA-N 2 0 326.406 4.073 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CN[C@H]3C[C@@H]([NH3+])c4ccccc43)cc2)C1 ZINC000422866969 1037848280 /nfs/dbraw/zinc/84/82/80/1037848280.db2.gz RGZOJHFOMMLFJE-ZQMYSKGWSA-N 2 0 349.522 4.153 20 0 EIADRP CCOc1ccccc1[C@H](CC)[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422880289 1037852817 /nfs/dbraw/zinc/85/28/17/1037852817.db2.gz NWHCAIDOLLPORS-BEFAXECRSA-N 2 0 327.472 4.049 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1-c1ccc(Cl)cc1Cl)C1C[NH2+]C1 ZINC000422883946 1037854897 /nfs/dbraw/zinc/85/48/97/1037854897.db2.gz DIXKCPCWMMBJBL-GFCCVEGCSA-N 2 0 335.278 4.358 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC1CCC(c2ccccc2)CC1 ZINC000422892217 1037856923 /nfs/dbraw/zinc/85/69/23/1037856923.db2.gz XVAWHNSOQUENTJ-VQSBYGRUSA-N 2 0 337.511 4.473 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](c1ccc(F)cc1F)C(C)C ZINC000422872392 1037859298 /nfs/dbraw/zinc/85/92/98/1037859298.db2.gz GYVYJMJYYRHFNN-BFUOFWGJSA-N 2 0 333.426 4.175 20 0 EIADRP CC(C)c1ccc(C[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422874719 1037861092 /nfs/dbraw/zinc/86/10/92/1037861092.db2.gz ASPAXCHLLICOHO-RBBKRZOGSA-N 2 0 336.479 4.156 20 0 EIADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1ccc2ccccc2c1 ZINC000422906304 1037863047 /nfs/dbraw/zinc/86/30/47/1037863047.db2.gz JNSOPAOGYZHLPB-PKTZIBPZSA-N 2 0 348.490 4.273 20 0 EIADRP c1ccc([C@@H]2OCCC[C@@H]2C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000422908797 1037863293 /nfs/dbraw/zinc/86/32/93/1037863293.db2.gz ZIADPJLVGMZWPH-YHINDDMVSA-N 2 0 342.527 4.055 20 0 EIADRP CC(C)(C[NH2+]C1CCC(C[NH3+])CC1)c1cccc(C(F)(F)F)c1 ZINC000422911724 1037865237 /nfs/dbraw/zinc/86/52/37/1037865237.db2.gz ULWZZEXHYBFDCF-UHFFFAOYSA-N 2 0 328.422 4.090 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC1(c2ccc(Cl)cc2)CCC1 ZINC000422912838 1037865461 /nfs/dbraw/zinc/86/54/61/1037865461.db2.gz WZVLLQXQOAEWKB-AWEZNQCLSA-N 2 0 343.902 4.275 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C(c1cccs1)c1cccs1 ZINC000422923111 1037871673 /nfs/dbraw/zinc/87/16/73/1037871673.db2.gz REMTWIIPRQCQQR-CYBMUJFWSA-N 2 0 343.521 4.412 20 0 EIADRP c1ccc([C@@H]2CCC[C@H]2[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422965837 1037879981 /nfs/dbraw/zinc/87/99/81/1037879981.db2.gz MBUKKSSYJFDNPG-SQMWVJLWSA-N 2 0 348.490 4.168 20 0 EIADRP c1cc(OC2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1 ZINC000422946885 1037884631 /nfs/dbraw/zinc/88/46/31/1037884631.db2.gz PQJBYDREJBWYIK-QHAWAJNXSA-N 2 0 328.500 4.018 20 0 EIADRP CCOc1ccc([C@@H]([NH2+][C@@H](C)CCCC[NH3+])c2ccccc2)cc1 ZINC000422946746 1037885243 /nfs/dbraw/zinc/88/52/43/1037885243.db2.gz PDUOQSAQRWITOD-UWJYYQICSA-N 2 0 326.484 4.282 20 0 EIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@@H](C)CCCC[NH3+])s2)cc1 ZINC000422984509 1037895536 /nfs/dbraw/zinc/89/55/36/1037895536.db2.gz YDCROLUKSJPNEH-KBPBESRZSA-N 2 0 347.528 4.295 20 0 EIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000423006232 1037899047 /nfs/dbraw/zinc/89/90/47/1037899047.db2.gz USEAIOWJEKYFRU-QCFAMHMHSA-N 2 0 330.516 4.055 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c2ccccc21 ZINC000423004707 1037899509 /nfs/dbraw/zinc/89/95/09/1037899509.db2.gz PUOPICHTKZLICW-BWWDHELJSA-N 2 0 348.490 4.471 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]CCc1csc(-c2ccc(Cl)cc2)n1 ZINC000423008380 1037899805 /nfs/dbraw/zinc/89/98/05/1037899805.db2.gz ABJLOMOBCSAQEC-ZDUSSCGKSA-N 2 0 337.920 4.113 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+][C@H]2C[C@H]([NH3+])c3ccccc32)C[N@@H+]1Cc1ccccc1 ZINC000423007047 1037899915 /nfs/dbraw/zinc/89/99/15/1037899915.db2.gz XCIZUZMXZAGSDI-FUAMJQMHSA-N 3 0 349.522 4.022 20 0 EIADRP FC(F)(F)c1ccccc1[C@@H]1CCC[C@H]1[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000423023320 1037908487 /nfs/dbraw/zinc/90/84/87/1037908487.db2.gz JMLQYNVXSFFPOS-IFHSXWPFSA-N 2 0 338.417 4.214 20 0 EIADRP C[C@H]([NH2+]C1CCC(C[NH3+])CC1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000423026213 1037909871 /nfs/dbraw/zinc/90/98/71/1037909871.db2.gz PRZQNZUFMMSOHR-DNDYEEKYSA-N 2 0 328.422 4.305 20 0 EIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)[C@@H](C)c1ccccc1C(F)(F)F ZINC000423022687 1037911681 /nfs/dbraw/zinc/91/16/81/1037911681.db2.gz IEIHEQBJWKLZSN-NLXYCFSDSA-N 2 0 326.406 4.070 20 0 EIADRP COc1c(Cl)cc(Cl)cc1CNC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000503805284 1037919470 /nfs/dbraw/zinc/91/94/70/1037919470.db2.gz USQLDDAAOLPVSV-UHFFFAOYSA-N 2 0 345.314 4.401 20 0 EIADRP Cc1cccc(C)c1[C@H](C)[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423041197 1037921884 /nfs/dbraw/zinc/92/18/84/1037921884.db2.gz WJSURXSWENLTEE-LRXVAGHRSA-N 2 0 336.479 4.210 20 0 EIADRP FC(F)(F)[C@H](C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1)c1ccccc1 ZINC000423067193 1037929035 /nfs/dbraw/zinc/92/90/35/1037929035.db2.gz YVEWCODUYFUTFN-ZJPYXAASSA-N 2 0 340.433 4.233 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1cc(F)cc(Br)c1 ZINC000423064187 1037929204 /nfs/dbraw/zinc/92/92/04/1037929204.db2.gz QUYSIMHCKZXHCG-MKBNYLNASA-N 2 0 343.284 4.017 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(Cl)c1 ZINC000423082216 1037945483 /nfs/dbraw/zinc/94/54/83/1037945483.db2.gz WPUQIYRVBOMEOS-LXGCGDOSSA-N 2 0 342.870 4.247 20 0 EIADRP [NH3+][C@@H]1CCCCC[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000423097294 1037952278 /nfs/dbraw/zinc/95/22/78/1037952278.db2.gz QRVGNSBVGNVHQQ-DZUCGIPZSA-N 2 0 326.406 4.201 20 0 EIADRP [NH3+][C@H]1CCCCC[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000423097295 1037954824 /nfs/dbraw/zinc/95/48/24/1037954824.db2.gz QRVGNSBVGNVHQQ-HJWJTTGWSA-N 2 0 326.406 4.201 20 0 EIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc(OCc2ccccc2)c1 ZINC000423075807 1037962671 /nfs/dbraw/zinc/96/26/71/1037962671.db2.gz PITRYDAEBQQZHV-XVSDAANHSA-N 2 0 336.479 4.199 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H]1CCCc2sc(Cl)cc21 ZINC000423126399 1037967605 /nfs/dbraw/zinc/96/76/05/1037967605.db2.gz ISIBCJAIYCFURJ-IAQYHMDHSA-N 2 0 335.904 4.292 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](c1ccc(F)c(Cl)c1)C1CC1 ZINC000423152421 1038001400 /nfs/dbraw/zinc/00/14/00/1038001400.db2.gz DZJKQPQIASUSLD-HXPMCKFVSA-N 2 0 347.865 4.443 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423209380 1038038609 /nfs/dbraw/zinc/03/86/09/1038038609.db2.gz FDBNHNNOPOVTAX-IJEWVQPXSA-N 2 0 328.422 4.004 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@@H]2CCCC[C@H]2OC(F)F)CC1 ZINC000503950147 1038041474 /nfs/dbraw/zinc/04/14/74/1038041474.db2.gz BIMNTVCRROYLHN-NRSFXHEJSA-N 2 0 344.490 4.170 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+]CC[C@@H]1CC[NH2+]C1)c1cccs1 ZINC000423239199 1038057530 /nfs/dbraw/zinc/05/75/30/1038057530.db2.gz AYGGPYARCQLOIK-WMLDXEAASA-N 2 0 334.916 4.275 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc(OC(F)(F)F)cc1 ZINC000423217807 1038060432 /nfs/dbraw/zinc/06/04/32/1038060432.db2.gz QMHYFKGHOJJRQT-NOLJZWGESA-N 2 0 330.394 4.014 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1)[C@H]1CCC[NH2+]C1 ZINC000423221722 1038066861 /nfs/dbraw/zinc/06/68/61/1038066861.db2.gz XULZJJLFIXHKMM-JXSMBQFASA-N 2 0 340.433 4.319 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000423233108 1038068748 /nfs/dbraw/zinc/06/87/48/1038068748.db2.gz NYNMIJJKHGXTDK-LHUBUQBQSA-N 2 0 326.406 4.201 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000423254149 1038085031 /nfs/dbraw/zinc/08/50/31/1038085031.db2.gz XHHXQJVTGGWNGZ-GOEBONIOSA-N 2 0 329.513 4.077 20 0 EIADRP COc1cc(OC)c([C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1Cl ZINC000423288956 1038091590 /nfs/dbraw/zinc/09/15/90/1038091590.db2.gz ACVUHPDJRKGZCL-STQMWFEESA-N 2 0 348.874 4.228 20 0 EIADRP CC(C)[C@H](COCc1ccccc1)[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000423293693 1038094867 /nfs/dbraw/zinc/09/48/67/1038094867.db2.gz RXUMSWWKBFPFQZ-UWJYYQICSA-N 2 0 326.484 4.037 20 0 EIADRP Cc1cc(Cl)c2c(c1)[C@@H]([NH2+]CCC1CC[NH+](C)CC1)CCCO2 ZINC000489514337 1038096247 /nfs/dbraw/zinc/09/62/47/1038096247.db2.gz HGWPFFWCXMZSNB-SFHVURJKSA-N 2 0 336.907 4.184 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cc(Br)cs2)cc1 ZINC000423293462 1038098318 /nfs/dbraw/zinc/09/83/18/1038098318.db2.gz RKBDMDIJOQPFMN-MNOVXSKESA-N 2 0 339.302 4.381 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2CCc3cc(Br)ccc32)cc1 ZINC000423293063 1038101363 /nfs/dbraw/zinc/10/13/63/1038101363.db2.gz POWLLTRYMFXMNI-XIKOKIGWSA-N 2 0 345.284 4.246 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423316346 1038112805 /nfs/dbraw/zinc/11/28/05/1038112805.db2.gz AMKCJGUOUZLCFN-OAHLLOKOSA-N 2 0 343.540 4.467 20 0 EIADRP CSC[C@H]([NH2+]CC1(C)CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1 ZINC000423317574 1038116497 /nfs/dbraw/zinc/11/64/97/1038116497.db2.gz BUVWVFZJIZGCTO-HNNXBMFYSA-N 2 0 346.462 4.089 20 0 EIADRP COc1cc([C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)ccc1SC ZINC000423295903 1038121287 /nfs/dbraw/zinc/12/12/87/1038121287.db2.gz XSQAJXOUXNRECJ-ZIAGYGMSSA-N 2 0 330.497 4.288 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2nc3ccc(Cl)cc3n2C)cc1 ZINC000423296005 1038122289 /nfs/dbraw/zinc/12/22/89/1038122289.db2.gz YEWKATMSCCHFQB-CHWSQXEVSA-N 2 0 342.874 4.097 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc(F)cc1OC(F)F ZINC000423296558 1038124548 /nfs/dbraw/zinc/12/45/48/1038124548.db2.gz ZKDLGKANRXVTBL-NWDGAFQWSA-N 2 0 338.373 4.298 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCCOc3c(Cl)cc(C)cc32)C1 ZINC000489585740 1038132353 /nfs/dbraw/zinc/13/23/53/1038132353.db2.gz AXIXHKAHGGQJLD-YJBOKZPZSA-N 2 0 336.907 4.184 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCOc3c(Cl)cc(C)cc32)C1 ZINC000489585736 1038134709 /nfs/dbraw/zinc/13/47/09/1038134709.db2.gz AXIXHKAHGGQJLD-CRAIPNDOSA-N 2 0 336.907 4.184 20 0 EIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423323033 1038138367 /nfs/dbraw/zinc/13/83/67/1038138367.db2.gz HYDGUIXYIYSBMG-AWEZNQCLSA-N 2 0 328.422 4.006 20 0 EIADRP CC1(C[NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC[NH2+]CC1 ZINC000423325383 1038143923 /nfs/dbraw/zinc/14/39/23/1038143923.db2.gz JOAINQIHQNTFRI-RDJZCZTQSA-N 2 0 340.433 4.321 20 0 EIADRP [NH3+][C@H](C[NH2+]C1CCC(c2cccc(C(F)(F)F)c2)CC1)C1CC1 ZINC000423335285 1038148616 /nfs/dbraw/zinc/14/86/16/1038148616.db2.gz XBLWGIMKXQOAIO-UAIPMZCESA-N 2 0 326.406 4.059 20 0 EIADRP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423370906 1038153328 /nfs/dbraw/zinc/15/33/28/1038153328.db2.gz GAKKDUHJNHQIKE-CYBMUJFWSA-N 2 0 330.859 4.193 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[NH2+][C@H](C)C1 ZINC000423374827 1038155643 /nfs/dbraw/zinc/15/56/43/1038155643.db2.gz KBTFNHLSYHICRN-BFQNTYOBSA-N 2 0 333.476 4.049 20 0 EIADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+][C@H](Cc1ccccc1Cl)c1cccs1 ZINC000423362615 1038177572 /nfs/dbraw/zinc/17/75/72/1038177572.db2.gz BIWMMTFTMIXDKU-KBRIMQKVSA-N 2 0 334.916 4.273 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(Br)cc1 ZINC000423366562 1038186528 /nfs/dbraw/zinc/18/65/28/1038186528.db2.gz XWRYCPFKOGWSHW-GOSISDBHSA-N 2 0 345.284 4.293 20 0 EIADRP COc1ccc2oc([C@H](C)[NH2+]Cc3ccc4c(c3)C[NH2+]C4)c(C)c2c1 ZINC000423375001 1038206204 /nfs/dbraw/zinc/20/62/04/1038206204.db2.gz INYNVHNHEJLWQB-AWEZNQCLSA-N 2 0 336.435 4.204 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(Br)cc1F ZINC000423402173 1038215655 /nfs/dbraw/zinc/21/56/55/1038215655.db2.gz WJLHOUDZSRPWOX-NSHDSACASA-N 2 0 349.247 4.042 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000423402121 1038216294 /nfs/dbraw/zinc/21/62/94/1038216294.db2.gz WFYHXLDGNIMRJI-AOIWGVFYSA-N 2 0 346.421 4.237 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+][C@@H]3C[C@H]3C3CC[NH2+]CC3)cs2)cs1 ZINC000423449389 1038227603 /nfs/dbraw/zinc/22/76/03/1038227603.db2.gz WIYFFXISDWLVPM-XFBWCDHKSA-N 2 0 347.553 4.219 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000423431910 1038232430 /nfs/dbraw/zinc/23/24/30/1038232430.db2.gz MBVILGUOVOMXGI-KMFMINBZSA-N 2 0 328.422 4.449 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)cc1OC ZINC000423455439 1038238557 /nfs/dbraw/zinc/23/85/57/1038238557.db2.gz FDQXYTBMLOMXPT-XYJFISCASA-N 2 0 334.504 4.042 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H](C)CCC[NH3+])CCC3)cc1 ZINC000423458984 1038240789 /nfs/dbraw/zinc/24/07/89/1038240789.db2.gz QTVWHLBHAIEAKU-GOEBONIOSA-N 2 0 329.513 4.213 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1ccccc1Br ZINC000423461581 1038241234 /nfs/dbraw/zinc/24/12/34/1038241234.db2.gz SYDZGXLSRIDLPS-KBXCAEBGSA-N 2 0 347.300 4.256 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]C(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000423464762 1038241896 /nfs/dbraw/zinc/24/18/96/1038241896.db2.gz HFQWHTSXVXCUEI-IFXJQAMLSA-N 2 0 330.422 4.161 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H](c2ccc(Br)cc2)C2CC2)C1 ZINC000423461974 1038242465 /nfs/dbraw/zinc/24/24/65/1038242465.db2.gz DBEUEJMHKIRWER-JLZZUVOBSA-N 2 0 337.305 4.007 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1csc(-c2ccccc2F)n1 ZINC000423468192 1038244743 /nfs/dbraw/zinc/24/47/43/1038244743.db2.gz JOGMSOGZHRKHGX-IHRRRGAJSA-N 2 0 333.476 4.117 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000423470721 1038247749 /nfs/dbraw/zinc/24/77/49/1038247749.db2.gz LUTGWGKHJWBQON-ZACQAIPSSA-N 2 0 327.516 4.331 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000423478565 1038249231 /nfs/dbraw/zinc/24/92/31/1038249231.db2.gz TYBNDJBLPOVVMF-CSMYWGQOSA-N 2 0 326.406 4.264 20 0 EIADRP CSC[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1 ZINC000423479221 1038251710 /nfs/dbraw/zinc/25/17/10/1038251710.db2.gz USAMWMDXUYILCJ-RCBQFDQVSA-N 2 0 346.462 4.217 20 0 EIADRP Brc1ccc([C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)C2CC2)cc1 ZINC000423480971 1038251740 /nfs/dbraw/zinc/25/17/40/1038251740.db2.gz NVXUVOMWRHNOIS-DLBZAZTESA-N 2 0 337.305 4.022 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1cccc(Br)c1 ZINC000423454255 1038253828 /nfs/dbraw/zinc/25/38/28/1038253828.db2.gz BZCMADQJCLKPBP-WQVCFCJDSA-N 2 0 325.294 4.007 20 0 EIADRP COC[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(Cl)cc1 ZINC000423499397 1038254295 /nfs/dbraw/zinc/25/42/95/1038254295.db2.gz AVHGZUQEQWDIAM-OALUTQOASA-N 2 0 332.875 4.097 20 0 EIADRP Brc1ccc([C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)C2CC2)s1 ZINC000423486861 1038260501 /nfs/dbraw/zinc/26/05/01/1038260501.db2.gz SWDBUKNNFKASCD-SWLSCSKDSA-N 2 0 343.334 4.084 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@@H](C[NH3+])C1 ZINC000423489313 1038261737 /nfs/dbraw/zinc/26/17/37/1038261737.db2.gz FXFZOMLJXFDSNT-YSVLISHTSA-N 2 0 329.513 4.205 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000423495635 1038264441 /nfs/dbraw/zinc/26/44/41/1038264441.db2.gz CFVLINSCAOBYAL-CBGDNZLLSA-N 2 0 326.484 4.257 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000423496255 1038265672 /nfs/dbraw/zinc/26/56/72/1038265672.db2.gz GGWSAGJGXRCVAU-LJHODMEESA-N 2 0 346.421 4.094 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+]C2CCC(c3cccc(C(F)(F)F)c3)CC2)C1 ZINC000423513816 1038269985 /nfs/dbraw/zinc/26/99/85/1038269985.db2.gz ROHWGCXWTPVDIY-YHDCKOJYSA-N 2 0 340.433 4.449 20 0 EIADRP COc1cc(C)c([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1OC ZINC000423516993 1038271108 /nfs/dbraw/zinc/27/11/08/1038271108.db2.gz YJEAOLWALIJDFK-VQIMIIECSA-N 2 0 342.483 4.143 20 0 EIADRP [NH3+]C[C@H]1CC[C@H]([NH2+]C2CCC(c3cccc(C(F)(F)F)c3)CC2)C1 ZINC000423513813 1038271999 /nfs/dbraw/zinc/27/19/99/1038271999.db2.gz ROHWGCXWTPVDIY-DKVDKTFMSA-N 2 0 340.433 4.449 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21)c1ccccc1 ZINC000423522249 1038273004 /nfs/dbraw/zinc/27/30/04/1038273004.db2.gz UHTDRJNJVYIIJV-HZPDHXFCSA-N 2 0 334.385 4.161 20 0 EIADRP [NH3+]C1(C[NH2+]C2CCC(OC3CCCC3)CC2)C2CC3CC(C2)CC1C3 ZINC000423521546 1038274069 /nfs/dbraw/zinc/27/40/69/1038274069.db2.gz GFEAMELZYUBMSC-UHFFFAOYSA-N 2 0 346.559 4.000 20 0 EIADRP Cc1c([C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cnn1C(C)(C)C ZINC000423521104 1038275006 /nfs/dbraw/zinc/27/50/06/1038275006.db2.gz SDWFVKKERHJLCC-BEFAXECRSA-N 2 0 328.504 4.077 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H](Cc2ccccc2Cl)c2ccsc2)C1 ZINC000423522167 1038279733 /nfs/dbraw/zinc/27/97/33/1038279733.db2.gz XOQQEHVAMGHYKM-RPVQJOFSSA-N 2 0 334.916 4.402 20 0 EIADRP CSC[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(C(F)(F)F)cc1 ZINC000423535026 1038285465 /nfs/dbraw/zinc/28/54/65/1038285465.db2.gz BPLRSANRMQUDKJ-MRXNPFEDSA-N 2 0 344.446 4.009 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423535271 1038286469 /nfs/dbraw/zinc/28/64/69/1038286469.db2.gz CMNWKZXGGRJZPA-CQSZACIVSA-N 2 0 327.497 4.079 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc2cc(OC)ccc2c1 ZINC000423537923 1038287172 /nfs/dbraw/zinc/28/71/72/1038287172.db2.gz DWZXAPZJIWBCMY-VMBXEPDQSA-N 2 0 338.495 4.277 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423536171 1038287380 /nfs/dbraw/zinc/28/73/80/1038287380.db2.gz GXXXGXNXEKODPP-HNNXBMFYSA-N 2 0 341.524 4.387 20 0 EIADRP Fc1ccc(C([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)c2ccc(F)cc2)cc1 ZINC000423540607 1038288515 /nfs/dbraw/zinc/28/85/15/1038288515.db2.gz KALRFJHKYJTQMZ-ABSDTBQOSA-N 2 0 342.433 4.032 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423544578 1038290046 /nfs/dbraw/zinc/29/00/46/1038290046.db2.gz OLPDIWZYMLHIRJ-ZJPYXAASSA-N 2 0 339.527 4.202 20 0 EIADRP Cc1cccc([C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@@H]3C2)c2cccc(F)c2)c1 ZINC000423548850 1038292845 /nfs/dbraw/zinc/29/28/45/1038292845.db2.gz MYNQAIGNCXJWNG-KIZRIRGWSA-N 2 0 338.470 4.201 20 0 EIADRP FC(F)Oc1ccc([C@H](NCCC[NH2+]C2CC2)c2ccccc2)cc1 ZINC000423556916 1038294048 /nfs/dbraw/zinc/29/40/48/1038294048.db2.gz NBOOFVKFAYMBSS-LJQANCHMSA-N 2 0 346.421 4.109 20 0 EIADRP C[C@H]([NH2+][C@H]1CSCc2ccccc21)c1cccc(C[NH+](C)C)c1 ZINC000924850104 1038325952 /nfs/dbraw/zinc/32/59/52/1038325952.db2.gz QURGSSKUBFBGLA-YWZLYKJASA-N 2 0 326.509 4.387 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000490142363 1038356963 /nfs/dbraw/zinc/35/69/63/1038356963.db2.gz HQCGKGURPLNTDJ-IBGZPJMESA-N 2 0 334.866 4.500 20 0 EIADRP C[N@H+](Cc1ccccc1)[C@H]1CCN(c2cc[nH+]c3cc(F)ccc32)C1 ZINC000608092839 1038604089 /nfs/dbraw/zinc/60/40/89/1038604089.db2.gz PUQXSJKEBGMKHF-SFHVURJKSA-N 2 0 335.426 4.085 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H](CC2CCOCC2)c2ccc(F)cc2)CC1 ZINC001168311884 1038782192 /nfs/dbraw/zinc/78/21/92/1038782192.db2.gz CZPLGIUETJPTMB-XVAXZDLZSA-N 2 0 348.506 4.146 20 0 EIADRP CC(C)(C[NH2+][C@H](Cc1ccncc1)c1cccs1)C[NH+]1CCCC1 ZINC000424280940 1038790384 /nfs/dbraw/zinc/79/03/84/1038790384.db2.gz MPLVFPGAFVMOKG-GOSISDBHSA-N 2 0 343.540 4.139 20 0 EIADRP CCCCCOc1ccc([C@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000480769819 1038799012 /nfs/dbraw/zinc/79/90/12/1038799012.db2.gz MQSLKWJNMVCVTM-ZWKOTPCHSA-N 2 0 330.516 4.391 20 0 EIADRP c1ccc2c(c1)sc1c2CCC[C@@H]1[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000480758670 1038800708 /nfs/dbraw/zinc/80/07/08/1038800708.db2.gz NRWBESLRUYPHRP-KDOFPFPSSA-N 2 0 326.509 4.353 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(F)cc1Cl ZINC000539072157 1038822113 /nfs/dbraw/zinc/82/21/13/1038822113.db2.gz VEDDCVFJGJBYBI-ZNMIVQPWSA-N 2 0 342.886 4.019 20 0 EIADRP C[NH+](C)C1CCC([NH+]2CCC(c3noc4ccc(F)cc43)CC2)CC1 ZINC001168324376 1038874399 /nfs/dbraw/zinc/87/43/99/1038874399.db2.gz NAEQXNYPJHADPG-UHFFFAOYSA-N 2 0 345.462 4.019 20 0 EIADRP c1ccc(CCN2CCC([NH2+][C@@H]3CC[C@H]4CCC[C@H]4C3)CC2)cc1 ZINC000462120572 1038938361 /nfs/dbraw/zinc/93/83/61/1038938361.db2.gz UKPSHLOKUJQFIP-RZUBCFFCSA-N 2 0 326.528 4.252 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](CC)c2cccc(Br)c2)C1 ZINC000481024775 1038963422 /nfs/dbraw/zinc/96/34/22/1038963422.db2.gz NJPQJONRZQKKHC-RHSMWYFYSA-N 2 0 339.321 4.222 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000481044562 1038977830 /nfs/dbraw/zinc/97/78/30/1038977830.db2.gz WDKGSIHUBXYCAM-SJORKVTESA-N 2 0 344.474 4.048 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(SCC(F)F)cc2)C1 ZINC000481040999 1038988151 /nfs/dbraw/zinc/98/81/51/1038988151.db2.gz RXZBAZFQRMVTPS-GJZGRUSLSA-N 2 0 342.499 4.426 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(SCC(F)F)cc2)C1 ZINC000481041001 1038988681 /nfs/dbraw/zinc/98/86/81/1038988681.db2.gz RXZBAZFQRMVTPS-HUUCEWRRSA-N 2 0 342.499 4.426 20 0 EIADRP CC[C@@H]1CCC[C@H]1[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000539394932 1039030797 /nfs/dbraw/zinc/03/07/97/1039030797.db2.gz AISZRCPHIFQRIW-BHIYHBOVSA-N 2 0 328.500 4.143 20 0 EIADRP CCCOc1ccc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1OCC ZINC000414811586 1039065944 /nfs/dbraw/zinc/06/59/44/1039065944.db2.gz PTUPVOJKSHFSNZ-INIZCTEOSA-N 2 0 342.483 4.184 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]Cc2ccc(-c3ccco3)cc2F)[C@H]2CCC[C@@H]21 ZINC000552057358 1039076490 /nfs/dbraw/zinc/07/64/90/1039076490.db2.gz QDNPBNQPRRABEN-NEWSRXKRSA-N 2 0 328.431 4.048 20 0 EIADRP CC(C)CCOc1ccc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000414815109 1039090626 /nfs/dbraw/zinc/09/06/26/1039090626.db2.gz WUSFANUZBVVUIT-KRWDZBQOSA-N 2 0 326.484 4.421 20 0 EIADRP CSc1ccccc1C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000481187263 1039092836 /nfs/dbraw/zinc/09/28/36/1039092836.db2.gz ZAKFLJTZFYBXGZ-FXAWDEMLSA-N 2 0 340.536 4.409 20 0 EIADRP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1cccc(OC(F)F)c1 ZINC000120546861 1039154012 /nfs/dbraw/zinc/15/40/12/1039154012.db2.gz DSVRXSYYOJYNPI-GFCCVEGCSA-N 2 0 326.431 4.248 20 0 EIADRP COc1ccc2cc(C[NH2+]CCC[NH+]3CCC(C)CC3)ccc2c1 ZINC000061558279 1039223536 /nfs/dbraw/zinc/22/35/36/1039223536.db2.gz VDEVTHRGSNWNJU-UHFFFAOYSA-N 2 0 326.484 4.060 20 0 EIADRP CCC[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccccc1 ZINC000481305073 1039251981 /nfs/dbraw/zinc/25/19/81/1039251981.db2.gz KAUYWXOSOSBEAU-NRFANRHFSA-N 2 0 326.484 4.258 20 0 EIADRP CC[C@H](Cc1ccc(Cl)cc1Cl)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414838492 1039283864 /nfs/dbraw/zinc/28/38/64/1039283864.db2.gz WXEAYVXAWKNOMX-JZWPEALZSA-N 2 0 327.299 4.187 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)[C@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000481322925 1039288238 /nfs/dbraw/zinc/28/82/38/1039288238.db2.gz NYEMHFXCEYJGSL-MELADBBJSA-N 2 0 345.314 4.081 20 0 EIADRP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C[C@@H]1CC[N@H+](CC)C1 ZINC000481339689 1039319980 /nfs/dbraw/zinc/31/99/80/1039319980.db2.gz QZXOQCIGDRZKGU-HOCLYGCPSA-N 2 0 326.937 4.142 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](C[C@@H](OC)c2ccc(Cl)cc2)CC1 ZINC000513960617 1039400783 /nfs/dbraw/zinc/40/07/83/1039400783.db2.gz LISDIAJOKGVZJU-LJQANCHMSA-N 2 0 338.923 4.081 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](C2CCC2)CC1)c1ccc(-c2ccncc2)cc1 ZINC000481429149 1039414859 /nfs/dbraw/zinc/41/48/59/1039414859.db2.gz BZJXBDHTWFXJAH-QGZVFWFLSA-N 2 0 335.495 4.416 20 0 EIADRP C[N@@H+]1CCC[C@]2(CC[NH+](CCCSc3ccccc3Cl)C2)C1 ZINC000555598341 1039424652 /nfs/dbraw/zinc/42/46/52/1039424652.db2.gz XTCHPSXKTQDHJU-SFHVURJKSA-N 2 0 338.948 4.240 20 0 EIADRP Clc1ccc(C[NH2+]CCCCC[NH+]2CCCC2)c2ncccc12 ZINC000555612127 1039447506 /nfs/dbraw/zinc/44/75/06/1039447506.db2.gz SFFSEDUOFJPAOV-UHFFFAOYSA-N 2 0 331.891 4.244 20 0 EIADRP CCc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)o1 ZINC000481560058 1039582491 /nfs/dbraw/zinc/58/24/91/1039582491.db2.gz VOXZJQQYYUECLX-QGZVFWFLSA-N 2 0 326.484 4.405 20 0 EIADRP CCc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)o1 ZINC000481560057 1039583065 /nfs/dbraw/zinc/58/30/65/1039583065.db2.gz VOXZJQQYYUECLX-KRWDZBQOSA-N 2 0 326.484 4.405 20 0 EIADRP COc1ccccc1C[NH+]1CCC(C[N@H+](C)Cc2ccccc2)CC1 ZINC000514086635 1039589762 /nfs/dbraw/zinc/58/97/62/1039589762.db2.gz BVJZTRMABOUNPC-UHFFFAOYSA-N 2 0 338.495 4.039 20 0 EIADRP CCOCCCC[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000514103472 1039610493 /nfs/dbraw/zinc/61/04/93/1039610493.db2.gz CIONWXYZOWWFHF-FDFHNCONSA-N 2 0 344.543 4.084 20 0 EIADRP Clc1sc(Cl)c2c1CCC[C@@H]2[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000643536949 1039745405 /nfs/dbraw/zinc/74/54/05/1039745405.db2.gz XLZAWOZYFUOROT-WDEREUQCSA-N 2 0 331.312 4.164 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccc(C)cc1 ZINC000481732054 1039793548 /nfs/dbraw/zinc/79/35/48/1039793548.db2.gz WSRQUERHCZPNNP-FQEVSTJZSA-N 2 0 326.484 4.176 20 0 EIADRP Fc1ccc([C@@H]([NH2+]CCCCC[NH+]2CCCC2)c2cccnc2)cc1 ZINC000550882955 1039809308 /nfs/dbraw/zinc/80/93/08/1039809308.db2.gz UDVPIZLAZNWBJJ-OAQYLSRUSA-N 2 0 341.474 4.166 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CC(C)(C)c2ccccc21 ZINC000481748629 1039810664 /nfs/dbraw/zinc/81/06/64/1039810664.db2.gz UXKQXCFMHODOHJ-HXUWFJFHSA-N 2 0 338.495 4.139 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CC(C)(C)c2ccccc21 ZINC000481748626 1039811034 /nfs/dbraw/zinc/81/10/34/1039811034.db2.gz UXKQXCFMHODOHJ-FQEVSTJZSA-N 2 0 338.495 4.139 20 0 EIADRP Clc1ccc(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)s1 ZINC000552880247 1039855973 /nfs/dbraw/zinc/85/59/73/1039855973.db2.gz XKTGRIDBDJDOPQ-UHFFFAOYSA-N 2 0 326.937 4.331 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)c1ccc(SCC(F)(F)F)cc1 ZINC000481959268 1039913173 /nfs/dbraw/zinc/91/31/73/1039913173.db2.gz LGFASBVGDLLKOE-CHWSQXEVSA-N 2 0 334.451 4.332 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000481955122 1039913791 /nfs/dbraw/zinc/91/37/91/1039913791.db2.gz SULWTDFXNQHYQV-CJNGLKHVSA-N 2 0 347.503 4.256 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cnc(-c3ccccc3)s2)CC1 ZINC000535083288 1039924465 /nfs/dbraw/zinc/92/44/65/1039924465.db2.gz STZUBFOVMWQWPB-UHFFFAOYSA-N 2 0 343.540 4.362 20 0 EIADRP COC1CCC(C)(C[NH2+][C@H]2CCN(C)[C@@H](c3ccccc3)C2)CC1 ZINC000551175563 1040018064 /nfs/dbraw/zinc/01/80/64/1040018064.db2.gz MTYKFPLPLPEVBW-JJBAYQRUSA-N 2 0 330.516 4.007 20 0 EIADRP C[NH+](C)CCCOc1cnccc1C[NH2+][C@@H]1CCCCC12CCCC2 ZINC000551197211 1040056979 /nfs/dbraw/zinc/05/69/79/1040056979.db2.gz CTXTUSNEXGFWER-HXUWFJFHSA-N 2 0 345.531 4.005 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000551267689 1040130049 /nfs/dbraw/zinc/13/00/49/1040130049.db2.gz SLEAXSPUKYIQAD-SJORKVTESA-N 2 0 339.527 4.298 20 0 EIADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1cc(Cl)ccc1OC(F)F ZINC000482350845 1040187953 /nfs/dbraw/zinc/18/79/53/1040187953.db2.gz VZOFWWNFXOTLGV-LBPRGKRZSA-N 2 0 346.849 4.324 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc(F)c1 ZINC000482442768 1040250367 /nfs/dbraw/zinc/25/03/67/1040250367.db2.gz XCIACAPNNAVCIN-PKOBYXMFSA-N 2 0 326.459 4.041 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000479406160 1040328697 /nfs/dbraw/zinc/32/86/97/1040328697.db2.gz BGQAZRGKSTTYII-NRFANRHFSA-N 2 0 326.459 4.445 20 0 EIADRP C[C@@H]([NH2+]C[C@H](C)N1CC[NH+](C)CC1)c1ccc(C2CCCCC2)cc1 ZINC000482555431 1040357582 /nfs/dbraw/zinc/35/75/82/1040357582.db2.gz RCJGLSDLDBBLEY-RBUKOAKNSA-N 2 0 343.559 4.021 20 0 EIADRP C[C@@H](Cc1c(Cl)cccc1Cl)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995701 1040392320 /nfs/dbraw/zinc/39/23/20/1040392320.db2.gz WWJXPZNWKYHUTC-STQMWFEESA-N 2 0 327.299 4.189 20 0 EIADRP CC(C)[C@H](CSc1ccccc1)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000479522501 1040421352 /nfs/dbraw/zinc/42/13/52/1040421352.db2.gz BLVLYOICUAAIJZ-QLOJAFMTSA-N 2 0 332.557 4.410 20 0 EIADRP CC[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551572365 1040421252 /nfs/dbraw/zinc/42/12/52/1040421252.db2.gz IWOWZDWQTVLZHI-RXVVDRJESA-N 2 0 330.516 4.218 20 0 EIADRP C[C@H]([NH2+]CCCc1ccccc1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000479528651 1040426968 /nfs/dbraw/zinc/42/69/68/1040426968.db2.gz JMBRLDXZDHQGEE-KRWDZBQOSA-N 2 0 344.474 4.050 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000482900172 1040563501 /nfs/dbraw/zinc/56/35/01/1040563501.db2.gz ZSZUDPRLLPYMHH-YLJYHZDGSA-N 2 0 338.495 4.008 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[N@@H+]2C2CCCCC2)C1 ZINC000435742449 1040595333 /nfs/dbraw/zinc/59/53/33/1040595333.db2.gz NMMVJGFXELBHPM-VYDXJSESSA-N 2 0 332.454 4.494 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH+]2CCC[C@H]3C[N@H+](C)CC[C@@H]32)cc1 ZINC000668172369 1040604859 /nfs/dbraw/zinc/60/48/59/1040604859.db2.gz MCQRXBFJLKWDCD-OALUTQOASA-N 2 0 341.524 4.035 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccnc3ccccc23)c1 ZINC000539710572 1040719547 /nfs/dbraw/zinc/71/95/47/1040719547.db2.gz UAEXHFBUEYYURN-UHFFFAOYSA-N 2 0 333.479 4.365 20 0 EIADRP FC(F)(F)c1cccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167959818 1040722192 /nfs/dbraw/zinc/72/21/92/1040722192.db2.gz SMGZOSLADIPJFF-AYHJJNSGSA-N 2 0 338.417 4.200 20 0 EIADRP C[C@@H]([NH2+]CCSc1ccccc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000479904088 1040761084 /nfs/dbraw/zinc/76/10/84/1040761084.db2.gz STIQHMYILBQJPZ-QGZVFWFLSA-N 2 0 344.524 4.070 20 0 EIADRP CCC[C@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000483258616 1040795196 /nfs/dbraw/zinc/79/51/96/1040795196.db2.gz NJGSIKZABLLINO-PXNSSMCTSA-N 2 0 345.531 4.166 20 0 EIADRP CCCOc1ccc(C[N@H+](C)[C@H]2CC[NH+](CC)C[C@H]2C)cc1OCC ZINC000539817501 1040812577 /nfs/dbraw/zinc/81/25/77/1040812577.db2.gz OJNBFMMYFKFRMO-MJGOQNOKSA-N 2 0 348.531 4.036 20 0 EIADRP CN(C/C=C\c1ccc(F)cc1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000539834037 1040828427 /nfs/dbraw/zinc/82/84/27/1040828427.db2.gz WFTRWPXVSWSNQU-DPVXCJKMSA-N 2 0 338.470 4.293 20 0 EIADRP CN(C/C=C/c1ccc(F)cc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000539834040 1040828480 /nfs/dbraw/zinc/82/84/80/1040828480.db2.gz WFTRWPXVSWSNQU-WKOQKXSESA-N 2 0 338.470 4.293 20 0 EIADRP c1ccc([C@H](CC2CC2)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000537935666 1040898043 /nfs/dbraw/zinc/89/80/43/1040898043.db2.gz AUZPNYTYKBZPAZ-QFIPXVFZSA-N 2 0 335.495 4.429 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CC2(c3ccc(Cl)cc3Cl)CCC2)CC[N@@H+]1C ZINC000537964483 1040937679 /nfs/dbraw/zinc/93/76/79/1040937679.db2.gz RYNOQPCATQMHGK-ZFWWWQNUSA-N 2 0 341.326 4.487 20 0 EIADRP Cc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000537981113 1040953336 /nfs/dbraw/zinc/95/33/36/1040953336.db2.gz XVCHPLRVYUZQGC-JTSKRJEESA-N 2 0 338.495 4.274 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(COc3ccccc3)cc2)[C@@H](C)C1 ZINC000537989794 1040967257 /nfs/dbraw/zinc/96/72/57/1040967257.db2.gz FCLMZIYQTIDAFK-AVRDEDQJSA-N 2 0 338.495 4.086 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2cc(C)ccc2OC(F)F)CC1 ZINC000483725069 1040976789 /nfs/dbraw/zinc/97/67/89/1040976789.db2.gz DJIKHLLIMYFYQB-HNNXBMFYSA-N 2 0 340.458 4.369 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000379740220 1040989231 /nfs/dbraw/zinc/98/92/31/1040989231.db2.gz HWPIKSPXGYGELJ-GHTZIAJQSA-N 2 0 326.459 4.389 20 0 EIADRP C[C@@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(C2CCCCC2)cc1 ZINC000480149117 1041004713 /nfs/dbraw/zinc/00/47/13/1041004713.db2.gz NHUINXGZCVWSOX-LJQANCHMSA-N 2 0 343.559 4.022 20 0 EIADRP F[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000554374165 1041058921 /nfs/dbraw/zinc/05/89/21/1041058921.db2.gz PKOFMVVZQXZXPM-YMQHIKHWSA-N 2 0 330.491 4.157 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000436295646 1041061256 /nfs/dbraw/zinc/06/12/56/1041061256.db2.gz SAXRPIIMVNJIGV-RZDIXWSQSA-N 2 0 340.433 4.415 20 0 EIADRP C[C@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000480244551 1041100563 /nfs/dbraw/zinc/10/05/63/1041100563.db2.gz VMXBQDHDJWRSKK-KSFYIVLOSA-N 2 0 338.470 4.445 20 0 EIADRP CC[C@H]([NH2+]CC1(CC)CC[NH+](Cc2ccccc2)CC1)[C@H]1CCOC1 ZINC000540143271 1041165222 /nfs/dbraw/zinc/16/52/22/1041165222.db2.gz OEAZXJIIGDBTEB-SFTDATJTSA-N 2 0 344.543 4.084 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+]Cc2ccc(-c3cccc(F)c3F)o2)CC1 ZINC000480291415 1041167790 /nfs/dbraw/zinc/16/77/90/1041167790.db2.gz ILDLCVZARKTQRP-UHFFFAOYSA-N 2 0 334.410 4.046 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000484280789 1041185211 /nfs/dbraw/zinc/18/52/11/1041185211.db2.gz TXDAZEMWWUPJOA-JSGCOSHPSA-N 2 0 333.303 4.001 20 0 EIADRP COc1ccc2oc([C@@H](C)[NH2+]CCCNc3ccccn3)c(C)c2c1 ZINC000484305083 1041192127 /nfs/dbraw/zinc/19/21/27/1041192127.db2.gz UMBALGDVJGJIRE-OAHLLOKOSA-N 2 0 339.439 4.298 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cc2cc(C)c(C)cc2o1 ZINC000484299172 1041201881 /nfs/dbraw/zinc/20/18/81/1041201881.db2.gz DSUOWGFDLAGAPL-WMZOPIPTSA-N 2 0 332.488 4.057 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cc2cc(C)c(C)cc2o1 ZINC000484299171 1041202414 /nfs/dbraw/zinc/20/24/14/1041202414.db2.gz DSUOWGFDLAGAPL-SJLPKXTDSA-N 2 0 332.488 4.057 20 0 EIADRP C[C@@H]([NH2+]Cc1cc2c(cccc2F)[nH]1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000436399879 1041203166 /nfs/dbraw/zinc/20/31/66/1041203166.db2.gz GUVWAWGODCBOAG-CABCVRRESA-N 2 0 329.463 4.050 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc2ccccc21 ZINC000540169038 1041211977 /nfs/dbraw/zinc/21/19/77/1041211977.db2.gz JJQUMKAGIHPQNS-CEXWTWQISA-N 2 0 340.511 4.380 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3c2cccc3F)c1 ZINC000540172618 1041216946 /nfs/dbraw/zinc/21/69/46/1041216946.db2.gz PNJHRZVJFBXPCX-OAQYLSRUSA-N 2 0 326.459 4.443 20 0 EIADRP CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc[nH+]c2cc(F)ccc21 ZINC000463063265 1041295431 /nfs/dbraw/zinc/29/54/31/1041295431.db2.gz GPXDTBCOAXLMFE-SFHVURJKSA-N 2 0 349.453 4.332 20 0 EIADRP CC(C)[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000538406111 1041303564 /nfs/dbraw/zinc/30/35/64/1041303564.db2.gz PPKJVDBDNSBFPI-KRWDZBQOSA-N 2 0 326.406 4.254 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)CC1 ZINC000538408322 1041325267 /nfs/dbraw/zinc/32/52/67/1041325267.db2.gz XUZLALRVQFYHCL-IBGZPJMESA-N 2 0 326.484 4.065 20 0 EIADRP COc1ccc([C@@H]([NH2+]CCCCC[NH+]2CCCCC2)C2CC2)cc1 ZINC000540300615 1041352895 /nfs/dbraw/zinc/35/28/95/1041352895.db2.gz FCLDHVAQAXXRCM-NRFANRHFSA-N 2 0 330.516 4.392 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)C1 ZINC000540301595 1041353131 /nfs/dbraw/zinc/35/31/31/1041353131.db2.gz LQUYJOUCDUESDK-YVEFUNNKSA-N 2 0 327.299 4.376 20 0 EIADRP Cc1cc(C[NH2+]C2CCN(CCc3ccc(F)cc3)CC2)ccc1F ZINC000463136459 1041370881 /nfs/dbraw/zinc/37/08/81/1041370881.db2.gz FCNCQIYERBXCKX-UHFFFAOYSA-N 2 0 344.449 4.070 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000463141463 1041375527 /nfs/dbraw/zinc/37/55/27/1041375527.db2.gz ZDONDTLABANVOK-JAXLGGSGSA-N 2 0 345.575 4.140 20 0 EIADRP CC(C)C[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)CCO1 ZINC000538579550 1041430910 /nfs/dbraw/zinc/43/09/10/1041430910.db2.gz XACSQFSAXHDBFI-OYNPSCLESA-N 2 0 336.564 4.213 20 0 EIADRP CSc1cccc([C@@H]([NH2+]C2CC(C[NH3+])C2)c2cc(F)ccc2F)c1 ZINC000904362651 1041450885 /nfs/dbraw/zinc/45/08/85/1041450885.db2.gz QKBFXRAMIAWVHK-UZABCXPZSA-N 2 0 348.462 4.103 20 0 EIADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)[C@H]1C ZINC000540467221 1041472661 /nfs/dbraw/zinc/47/26/61/1041472661.db2.gz DTIWEAGNBNALIW-UMGGQSCQSA-N 2 0 342.527 4.389 20 0 EIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2(Cc3ccccc3)CC2)CC1 ZINC000480689172 1041473350 /nfs/dbraw/zinc/47/33/50/1041473350.db2.gz MBMGMIIJJJBMKF-GHTZIAJQSA-N 2 0 326.528 4.394 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)C2=CCCCC2)[C@H](C)C1 ZINC000480693761 1041475614 /nfs/dbraw/zinc/47/56/14/1041475614.db2.gz NDDNXLGUXHNUAM-UYAOXDASSA-N 2 0 336.564 4.240 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)C2=CCCCC2)[C@@H](C)C1 ZINC000480693757 1041476174 /nfs/dbraw/zinc/47/61/74/1041476174.db2.gz NDDNXLGUXHNUAM-ICSRJNTNSA-N 2 0 336.564 4.240 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)[C@@H]1CCOC1 ZINC000480732584 1041496985 /nfs/dbraw/zinc/49/69/85/1041496985.db2.gz ZFZAYCFHVHXCDI-OSZJIOELSA-N 2 0 344.543 4.069 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H](C)c1ccc(F)cc1 ZINC000480731798 1041505605 /nfs/dbraw/zinc/50/56/05/1041505605.db2.gz RJISQCOJJSZWFC-KRWDZBQOSA-N 2 0 344.474 4.397 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](c1cc2ccccc2o1)C(C)C ZINC000540657012 1041590897 /nfs/dbraw/zinc/59/08/97/1041590897.db2.gz UNBGNBZZDLCVDO-XLIONFOSSA-N 2 0 332.488 4.076 20 0 EIADRP Cc1ccncc1[C@H](C)[NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000539040717 1041616450 /nfs/dbraw/zinc/61/64/50/1041616450.db2.gz PLDSAIMJORKVFZ-ZJOUEHCJSA-N 2 0 337.511 4.341 20 0 EIADRP [NH3+]Cc1cc2cc(Cl)ccc2n1C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167961692 1041619312 /nfs/dbraw/zinc/61/93/12/1041619312.db2.gz NBLPDYUBDVEJRM-JWTNVVGKSA-N 2 0 343.902 4.331 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414900477 1041737715 /nfs/dbraw/zinc/73/77/15/1041737715.db2.gz DSKJKEABPHYFNM-RHSMWYFYSA-N 2 0 328.422 4.006 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000491305589 1041788241 /nfs/dbraw/zinc/78/82/41/1041788241.db2.gz MNUKMGYFWFBNRI-ROUUACIJSA-N 2 0 341.543 4.434 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H]1CCc2[nH]c3ccc(C)cc3c2C1 ZINC000491305587 1041788348 /nfs/dbraw/zinc/78/83/48/1041788348.db2.gz MNUKMGYFWFBNRI-QZTJIDSGSA-N 2 0 341.543 4.434 20 0 EIADRP Cc1nccn1CCC[NH2+][C@H](C)CC(C)(C)c1c[nH]c2ccccc21 ZINC000516881766 1041794555 /nfs/dbraw/zinc/79/45/55/1041794555.db2.gz GCGUBAXTWFKXPF-MRXNPFEDSA-N 2 0 338.499 4.409 20 0 EIADRP CC[C@H]([NH2+]CC1(SC)CC[NH+](C)CC1)c1ccc(Cl)s1 ZINC000516939741 1041817470 /nfs/dbraw/zinc/81/74/70/1041817470.db2.gz DKWWOGWXDXEGBM-LBPRGKRZSA-N 2 0 332.966 4.270 20 0 EIADRP C[C@H]([NH2+]CCCCCOc1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000437784858 1041907792 /nfs/dbraw/zinc/90/77/92/1041907792.db2.gz KZZOXKLAYQHDDO-PMACEKPBSA-N 2 0 344.543 4.478 20 0 EIADRP CC[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)CC(F)(F)F ZINC000402688698 1041947431 /nfs/dbraw/zinc/94/74/31/1041947431.db2.gz HENLUERVXJSJIO-SOLBZPMBSA-N 2 0 342.449 4.465 20 0 EIADRP CC[C@H]1CCC[C@@H](C[N@H+](C)C2CCN(CCc3ccccn3)CC2)C1 ZINC000541536594 1041998628 /nfs/dbraw/zinc/99/86/28/1041998628.db2.gz CWDFCQMVGIDHCD-VQTJNVASSA-N 2 0 343.559 4.237 20 0 EIADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+]([C@@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438094687 1042043087 /nfs/dbraw/zinc/04/30/87/1042043087.db2.gz OBVLVGAIPKHDMW-NNWRFLSQSA-N 2 0 326.528 4.161 20 0 EIADRP C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3cccc(Cl)c3)s2)C1 ZINC000541908758 1042165938 /nfs/dbraw/zinc/16/59/38/1042165938.db2.gz MCRNNYSBYDUBEI-CQSZACIVSA-N 2 0 334.916 4.452 20 0 EIADRP C[C@@H](c1cccc(F)c1)[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464836210 1042181905 /nfs/dbraw/zinc/18/19/05/1042181905.db2.gz JNMBOWHEOLUMBR-HKUYNNGSSA-N 2 0 326.459 4.341 20 0 EIADRP C[N@H+](CCc1ccccc1Cl)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464845989 1042195026 /nfs/dbraw/zinc/19/50/26/1042195026.db2.gz HZWWFSBSVWPXCV-LJQANCHMSA-N 2 0 342.914 4.336 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2cn(C)nc2C(C)(C)C)CC1 ZINC000542176512 1042327375 /nfs/dbraw/zinc/32/73/75/1042327375.db2.gz AKQCKUHSGNSTBZ-UHFFFAOYSA-N 2 0 348.579 4.052 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCc2cccs2)CC1 ZINC000438824267 1042369308 /nfs/dbraw/zinc/36/93/08/1042369308.db2.gz COGSKKPPLKIIGB-UHFFFAOYSA-N 2 0 328.525 4.323 20 0 EIADRP C[NH+](C)CCCC[NH2+]Cc1cccc(OCc2ccccc2Cl)c1 ZINC000518280462 1042450521 /nfs/dbraw/zinc/45/05/21/1042450521.db2.gz PJFRQPYLOQAMBV-UHFFFAOYSA-N 2 0 346.902 4.350 20 0 EIADRP c1cc(-c2nc3ccccc3s2)oc1C[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414975599 1042467169 /nfs/dbraw/zinc/46/71/69/1042467169.db2.gz OWEKZTVMOZGOSL-CQSZACIVSA-N 2 0 341.480 4.178 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@H]2[NH2+]CCC[C@H]2CCC[NH2+]2)cc1 ZINC000414983638 1042520396 /nfs/dbraw/zinc/52/03/96/1042520396.db2.gz ZYVOKCPXLPIKNY-HLAWJBBLSA-N 2 0 330.516 4.232 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1 ZINC000414983640 1042521047 /nfs/dbraw/zinc/52/10/47/1042521047.db2.gz ZYVOKCPXLPIKNY-JBACZVJFSA-N 2 0 330.516 4.232 20 0 EIADRP CCN1CC[NH+](CCCC[NH2+][C@@H](C)c2ccc(C(C)(C)C)cc2)CC1 ZINC000173319592 1042564280 /nfs/dbraw/zinc/56/42/80/1042564280.db2.gz OVVIVKUNAYHPEQ-IBGZPJMESA-N 2 0 345.575 4.052 20 0 EIADRP C[C@@H]([NH2+]CCOC1CCCCCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492398272 1042633209 /nfs/dbraw/zinc/63/32/09/1042633209.db2.gz GVDWKSMOSKSGOY-TZIWHRDSSA-N 2 0 344.543 4.226 20 0 EIADRP CSc1ccc(C[NH2+]C[C@@H]2C[NH2+]CC[C@@H]2c2ccc(F)cc2)cc1 ZINC000415003477 1042710506 /nfs/dbraw/zinc/71/05/06/1042710506.db2.gz NEGFQXUWPYTYIN-FXAWDEMLSA-N 2 0 344.499 4.031 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+]C[C@H]1CCC[C@H]([NH3+])C1 ZINC000415006324 1042804134 /nfs/dbraw/zinc/80/41/34/1042804134.db2.gz QIFKHLKIHBFUAY-KMFMINBZSA-N 2 0 328.422 4.134 20 0 EIADRP CCc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000309710696 1042819504 /nfs/dbraw/zinc/81/95/04/1042819504.db2.gz JESXOHUZMZRMCF-AEFFLSMTSA-N 2 0 328.525 4.483 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccccc1Cl ZINC000177226670 1042831464 /nfs/dbraw/zinc/83/14/64/1042831464.db2.gz NKIXPCBPOMHYFL-HNNXBMFYSA-N 2 0 332.875 4.131 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2[nH]ccc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310902527 1042847778 /nfs/dbraw/zinc/84/77/78/1042847778.db2.gz BIVARKOEYZDMIA-YLJYHZDGSA-N 2 0 333.479 4.168 20 0 EIADRP FC1(F)CCC[C@H](C[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]23)C1 ZINC000311007389 1042850385 /nfs/dbraw/zinc/85/03/85/1042850385.db2.gz WOYAWOMPCPZDHJ-ZGXWSNOMSA-N 2 0 348.481 4.312 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccc(CNC(=[NH2+])Nc3ccccc3)cc2)C1 ZINC000057887943 1042859072 /nfs/dbraw/zinc/85/90/72/1042859072.db2.gz PUHFTIOFWUZEBE-KRWDZBQOSA-N 2 0 336.483 4.055 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)c2ccsc2)cc1 ZINC000178131765 1042859600 /nfs/dbraw/zinc/85/96/00/1042859600.db2.gz ITZUSZOSQJJGBX-INIZCTEOSA-N 2 0 332.513 4.320 20 0 EIADRP CC[C@H]1C[C@@H](C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)CCO1 ZINC000507784920 1042934387 /nfs/dbraw/zinc/93/43/87/1042934387.db2.gz UERKNUIPWHBCQB-VXKWHMMOSA-N 2 0 344.543 4.036 20 0 EIADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000493937912 1042987588 /nfs/dbraw/zinc/98/75/88/1042987588.db2.gz UNDHOMVZOSWUOA-PGRDOPGGSA-N 2 0 338.495 4.148 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cc(C)c(O)c(C)c2)cc1 ZINC000391746523 1043020322 /nfs/dbraw/zinc/02/03/22/1043020322.db2.gz VSPSBQPWHXVZQV-UHFFFAOYSA-N 2 0 326.484 4.141 20 0 EIADRP C/C=C/COc1ccc(CC[C@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000152421610 1043027621 /nfs/dbraw/zinc/02/76/21/1043027621.db2.gz OXCMLOGFHWJOTB-ABQVSZSXSA-N 2 0 342.527 4.037 20 0 EIADRP CCc1nc2c(s1)[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C3CCC3)C1)CCC2 ZINC000183186149 1043040177 /nfs/dbraw/zinc/04/01/77/1043040177.db2.gz WBEJTDBHONPFKX-ZMSDIMECSA-N 2 0 347.572 4.326 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(Cl)cc2)[C@H](C)C1 ZINC000152551015 1043081830 /nfs/dbraw/zinc/08/18/30/1043081830.db2.gz JXIWLQMBYCSRAL-GJYPPUQNSA-N 2 0 338.923 4.128 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2scnc2C2CC2)CC1 ZINC000494984390 1043095410 /nfs/dbraw/zinc/09/54/10/1043095410.db2.gz FBWBHPOMYBSUJG-INIZCTEOSA-N 2 0 347.572 4.497 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000310336425 1043125571 /nfs/dbraw/zinc/12/55/71/1043125571.db2.gz BJYGGLMQZQMTDZ-MJGOQNOKSA-N 2 0 326.459 4.389 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000338773763 1043142688 /nfs/dbraw/zinc/14/26/88/1043142688.db2.gz FRMPCPBQLXRYSA-ZMMAXQRCSA-N 2 0 341.499 4.425 20 0 EIADRP Cc1nc(-c2ccc(CC[NH2+][C@H](C)C3CC[NH+](C)CC3)s2)cs1 ZINC000164482672 1043150307 /nfs/dbraw/zinc/15/03/07/1043150307.db2.gz WPVARWUJFMLDTL-CYBMUJFWSA-N 2 0 349.569 4.042 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccc(OC(C)(C)C)cc1 ZINC000185201681 1043165292 /nfs/dbraw/zinc/16/52/92/1043165292.db2.gz CDGMAICIAUYSJM-MRXNPFEDSA-N 2 0 330.516 4.389 20 0 EIADRP Cc1cnc([C@H](C)NCc2ccccc2C[N@@H+]2CCCC[C@H]2C)cn1 ZINC000427821003 1043214131 /nfs/dbraw/zinc/21/41/31/1043214131.db2.gz AVIGCRHPHMTYTR-MSOLQXFVSA-N 2 0 338.499 4.010 20 0 EIADRP Cc1cnc([C@H](C)NCc2ccccc2C[N@@H+]2CCCC[C@@H]2C)cn1 ZINC000427821006 1043215340 /nfs/dbraw/zinc/21/53/40/1043215340.db2.gz AVIGCRHPHMTYTR-ROUUACIJSA-N 2 0 338.499 4.010 20 0 EIADRP c1cc2c(cccc2C[NH2+]C2CC[NH+](CC3CCCCC3)CC2)[nH]1 ZINC000727468356 1043229084 /nfs/dbraw/zinc/22/90/84/1043229084.db2.gz JARUMYIXSGCVAU-UHFFFAOYSA-N 2 0 325.500 4.302 20 0 EIADRP COc1ccsc1[C@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000186125838 1043248257 /nfs/dbraw/zinc/24/82/57/1043248257.db2.gz UFJRAWZGZOQQHO-INIZCTEOSA-N 2 0 344.524 4.320 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(c2ccc(F)cc2Cl)CCCC1 ZINC000427886275 1043248512 /nfs/dbraw/zinc/24/85/12/1043248512.db2.gz LOSFNZAAYVTJSF-KDOFPFPSSA-N 2 0 338.898 4.221 20 0 EIADRP Brc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+]3CCC[C@@H]3C1)CCC2 ZINC000356682443 1043252307 /nfs/dbraw/zinc/25/23/07/1043252307.db2.gz SDWNQWRLVNSSAD-JFIYKMOQSA-N 2 0 349.316 4.043 20 0 EIADRP C[C@H](CC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cccc(C(F)(F)F)c1 ZINC000166755187 1043310997 /nfs/dbraw/zinc/31/09/97/1043310997.db2.gz DOSNPMUHLBNOBR-FHLIZLRMSA-N 2 0 340.433 4.415 20 0 EIADRP c1cc(CC[NH2+][C@@H]2CCN(Cc3ccccc3)C3(CC3)C2)cs1 ZINC000520811513 1043391181 /nfs/dbraw/zinc/39/11/81/1043391181.db2.gz KOWGQOJNNFNKAT-LJQANCHMSA-N 2 0 326.509 4.077 20 0 EIADRP Cc1nc2ccc(C[NH2+]CCC[N@@H+](C)Cc3ccccc3)cc2s1 ZINC000494348383 1043427460 /nfs/dbraw/zinc/42/74/60/1043427460.db2.gz MDZDHLKRHGAQOB-UHFFFAOYSA-N 2 0 339.508 4.216 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCCc2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC000674305333 1043572173 /nfs/dbraw/zinc/57/21/73/1043572173.db2.gz HLJLUXFJGCJIAM-QAPCUYQASA-N 2 0 342.449 4.300 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)[C@@H]1CCCCO1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000681394488 1043733998 /nfs/dbraw/zinc/73/39/98/1043733998.db2.gz SHHQWXJWQPWNHM-TYPHKJRUSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2ccc3[nH]ccc3c2)CC1 ZINC000442811725 1043853081 /nfs/dbraw/zinc/85/30/81/1043853081.db2.gz PHIGMUBRCVUVIN-HTAPYJJXSA-N 2 0 339.527 4.343 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCCc2ccccn2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168014448 1043853770 /nfs/dbraw/zinc/85/37/70/1043853770.db2.gz LGQMTLHPYSUDFD-HATOLVCRSA-N 2 0 337.511 4.045 20 0 EIADRP CCC(CC)(C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C)c1ccc(F)cc1 ZINC000665301029 1043915096 /nfs/dbraw/zinc/91/50/96/1043915096.db2.gz MRUPSAGLOMFMOL-OAHLLOKOSA-N 2 0 343.490 4.396 20 0 EIADRP Cc1cc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cs1 ZINC000658164598 1043933681 /nfs/dbraw/zinc/93/36/81/1043933681.db2.gz NYFZWSNHAJTQDX-INIZCTEOSA-N 2 0 329.513 4.014 20 0 EIADRP COc1cc(C)ccc1C[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000675101668 1044020104 /nfs/dbraw/zinc/02/01/04/1044020104.db2.gz ZVKGXWQYOQYXAY-UHFFFAOYSA-N 2 0 338.495 4.279 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2cc(Cl)cc(Cl)c2)CC[NH+](C)CC1 ZINC000521944697 1044097367 /nfs/dbraw/zinc/09/73/67/1044097367.db2.gz LPQRSVOZAXRGFX-LBPRGKRZSA-N 2 0 347.355 4.471 20 0 EIADRP c1ccc(N2CCCCC2)c(C[NH2+]CCCCC[NH+]2CCCCC2)c1 ZINC000733326765 1044188337 /nfs/dbraw/zinc/18/83/37/1044188337.db2.gz YPSGLSFBKKKBSS-UHFFFAOYSA-N 2 0 343.559 4.423 20 0 EIADRP OC1CC[NH+](Cc2ccc(C[NH2+]CCCC3CCCCC3)cc2)CC1 ZINC000347971056 1044334478 /nfs/dbraw/zinc/33/44/78/1044334478.db2.gz WUNODFLZYTYFQV-UHFFFAOYSA-N 2 0 344.543 4.093 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)C1CCC(F)(F)CC1 ZINC000474079414 1044357972 /nfs/dbraw/zinc/35/79/72/1044357972.db2.gz IXISZHDEECMEMO-YQQAZPJKSA-N 2 0 328.491 4.443 20 0 EIADRP CC[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(Br)cc1 ZINC000227497446 1044454263 /nfs/dbraw/zinc/45/42/63/1044454263.db2.gz AKECKVKCYJWOKB-INIZCTEOSA-N 2 0 339.321 4.222 20 0 EIADRP C[C@H]1CC(n2ncc3c2cccc3C[NH3+])C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168021937 1044459561 /nfs/dbraw/zinc/45/95/61/1044459561.db2.gz RINSYHCZVPXDHM-IRXDYDNUSA-N 2 0 348.494 4.109 20 0 EIADRP CC1CC[NH+](CCC[NH2+][C@@H](C[C@@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000494880276 1044463002 /nfs/dbraw/zinc/46/30/02/1044463002.db2.gz RXSSHALTDWKEBC-RXVVDRJESA-N 2 0 348.506 4.005 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@H](c2cccnc2)C2CCCCC2)CC1 ZINC000675812758 1044512732 /nfs/dbraw/zinc/51/27/32/1044512732.db2.gz XZWOCBJGCSFOIL-NRFANRHFSA-N 2 0 329.532 4.413 20 0 EIADRP C[NH+](C)CC1(C[NH2+][C@@H](C[C@@H]2CCOC2)c2ccc(F)cc2)CCCC1 ZINC000494943708 1044528101 /nfs/dbraw/zinc/52/81/01/1044528101.db2.gz ZDOMUQYNKXAKRG-PXNSSMCTSA-N 2 0 348.506 4.005 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C[C@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000495072533 1044641426 /nfs/dbraw/zinc/64/14/26/1044641426.db2.gz SDANDMHRXUZNQI-NQIIRXRSSA-N 2 0 348.506 4.005 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C[C@@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000495092746 1044664406 /nfs/dbraw/zinc/66/44/06/1044664406.db2.gz IPGZZMDQKMKWKW-RXVVDRJESA-N 2 0 348.506 4.005 20 0 EIADRP C[C@H](C[NH2+]C1CCC([NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000560549104 1044689865 /nfs/dbraw/zinc/68/98/65/1044689865.db2.gz MANJCSGMYIACGG-NVPAJSRCSA-N 2 0 328.422 4.271 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2ccc(Br)s2)CC1 ZINC000922848554 1044997137 /nfs/dbraw/zinc/99/71/37/1044997137.db2.gz WNIZILSGKXUYER-UHFFFAOYSA-N 2 0 343.334 4.007 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)c(C)c1OC ZINC000671741453 1045166273 /nfs/dbraw/zinc/16/62/73/1045166273.db2.gz TVTCWFYDFGYNFZ-GOSISDBHSA-N 2 0 348.531 4.175 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000326084807 1045562115 /nfs/dbraw/zinc/56/21/15/1045562115.db2.gz PSZJVMWLSAOVJQ-NRFANRHFSA-N 2 0 326.459 4.445 20 0 EIADRP C[C@@H]1C[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CCC[C@H]1C[NH3+] ZINC001206026686 1045711816 /nfs/dbraw/zinc/71/18/16/1045711816.db2.gz TZBDZPMOSDNFDY-PWSUYJOCSA-N 2 0 335.706 4.454 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)[C@@H](C)c1ccccc1C(F)(F)F ZINC000768100582 1045713459 /nfs/dbraw/zinc/71/34/59/1045713459.db2.gz CQQNULXZPIXBIP-ZIAGYGMSSA-N 2 0 328.422 4.129 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC000397993098 1045821269 /nfs/dbraw/zinc/82/12/69/1045821269.db2.gz RANXRNJAFJXBEF-BHIYHBOVSA-N 2 0 336.470 4.312 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC000397993101 1045821963 /nfs/dbraw/zinc/82/19/63/1045821963.db2.gz RANXRNJAFJXBEF-QRQLOZEOSA-N 2 0 336.470 4.312 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](CC)c2ccc(F)cc2)[C@H](C)C1 ZINC000246825167 1045833471 /nfs/dbraw/zinc/83/34/71/1045833471.db2.gz ADSMFFUVCAJAEV-AHRSYUTCSA-N 2 0 336.495 4.003 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccsc1 ZINC000246982208 1045837048 /nfs/dbraw/zinc/83/70/48/1045837048.db2.gz KCJAFKGVPRKVAG-IXDOHACOSA-N 2 0 344.524 4.208 20 0 EIADRP CC[C@H]([NH2+][C@H]1CCN(Cc2ccccn2)C[C@H]1C)c1ccc(F)cc1 ZINC000247175529 1045843630 /nfs/dbraw/zinc/84/36/30/1045843630.db2.gz YUXAGVUGMOHNIQ-CZAAIQMYSA-N 2 0 341.474 4.172 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(CSC(F)F)o2)CC1 ZINC000768926783 1045861946 /nfs/dbraw/zinc/86/19/46/1045861946.db2.gz NSGCXHAPUSCJBE-UHFFFAOYSA-N 2 0 346.487 4.288 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1cc[n+](C[C@H]2CCC3(CCCCC3)O2)cc1 ZINC000249121906 1045894118 /nfs/dbraw/zinc/89/41/18/1045894118.db2.gz UEPZIYZFRQBTPZ-TZIWHRDSSA-N 2 0 343.535 4.230 20 0 EIADRP FC1(F)CCCC[C@H]1C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001170206009 1045926300 /nfs/dbraw/zinc/92/63/00/1045926300.db2.gz QGMUZIFQPJXYFS-PMACEKPBSA-N 2 0 348.481 4.410 20 0 EIADRP C[C@@H](Cc1ccccc1Cl)[NH+]1CCC([NH3+])(Cc2ccccc2)CC1 ZINC001170263896 1045962550 /nfs/dbraw/zinc/96/25/50/1045962550.db2.gz QRZTXOQZODOLHG-KRWDZBQOSA-N 2 0 342.914 4.307 20 0 EIADRP C[C@H](Cc1ccccc1Cl)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001170250349 1045973127 /nfs/dbraw/zinc/97/31/27/1045973127.db2.gz KPKKZEFUQFTTAJ-MJGOQNOKSA-N 2 0 342.914 4.383 20 0 EIADRP CC(C)([NH3+])c1ccccc1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001170336608 1046006476 /nfs/dbraw/zinc/00/64/76/1046006476.db2.gz AFKIVRCGEQZMRK-OWZKRDHZSA-N 2 0 349.522 4.488 20 0 EIADRP Clc1ccc2sc(C3CC[NH+](C[C@H]4CCC[NH2+]C4)CC3)nc2c1 ZINC000262044221 1046176053 /nfs/dbraw/zinc/17/60/53/1046176053.db2.gz YSQREHBUZRROPS-ZDUSSCGKSA-N 2 0 349.931 4.129 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCC2CC[NH+](C)CC2)c2ccccc12 ZINC000125328337 1046301545 /nfs/dbraw/zinc/30/15/45/1046301545.db2.gz QXOONVDZECAQOY-INIZCTEOSA-N 2 0 326.484 4.231 20 0 EIADRP COCCC1(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CCCC1 ZINC000508699886 1046326272 /nfs/dbraw/zinc/32/62/72/1046326272.db2.gz OYYMIPPBIMEFEE-PZJWPPBQSA-N 2 0 344.543 4.084 20 0 EIADRP Cc1cc(C)cc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c1 ZINC000162529965 1046327435 /nfs/dbraw/zinc/32/74/35/1046327435.db2.gz HKOWGRUKMLJKGU-GOSISDBHSA-N 2 0 326.484 4.095 20 0 EIADRP CC(C)Oc1ccc(CC[C@@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000166227222 1046354146 /nfs/dbraw/zinc/35/41/46/1046354146.db2.gz KMVKARBQAAMMFX-MISYRCLQSA-N 2 0 330.516 4.011 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)[C@@H](C)c2nc3ccccc3s2)C1 ZINC000125857726 1046356982 /nfs/dbraw/zinc/35/69/82/1046356982.db2.gz JGIVLSNKGKSIEI-IKGGRYGDSA-N 2 0 345.556 4.498 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@H]1Cc1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508709194 1046359823 /nfs/dbraw/zinc/35/98/23/1046359823.db2.gz GMDXFVKHFKIQPO-XSEFMFLKSA-N 2 0 334.507 4.118 20 0 EIADRP C[C@H]([NH2+]CCc1cc(F)cc(F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508712200 1046369174 /nfs/dbraw/zinc/36/91/74/1046369174.db2.gz CHGFJHWTZUOCLR-QFBILLFUSA-N 2 0 344.449 4.008 20 0 EIADRP COc1cc(C)cc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000508722034 1046422916 /nfs/dbraw/zinc/42/29/16/1046422916.db2.gz QUTGCHMSSXOLLZ-NQIIRXRSSA-N 2 0 338.495 4.004 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc2ccccc2c1OC(F)F ZINC000126189134 1046456884 /nfs/dbraw/zinc/45/68/84/1046456884.db2.gz YKZUMGFZNBHARJ-AWEZNQCLSA-N 2 0 348.437 4.434 20 0 EIADRP COCc1ccccc1/C=C(/C)CN(C)CC[C@@H]1CCCC[N@@H+]1C ZINC000508742998 1046493248 /nfs/dbraw/zinc/49/32/48/1046493248.db2.gz IOKVETOHESQPCX-TXOBRMIJSA-N 2 0 330.516 4.043 20 0 EIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CC[N@@H+](C3CC3)C1)CCCO2 ZINC000126535976 1046493519 /nfs/dbraw/zinc/49/35/19/1046493519.db2.gz XDDJVTJLBSAVKD-UZLBHIALSA-N 2 0 328.500 4.098 20 0 EIADRP C[NH+]1C(C)(C)CC(Nc2ccc(F)c(C[NH+]3CCCC3)c2)CC1(C)C ZINC001170453873 1046553615 /nfs/dbraw/zinc/55/36/15/1046553615.db2.gz OFEBBTMRZVXKOB-UHFFFAOYSA-N 2 0 347.522 4.485 20 0 EIADRP c1ccc([C@H]2CCCC[C@@H]2[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459402297 1046602345 /nfs/dbraw/zinc/60/23/45/1046602345.db2.gz YZENEIHCYXUUOT-YADHBBJMSA-N 2 0 335.495 4.366 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(OC)c3ccccc23)C[C@@H]1C ZINC000536659336 1046608338 /nfs/dbraw/zinc/60/83/38/1046608338.db2.gz WUPZOLPGGRKQMT-WMZOPIPTSA-N 2 0 326.484 4.153 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(OC)c3ccccc23)C[C@@H]1C ZINC000536659334 1046608546 /nfs/dbraw/zinc/60/85/46/1046608546.db2.gz WUPZOLPGGRKQMT-FUHWJXTLSA-N 2 0 326.484 4.153 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cc(C)c(Br)s2)C[C@@H]1C ZINC000536662004 1046634026 /nfs/dbraw/zinc/63/40/26/1046634026.db2.gz JXYWTJNXUBXDQY-STQMWFEESA-N 2 0 345.350 4.124 20 0 EIADRP FC1(F)CCC(C[NH+]2CCC(CCCn3ccnc3)CC2)CC1 ZINC000459414449 1046639732 /nfs/dbraw/zinc/63/97/32/1046639732.db2.gz SLUANAMEXFSZLQ-UHFFFAOYSA-N 2 0 325.447 4.201 20 0 EIADRP c1ccc(C[C@H]2CCC[C@H]2[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459436203 1046645465 /nfs/dbraw/zinc/64/54/65/1046645465.db2.gz QESRFYDVWIHMEQ-DENIHFKCSA-N 2 0 335.495 4.051 20 0 EIADRP CCOc1ccc(C[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000536673519 1046658843 /nfs/dbraw/zinc/65/88/43/1046658843.db2.gz YJVXHBHEQGHSPB-NRFANRHFSA-N 2 0 338.495 4.039 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccccc2N(C)C)c1 ZINC000536702371 1046701079 /nfs/dbraw/zinc/70/10/79/1046701079.db2.gz CTQYKERDWADJDL-GOSISDBHSA-N 2 0 339.527 4.445 20 0 EIADRP C[C@H]1C[C@H](NCc2cc(F)ccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000379624357 1046716880 /nfs/dbraw/zinc/71/68/80/1046716880.db2.gz JPDRXTPSILBZSN-HNAYVOBHSA-N 2 0 330.422 4.108 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000379641551 1046745004 /nfs/dbraw/zinc/74/50/04/1046745004.db2.gz YKEBXQKZHBLVLA-BBTUJRGHSA-N 2 0 338.495 4.399 20 0 EIADRP c1ccc([C@@H]2CCC[C@H]2C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459558664 1046776139 /nfs/dbraw/zinc/77/61/39/1046776139.db2.gz AOLSMXBAXHNCLO-UGKGYDQZSA-N 2 0 335.495 4.224 20 0 EIADRP c1ccc([C@@H]2CCC[C@@H]2C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459558659 1046777790 /nfs/dbraw/zinc/77/77/90/1046777790.db2.gz AOLSMXBAXHNCLO-KNQAVFIVSA-N 2 0 335.495 4.224 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c[nH+]cn2c1)[C@H](C)c1nc2ccccc2s1 ZINC000459663728 1046846797 /nfs/dbraw/zinc/84/67/97/1046846797.db2.gz YDBJRSGPOONVIF-UONOGXRCSA-N 2 0 336.464 4.226 20 0 EIADRP C(CCC[NH2+][C@@H]1CCC[C@H]([C@@H]2CCOC2)C1)CCC[NH+]1CCCC1 ZINC000798493105 1046853190 /nfs/dbraw/zinc/85/31/90/1046853190.db2.gz LJZVURUWKCIFFJ-PWRODBHTSA-N 2 0 336.564 4.218 20 0 EIADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000459723559 1046864523 /nfs/dbraw/zinc/86/45/23/1046864523.db2.gz ADDZODQHPOSTON-APIJFGDWSA-N 2 0 326.937 4.215 20 0 EIADRP COc1ccc([C@H]([NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)C2CC2)cc1 ZINC000536946955 1046877021 /nfs/dbraw/zinc/87/70/21/1046877021.db2.gz BRUZMNDYWFAMTK-LAUBAEHRSA-N 2 0 330.516 4.248 20 0 EIADRP CC(C)[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000536998058 1046890202 /nfs/dbraw/zinc/89/02/02/1046890202.db2.gz CYABIDFZTKQNEC-PBHICJAKSA-N 2 0 328.422 4.334 20 0 EIADRP C(=C\c1ccc(OCc2ccccc2)cc1)\C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000666858093 1047009199 /nfs/dbraw/zinc/00/91/99/1047009199.db2.gz WTFDOFJTMUVMFY-DJHHFUNSSA-N 2 0 336.479 4.011 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCc4nc(Cl)ccc43)CC2)CC1 ZINC000806149563 1047174965 /nfs/dbraw/zinc/17/49/65/1047174965.db2.gz VPWFZOOEXHKOPB-LEOMRAHMSA-N 2 0 347.934 4.355 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)Nc2cc(C)ccn2)ccc1OC ZINC000537406378 1047199337 /nfs/dbraw/zinc/19/93/37/1047199337.db2.gz GQEHARHOJVPVDG-MRXNPFEDSA-N 2 0 327.472 4.414 20 0 EIADRP C[NH+]1CCC(C[NH+]2CCC(c3nc4cc(Cl)ccc4o3)CC2)CC1 ZINC000788488625 1047201901 /nfs/dbraw/zinc/20/19/01/1047201901.db2.gz RGOOSUNGOGXJBH-UHFFFAOYSA-N 2 0 347.890 4.002 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCc3ccc(Cl)nc32)c1 ZINC000788542058 1047218165 /nfs/dbraw/zinc/21/81/65/1047218165.db2.gz JJTBIKFPABUKPI-GOSISDBHSA-N 2 0 343.902 4.354 20 0 EIADRP Clc1ccc2c(n1)[C@@H]([NH2+]CCCCCCC[NH+]1CCCC1)CC2 ZINC000788594122 1047241407 /nfs/dbraw/zinc/24/14/07/1047241407.db2.gz LPEDWBNPQJYHEI-KRWDZBQOSA-N 2 0 335.923 4.358 20 0 EIADRP CC(C)[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@H](O)c1ccccc1 ZINC000788622278 1047252153 /nfs/dbraw/zinc/25/21/53/1047252153.db2.gz QPYNIWDAVGRGJV-FGZHOGPDSA-N 2 0 344.543 4.131 20 0 EIADRP COc1ccc(C[NH2+]C[C@H](C)C[NH+]2CCCCC2)c2ccccc12 ZINC000325579940 1047261414 /nfs/dbraw/zinc/26/14/14/1047261414.db2.gz NTLFJKCTVBAHFQ-KRWDZBQOSA-N 2 0 326.484 4.060 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@H]2CCN(Cc3ccccc3)C3(CC3)C2)CCS1 ZINC000897793518 1047482557 /nfs/dbraw/zinc/48/25/57/1047482557.db2.gz NYKKORCOSLZHGD-RBUKOAKNSA-N 2 0 344.568 4.447 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)C1CCOCC1 ZINC000129873321 1047520278 /nfs/dbraw/zinc/52/02/78/1047520278.db2.gz AHDQUUPDXITJRV-GOSISDBHSA-N 2 0 344.543 4.356 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)[C@H]1CCOC1 ZINC000129871082 1047521727 /nfs/dbraw/zinc/52/17/27/1047521727.db2.gz JVLZYAAJTGNTJR-RBBKRZOGSA-N 2 0 344.543 4.356 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1cc(Br)cs1 ZINC000556232498 1047598753 /nfs/dbraw/zinc/59/87/53/1047598753.db2.gz HYMYJYKQGKOSGX-CYBMUJFWSA-N 2 0 345.350 4.427 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@H]2CCCc3c(O)cccc32)C1 ZINC000556236331 1047603033 /nfs/dbraw/zinc/60/30/33/1047603033.db2.gz QNECRCSOTKRISO-HLIPFELVSA-N 2 0 330.516 4.117 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000556238291 1047604424 /nfs/dbraw/zinc/60/44/24/1047604424.db2.gz IJXZORJHTHZLMA-ZIOPUJRMSA-N 2 0 341.326 4.415 20 0 EIADRP C[NH+](C)C1CCC([NH2+]CCc2cccc(Oc3ccccc3)c2)CC1 ZINC001168294956 1047664635 /nfs/dbraw/zinc/66/46/35/1047664635.db2.gz KLOGUXXGUGDCKE-UHFFFAOYSA-N 2 0 338.495 4.484 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1cc2cc(Br)ccc2o1 ZINC000045663262 1047716070 /nfs/dbraw/zinc/71/60/70/1047716070.db2.gz FLMPSUUGNYFMFE-GFCCVEGCSA-N 2 0 339.277 4.188 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1cc2cc(Br)ccc2o1 ZINC000045663259 1047716417 /nfs/dbraw/zinc/71/64/17/1047716417.db2.gz FLMPSUUGNYFMFE-LBPRGKRZSA-N 2 0 339.277 4.188 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](C[C@H]2CC2(Cl)Cl)CC1 ZINC000763435100 1047804943 /nfs/dbraw/zinc/80/49/43/1047804943.db2.gz YZZGPKOSEOTUKB-GDBMZVCRSA-N 2 0 333.347 4.157 20 0 EIADRP Clc1ccc(CCCC[NH2+]C2CC[NH+](CC3CC3)CC2)s1 ZINC000556576256 1047828147 /nfs/dbraw/zinc/82/81/47/1047828147.db2.gz PXFUBPAWUXTOLF-UHFFFAOYSA-N 2 0 326.937 4.188 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC000556590140 1047830840 /nfs/dbraw/zinc/83/08/40/1047830840.db2.gz ZKKRJTXVAMAWNZ-KRWDZBQOSA-N 2 0 330.516 4.391 20 0 EIADRP C[NH+]1CCC(C2CC[NH+](Cc3cc4c(cccc4Cl)[nH]3)CC2)CC1 ZINC001136862577 1047858551 /nfs/dbraw/zinc/85/85/51/1047858551.db2.gz QXUCMMKVVKXCBX-UHFFFAOYSA-N 2 0 345.918 4.375 20 0 EIADRP CCSCCC[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000814172779 1047865435 /nfs/dbraw/zinc/86/54/35/1047865435.db2.gz CQAKUFGKYMUPOQ-IHWFROFDSA-N 2 0 332.557 4.305 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H](c2ccc(F)cn2)C(C)C)CC1 ZINC000498923424 1047962931 /nfs/dbraw/zinc/96/29/31/1047962931.db2.gz JRVIPNILGXSKSW-HXUWFJFHSA-N 2 0 335.511 4.266 20 0 EIADRP C[NH+](C)CC1CC[NH+]([C@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171084060 1048075795 /nfs/dbraw/zinc/07/57/95/1048075795.db2.gz XDFZGTWQGMEMPL-INIZCTEOSA-N 2 0 341.326 4.124 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H](C)c2csc(-c3ccccc3)n2)CC1 ZINC000556873826 1048094271 /nfs/dbraw/zinc/09/42/71/1048094271.db2.gz MAZOVGFLVKXCQG-OAHLLOKOSA-N 2 0 329.513 4.193 20 0 EIADRP CC[N@H+](Cc1ccccc1)C1CC[NH+]([C@H]2C[C@@H]3[C@H](C2)C3(C)C)CC1 ZINC001170755458 1048108798 /nfs/dbraw/zinc/10/87/98/1048108798.db2.gz BSVCCCSJIMCBAZ-WKCHPHFGSA-N 2 0 326.528 4.408 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H]2CCc3cc(Cl)ccc3C2)c1 ZINC001171093422 1048130000 /nfs/dbraw/zinc/13/00/00/1048130000.db2.gz FTXFAEOUOAYVSC-FQEVSTJZSA-N 2 0 328.887 4.049 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@H]2CC(C)(C)OC2(C)C)CC1 ZINC000556893306 1048139372 /nfs/dbraw/zinc/13/93/72/1048139372.db2.gz UEHMAOCQFRSXNY-MHJFOBGBSA-N 2 0 344.543 4.365 20 0 EIADRP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1F ZINC000499159619 1048368897 /nfs/dbraw/zinc/36/88/97/1048368897.db2.gz VTWZZCFEDRGFNC-MZADTFQBSA-N 2 0 338.470 4.419 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171138221 1048413499 /nfs/dbraw/zinc/41/34/99/1048413499.db2.gz BJMBFXVPSOYGJP-INIZCTEOSA-N 2 0 341.326 4.315 20 0 EIADRP Cc1ccccc1CC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499247080 1048482179 /nfs/dbraw/zinc/48/21/79/1048482179.db2.gz UZHQWTBPJUPFIE-WBDAEOGXSA-N 2 0 334.507 4.323 20 0 EIADRP Cc1cc(F)ccc1[C@H](C)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000815589821 1048527690 /nfs/dbraw/zinc/52/76/90/1048527690.db2.gz FDBVOPYSYFSSQV-INIZCTEOSA-N 2 0 327.447 4.096 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)Cc2ccc(-n3cccc3)cc2)CC1 ZINC001144246686 1048534716 /nfs/dbraw/zinc/53/47/16/1048534716.db2.gz FNGBNJFGBZHQMD-UHFFFAOYSA-N 2 0 325.500 4.030 20 0 EIADRP Cc1cc(F)ccc1[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000815575486 1048536109 /nfs/dbraw/zinc/53/61/09/1048536109.db2.gz SRZIXWDAOWFUDA-QUCCMNQESA-N 2 0 340.486 4.349 20 0 EIADRP Cc1cc(F)ccc1[C@H](C)[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000815575484 1048537224 /nfs/dbraw/zinc/53/72/24/1048537224.db2.gz SRZIXWDAOWFUDA-AZUAARDMSA-N 2 0 340.486 4.349 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1cc(Cl)c(N)c(Cl)c1 ZINC000844922742 1048548532 /nfs/dbraw/zinc/54/85/32/1048548532.db2.gz DQEPBQUSDSNHGS-VIFPVBQESA-N 2 0 342.245 4.024 20 0 EIADRP Cc1cc(F)ccc1[C@@H](C)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000815622220 1048548793 /nfs/dbraw/zinc/54/87/93/1048548793.db2.gz PRERQPXJGDLASI-IEBWSBKVSA-N 2 0 326.459 4.307 20 0 EIADRP CCCCCC[C@H](CC)[NH+]1CCN(CCC[NH+](CC)CC)CC1 ZINC001170599958 1048668173 /nfs/dbraw/zinc/66/81/73/1048668173.db2.gz AFWDESJLMFBNMR-FQEVSTJZSA-N 2 0 325.585 4.085 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CC[C@@]2(C)C[C@@]2(F)Cl)CC1 ZINC000846030936 1048796040 /nfs/dbraw/zinc/79/60/40/1048796040.db2.gz GGJQATBDRDJMCF-UBDQQSCGSA-N 2 0 330.919 4.324 20 0 EIADRP C[C@H]([NH2+]CC[C@]1(C)C[C@@]1(F)Cl)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000846036813 1048801515 /nfs/dbraw/zinc/80/15/15/1048801515.db2.gz MKEGJTXCXXRTEE-KANFNMMFSA-N 2 0 338.898 4.191 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC[C@]1(C)C[C@@]1(F)Cl ZINC000846188816 1048838365 /nfs/dbraw/zinc/83/83/65/1048838365.db2.gz JTERVABTEPDIAM-LULLPPNCSA-N 2 0 338.898 4.191 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)cc1 ZINC000237344801 1048928919 /nfs/dbraw/zinc/92/89/19/1048928919.db2.gz WPLBOJYJHBQVJJ-VQTJNVASSA-N 2 0 338.495 4.325 20 0 EIADRP CC(C)(C)c1ccc(N2CCC([NH2+]C3CCC(C[NH3+])CC3)CC2)cc1 ZINC000817895546 1049054232 /nfs/dbraw/zinc/05/42/32/1049054232.db2.gz VSKUHTVTXLGHJK-UHFFFAOYSA-N 2 0 343.559 4.060 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)CC1 ZINC000817946758 1049060662 /nfs/dbraw/zinc/06/06/62/1049060662.db2.gz DOSWWMWWSQAJIR-SEEARECTSA-N 2 0 326.456 4.238 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000817947372 1049063157 /nfs/dbraw/zinc/06/31/57/1049063157.db2.gz CZEZBJIWDHZNOC-NRFANRHFSA-N 2 0 338.495 4.315 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc2cc(Cl)ccc2o1 ZINC000817947985 1049063208 /nfs/dbraw/zinc/06/32/08/1049063208.db2.gz HUFDBXMFLTXHKM-ZDUSSCGKSA-N 2 0 328.843 4.438 20 0 EIADRP CC(C)c1ccc(C2(O)CCC([NH2+][C@H]3CCCC[C@@H]3C[NH3+])CC2)cc1 ZINC000817961131 1049068922 /nfs/dbraw/zinc/06/89/22/1049068922.db2.gz UTADKXXEELJCAZ-DWOCFRCJSA-N 2 0 344.543 4.047 20 0 EIADRP COc1cc([C@@H](C)[NH2+]C[C@@]2(C)CCC[NH2+]C2)ccc1SC(F)F ZINC000817965859 1049070887 /nfs/dbraw/zinc/07/08/87/1049070887.db2.gz DNZHSFSSORFSCE-PXAZEXFGSA-N 2 0 344.471 4.050 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@H](C)CCCC[NH3+])ccc1SC(F)F ZINC000817976469 1049075589 /nfs/dbraw/zinc/07/55/89/1049075589.db2.gz ZEDOZDKDCYXEGG-NEPJUHHUSA-N 2 0 332.460 4.178 20 0 EIADRP C[NH+](C)CC[C@@H]([NH2+][C@H]1CCc2cc(F)cc(F)c2C1)c1ccccc1 ZINC001170657876 1049343002 /nfs/dbraw/zinc/34/30/02/1049343002.db2.gz HICFQHHXLDIOAL-GHTZIAJQSA-N 2 0 344.449 4.105 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)[C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170933619 1049353160 /nfs/dbraw/zinc/35/31/60/1049353160.db2.gz IODGJOCXNRQZGZ-SFHVURJKSA-N 2 0 334.935 4.250 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@H]2CCc3cc(F)cc(F)c3C2)CC1(C)C ZINC001170671252 1049386687 /nfs/dbraw/zinc/38/66/87/1049386687.db2.gz XSGXDYXQJNPWIV-HNNXBMFYSA-N 2 0 336.470 4.063 20 0 EIADRP C[C@@H](CC[NH2+][C@H]1CCCNc2ccccc21)[N@H+](C)Cc1ccccc1 ZINC000348097584 1049416831 /nfs/dbraw/zinc/41/68/31/1049416831.db2.gz WQQBUJDVEKAHFB-AVRDEDQJSA-N 2 0 337.511 4.434 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H]2CCc3c(F)cc(F)cc3C2)CC1 ZINC001171353212 1049507184 /nfs/dbraw/zinc/50/71/84/1049507184.db2.gz FCVAHWPHBHCKKD-ADKAHSJRSA-N 2 0 336.470 4.065 20 0 EIADRP Oc1cccc2c1CCC[C@@H]2[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000812720399 1049548986 /nfs/dbraw/zinc/54/89/86/1049548986.db2.gz FIRQLQRLIUAPRO-UHYCVJNDSA-N 2 0 328.500 4.156 20 0 EIADRP Clc1ccccc1C[C@@H](NC[C@H]1CC[N@@H+](C2CC2)C1)c1ccoc1 ZINC000820807864 1049555021 /nfs/dbraw/zinc/55/50/21/1049555021.db2.gz SLJHQHGLYBTXAI-FOIQADDNSA-N 2 0 344.886 4.291 20 0 EIADRP CCOc1cc(C)ccc1C[NH2+][C@H](C)c1cccc(C[NH+](C)C)c1 ZINC000820812258 1049557547 /nfs/dbraw/zinc/55/75/47/1049557547.db2.gz GWXMSJLTNYRCGQ-QGZVFWFLSA-N 2 0 326.484 4.306 20 0 EIADRP Cc1cc(C[NH+](C)C)cc(N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H]2C)c1 ZINC000820836050 1049565149 /nfs/dbraw/zinc/56/51/49/1049565149.db2.gz IZFYUQIMOOCFGF-GCJKJVERSA-N 2 0 337.511 4.132 20 0 EIADRP Fc1cccc2c1CC[C@H]([NH2+]CC1CC[NH+](C3CCCCC3)CC1)C2 ZINC001171405147 1049629143 /nfs/dbraw/zinc/62/91/43/1049629143.db2.gz QZTCKDXVCMLUHK-IBGZPJMESA-N 2 0 344.518 4.317 20 0 EIADRP Fc1cccc2c1C[C@H]([NH2+]C1CC[NH+](CC3CCCCC3)CC1)CC2 ZINC001170967774 1049651013 /nfs/dbraw/zinc/65/10/13/1049651013.db2.gz ASFFCDTUROLHJU-HXUWFJFHSA-N 2 0 344.518 4.317 20 0 EIADRP CC(F)(F)C(C)(C)C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716715758 1049704746 /nfs/dbraw/zinc/70/47/46/1049704746.db2.gz DNQATEGATDXOIW-BZSNNMDCSA-N 2 0 336.470 4.311 20 0 EIADRP Fc1cc2c(cc1F)C[C@@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CC2 ZINC001171466521 1049724563 /nfs/dbraw/zinc/72/45/63/1049724563.db2.gz LXUJBZORBJRWRM-SFHVURJKSA-N 2 0 348.481 4.209 20 0 EIADRP Fc1cc2c(cc1F)C[C@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CC2 ZINC001171466520 1049724956 /nfs/dbraw/zinc/72/49/56/1049724956.db2.gz LXUJBZORBJRWRM-GOSISDBHSA-N 2 0 348.481 4.209 20 0 EIADRP Cc1cccc2c1CC[C@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)C2 ZINC001171559563 1049755247 /nfs/dbraw/zinc/75/52/47/1049755247.db2.gz IKUHLHKDQPUXOV-FQEVSTJZSA-N 2 0 326.528 4.239 20 0 EIADRP Cc1cccc2c1CC[C@@H]([NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C)C2 ZINC001171573124 1049759943 /nfs/dbraw/zinc/75/99/43/1049759943.db2.gz GNFQTFOEDBDFRO-PWRODBHTSA-N 2 0 326.528 4.191 20 0 EIADRP COc1ccc(CC2([NH2+]C3CC(C)(C)[NH+](C)C(C)(C)C3)CCC2)cc1 ZINC001171630273 1049762186 /nfs/dbraw/zinc/76/21/86/1049762186.db2.gz KNEFBQRVQHAZFM-UHFFFAOYSA-N 2 0 344.543 4.401 20 0 EIADRP COc1cccc(CC2([NH2+]C3CC(C)(C)[NH+](C)C(C)(C)C3)CC2)c1 ZINC001171630470 1049762423 /nfs/dbraw/zinc/76/24/23/1049762423.db2.gz OOGZXXOBGHJBGJ-UHFFFAOYSA-N 2 0 330.516 4.011 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]Cc2cccc(Br)c2)CC1(C)C ZINC001171619576 1049766890 /nfs/dbraw/zinc/76/68/90/1049766890.db2.gz PTGIZMZZMBARNT-UHFFFAOYSA-N 2 0 339.321 4.190 20 0 EIADRP Cc1ccc(CC[C@@H](C)N(c2cc[nH+]cc2C)C2CC[NH2+]CC2)cc1 ZINC001171682440 1049777380 /nfs/dbraw/zinc/77/73/80/1049777380.db2.gz VMBRTCVNALCAEK-LJQANCHMSA-N 2 0 337.511 4.278 20 0 EIADRP C[C@H](c1ccccc1)[NH+]1CCN(C2CC(C)(C)[NH+](C)C(C)(C)C2)CC1 ZINC001171639228 1049778260 /nfs/dbraw/zinc/77/82/60/1049778260.db2.gz AEHFPOUTWHWTAK-GOSISDBHSA-N 2 0 343.559 4.017 20 0 EIADRP C[NH+]1C(C)(C)CC(n2c3ccccc3c3c2CC[NH2+]C3)CC1(C)C ZINC001171637922 1049779214 /nfs/dbraw/zinc/77/92/14/1049779214.db2.gz SOZKXYNEEROMRE-UHFFFAOYSA-N 2 0 325.500 4.111 20 0 EIADRP CC(C)c1noc([C@@H]2CCC[N@@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)C2)n1 ZINC001171639728 1049779751 /nfs/dbraw/zinc/77/97/51/1049779751.db2.gz QWVHYFXUQGELIU-OAHLLOKOSA-N 2 0 348.535 4.024 20 0 EIADRP Cc1c(CC[NH3+])c2ccccc2n1[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171727253 1049785384 /nfs/dbraw/zinc/78/53/84/1049785384.db2.gz TXZBBCIPFWARSQ-XLIONFOSSA-N 2 0 347.506 4.286 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1CCc2cccc(F)c2C1 ZINC001171005854 1049819676 /nfs/dbraw/zinc/81/96/76/1049819676.db2.gz RMTJOBAMWPCHOP-GBESFXJTSA-N 2 0 330.491 4.022 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1CCc2cccc(F)c2C1 ZINC001171005856 1049820097 /nfs/dbraw/zinc/82/00/97/1049820097.db2.gz RMTJOBAMWPCHOP-OTWHNJEPSA-N 2 0 330.491 4.022 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001171961113 1049824433 /nfs/dbraw/zinc/82/44/33/1049824433.db2.gz QAXDRLMHGJAZBF-HNNXBMFYSA-N 2 0 342.449 4.346 20 0 EIADRP CC1(C)C[C@H]([NH2+]C2Cc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001171962351 1049825158 /nfs/dbraw/zinc/82/51/58/1049825158.db2.gz COAWYPCSPPPLFJ-OAQYLSRUSA-N 2 0 334.507 4.187 20 0 EIADRP CC1(C)C[C@H](Nc2cccc(F)c2C[NH3+])CC[N@@H+]1Cc1ccccc1 ZINC001171967721 1049828316 /nfs/dbraw/zinc/82/83/16/1049828316.db2.gz MWUVPQVTWSFRPQ-QGZVFWFLSA-N 2 0 341.474 4.140 20 0 EIADRP CC1(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC(F)(F)C1 ZINC001171970617 1049834697 /nfs/dbraw/zinc/83/46/97/1049834697.db2.gz DQRYNWZWIKRYBA-KRWDZBQOSA-N 2 0 336.470 4.455 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CCCc2cccnc2)CC[N@@H+]1Cc1ccccc1 ZINC001171972823 1049835733 /nfs/dbraw/zinc/83/57/33/1049835733.db2.gz SRQRDIYIQFTWOL-NRFANRHFSA-N 2 0 337.511 4.047 20 0 EIADRP CC1(C)C[C@H]([NH2+]CCCC(F)(F)F)CC[N@@H+]1Cc1ccccc1 ZINC001171974158 1049836140 /nfs/dbraw/zinc/83/61/40/1049836140.db2.gz CLRKUUYUIZJXLX-MRXNPFEDSA-N 2 0 328.422 4.362 20 0 EIADRP CC(C)(N[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1ccccn1 ZINC001171975970 1049837734 /nfs/dbraw/zinc/83/77/34/1049837734.db2.gz OFTLBQPBLHBJIW-LJQANCHMSA-N 2 0 337.511 4.350 20 0 EIADRP CCC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CCOCC1 ZINC001171977807 1049837765 /nfs/dbraw/zinc/83/77/65/1049837765.db2.gz HBOXDXFTJDWBIC-HXUWFJFHSA-N 2 0 344.543 4.226 20 0 EIADRP CC1(C)C[C@@H]([NH+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)CC[N@@H+]1Cc1ccccc1 ZINC001171982376 1049839158 /nfs/dbraw/zinc/83/91/58/1049839158.db2.gz RHRIFDWWVCSZOK-OTWHNJEPSA-N 2 0 348.481 4.407 20 0 EIADRP CC1(C)C[C@@H](Nc2ccc(C[NH3+])c(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC001171978852 1049839331 /nfs/dbraw/zinc/83/93/31/1049839331.db2.gz MKHUWCKTXUDMJQ-IBGZPJMESA-N 2 0 341.474 4.140 20 0 EIADRP [NH3+]Cc1cccc(N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172065756 1049851032 /nfs/dbraw/zinc/85/10/32/1049851032.db2.gz QIUDNHRGKGWTEN-KOUNCHBCSA-N 2 0 335.495 4.143 20 0 EIADRP CC1(F)CC[NH+]([C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172070154 1049852841 /nfs/dbraw/zinc/85/28/41/1049852841.db2.gz XJEQHRUFXQWENX-ACDBMABISA-N 2 0 330.491 4.396 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCc1c(Cl)cccc1Cl)C2 ZINC001172102965 1049855734 /nfs/dbraw/zinc/85/57/34/1049855734.db2.gz RBUCNPBIXQSQLY-BTTYYORXSA-N 2 0 327.299 4.141 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@H]([N@H+](CC1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001172109893 1049856599 /nfs/dbraw/zinc/85/65/99/1049856599.db2.gz GOXCATJJKNDTNZ-HRMJIJJXSA-N 3 0 347.591 4.154 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C[C@@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001172114353 1049858559 /nfs/dbraw/zinc/85/85/59/1049858559.db2.gz QVDJJZHRLFMOAD-IYWMVGAKSA-N 2 0 332.919 4.439 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C[C@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001172114348 1049858735 /nfs/dbraw/zinc/85/87/35/1049858735.db2.gz QVDJJZHRLFMOAD-HAGHYFMRSA-N 2 0 332.919 4.439 20 0 EIADRP Clc1cccc2c1CC[C@@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)C2 ZINC001171022668 1049865900 /nfs/dbraw/zinc/86/59/00/1049865900.db2.gz PGICYBJDCMMOGW-LJQANCHMSA-N 2 0 346.946 4.442 20 0 EIADRP CC(C)(C)C[NH+]1CCC([NH2+][C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171024708 1049869902 /nfs/dbraw/zinc/86/99/02/1049869902.db2.gz GTZJALLRKUPIAJ-QGZVFWFLSA-N 2 0 334.935 4.297 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CC[C@H]2CCCCO2)ccc1OC ZINC000180259746 1049873188 /nfs/dbraw/zinc/87/31/88/1049873188.db2.gz WHGGJTYQMFRZNY-FXAWDEMLSA-N 2 0 348.531 4.147 20 0 EIADRP C[C@@H](CCc1ccc(Br)cc1)[NH2+]CC1([NH3+])CCCCC1 ZINC001246278500 1049875224 /nfs/dbraw/zinc/87/52/24/1049875224.db2.gz IGBHAQCDZLWVIX-AWEZNQCLSA-N 2 0 339.321 4.021 20 0 EIADRP CC[C@H](C)OCC[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001172322106 1049878463 /nfs/dbraw/zinc/87/84/63/1049878463.db2.gz RUIJTUXHWIEHBU-DYXWJJEUSA-N 2 0 332.532 4.082 20 0 EIADRP Clc1cccc2c1CC[C@@H]([NH2+]CC1CC[NH+](CC3CCC3)CC1)C2 ZINC001171031888 1049878518 /nfs/dbraw/zinc/87/85/18/1049878518.db2.gz YWKJJJUSRYGZHW-LJQANCHMSA-N 2 0 346.946 4.299 20 0 EIADRP CC[C@@H](C)OCC[C@@H](C)[N@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172355844 1049894355 /nfs/dbraw/zinc/89/43/55/1049894355.db2.gz WQAJDXWGMKZMFR-WOJBJXKFSA-N 2 0 346.559 4.424 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[N@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172355840 1049894733 /nfs/dbraw/zinc/89/47/33/1049894733.db2.gz WQAJDXWGMKZMFR-PMACEKPBSA-N 2 0 346.559 4.424 20 0 EIADRP CCCCCC[C@@H](CCC)[NH2+][C@@H](CCC[NH3+])NC(=O)OC(C)(C)C ZINC001172391973 1049905552 /nfs/dbraw/zinc/90/55/52/1049905552.db2.gz UTBMGFHUXHYFHE-IAGOWNOFSA-N 2 0 343.556 4.305 20 0 EIADRP CC(C)COCC[C@H](C)[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001172475937 1049909244 /nfs/dbraw/zinc/90/92/44/1049909244.db2.gz NQPXAQNTCOGMRU-RBBKRZOGSA-N 2 0 344.543 4.036 20 0 EIADRP CC(C)COCC[C@@H](C)[NH+]1CCC2(C[NH+](Cc3ccccc3)C2)CC1 ZINC001172485866 1049911599 /nfs/dbraw/zinc/91/15/99/1049911599.db2.gz ZOYPTAZAPTYBJY-HXUWFJFHSA-N 2 0 344.543 4.036 20 0 EIADRP CC(C)OCC[C@H](C)[N@H+]1C[C@H]2c3ccccc3[C@H]([NH+](C)C(C)C)[C@H]2C1 ZINC001172451448 1049914394 /nfs/dbraw/zinc/91/43/94/1049914394.db2.gz QASNAHSAYIBWTJ-MQGJPIDWSA-N 2 0 344.543 4.301 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@H]1CC[C@H]([NH+](C)C)CC1 ZINC001172570634 1049939356 /nfs/dbraw/zinc/93/93/56/1049939356.db2.gz HHNQRBFTWKGRRX-QEJZJMRPSA-N 2 0 344.877 4.402 20 0 EIADRP CC(C)[PH+](CC[NH2+][C@@H]1CCN(Cc2ccccc2)C(=O)C1)C(C)C ZINC001172679423 1049962807 /nfs/dbraw/zinc/96/28/07/1049962807.db2.gz MOAHGFQCOXAEMR-LJQANCHMSA-N 2 0 348.471 4.066 20 0 EIADRP Clc1ccc2c(c1)C[C@H]([NH2+]C1CC[NH+](C[C@@H]3CC=CCC3)CC1)C2 ZINC001172717001 1049964044 /nfs/dbraw/zinc/96/40/44/1049964044.db2.gz VAZPHKHLLIUKTF-IIBYNOLFSA-N 2 0 344.930 4.218 20 0 EIADRP Clc1ccc2c(c1)C[C@@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001172716988 1049964136 /nfs/dbraw/zinc/96/41/36/1049964136.db2.gz CQOYCAKNRKWRDN-UXHICEINSA-N 2 0 332.919 4.148 20 0 EIADRP CC(C)(C)C[NH+]1CCC(C[NH2+][C@@H]2Cc3ccc(Cl)cc3C2)CC1 ZINC001172716770 1049964200 /nfs/dbraw/zinc/96/42/00/1049964200.db2.gz OOCLSCYDQYXAEA-LJQANCHMSA-N 2 0 334.935 4.155 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@H]2Cc3ccc(Cl)cc3C2)CC1 ZINC001172713688 1049971860 /nfs/dbraw/zinc/97/18/60/1049971860.db2.gz YAEREEJUGRGTMV-IHPCNDPISA-N 2 0 332.919 4.322 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc2c(c1)OCCCO2 ZINC000246856038 1050002610 /nfs/dbraw/zinc/00/26/10/1050002610.db2.gz CTIPVIOBBJWKRF-QZTJIDSGSA-N 2 0 346.515 4.011 20 0 EIADRP CC(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCN(Cc3ccccn3)C[C@@H]2C)C1 ZINC000246940970 1050006294 /nfs/dbraw/zinc/00/62/94/1050006294.db2.gz HQWWCOATECSGQT-YOUFYPILSA-N 2 0 329.532 4.096 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2sc(-c3ccc(F)cc3)nc2C)C1 ZINC000247121250 1050014614 /nfs/dbraw/zinc/01/46/14/1050014614.db2.gz REBSPULOAJQHLZ-HIFRSBDPSA-N 2 0 347.503 4.250 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2sc(-c3ccc(F)cc3)nc2C)C1 ZINC000247121264 1050015341 /nfs/dbraw/zinc/01/53/41/1050015341.db2.gz REBSPULOAJQHLZ-UKRRQHHQSA-N 2 0 347.503 4.250 20 0 EIADRP Cc1c([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cnn1C(C)(C)C ZINC000248738784 1050076595 /nfs/dbraw/zinc/07/65/95/1050076595.db2.gz XVXXDQCIOXZNSA-IAGOWNOFSA-N 2 0 334.552 4.109 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC001172838081 1050164345 /nfs/dbraw/zinc/16/43/45/1050164345.db2.gz SHGDDMSBDFBIDK-AWEZNQCLSA-N 2 0 334.866 4.262 20 0 EIADRP CCC[NH+]1C[C@H]2C[NH+](C3CCC(Cc4ccccc4)CC3)C[C@@H]2C1 ZINC001172825531 1050166404 /nfs/dbraw/zinc/16/64/04/1050166404.db2.gz WXAKQMCGQOLUEA-INAZGPRKSA-N 2 0 326.528 4.062 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([N@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828483 1050167218 /nfs/dbraw/zinc/16/72/18/1050167218.db2.gz MOVPGRFNCOBVAM-DNVJHFABSA-N 2 0 349.522 4.019 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)CC2 ZINC001172832718 1050169509 /nfs/dbraw/zinc/16/95/09/1050169509.db2.gz UJLQRSBNSYQHPL-JOCHJYFZSA-N 2 0 326.528 4.097 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[NH2+]CCCCC[NH+]1CCCC1 ZINC001172841566 1050179555 /nfs/dbraw/zinc/17/95/55/1050179555.db2.gz LOWCSNLKSFNURD-OAHLLOKOSA-N 2 0 326.887 4.266 20 0 EIADRP COC1(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)CCCCC1 ZINC001177266112 1050182462 /nfs/dbraw/zinc/18/24/62/1050182462.db2.gz AMYDVPCMXGDVAZ-IBGZPJMESA-N 2 0 344.543 4.500 20 0 EIADRP CCc1nc2c(s1)[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)CCC2 ZINC000090586939 1050190926 /nfs/dbraw/zinc/19/09/26/1050190926.db2.gz RQXDKKINSMBAAX-CVEARBPZSA-N 2 0 335.561 4.041 20 0 EIADRP C[C@H](C[NH2+]Cc1ccc(Oc2cccc(F)c2)cc1)C[NH+]1CCCC1 ZINC001177328748 1050192790 /nfs/dbraw/zinc/19/27/90/1050192790.db2.gz SLFCIRCCXIWBRY-QGZVFWFLSA-N 2 0 342.458 4.440 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]CCc1ccc(C[NH+](C)C)cc1 ZINC001172856787 1050194688 /nfs/dbraw/zinc/19/46/88/1050194688.db2.gz OFGZXGIDLLOFMA-HNNXBMFYSA-N 2 0 348.893 4.304 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[N@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172858250 1050194925 /nfs/dbraw/zinc/19/49/25/1050194925.db2.gz KZJRDYWHKDVJAT-FSPWUOQZSA-N 2 0 338.898 4.392 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[N@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172858253 1050195233 /nfs/dbraw/zinc/19/52/33/1050195233.db2.gz KZJRDYWHKDVJAT-KKXDTOCCSA-N 2 0 338.898 4.392 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@@H](C)CSc2ccc(Cl)cc2)CC1 ZINC001172875207 1050214236 /nfs/dbraw/zinc/21/42/36/1050214236.db2.gz MTZIDMJWWAWWTK-AWEZNQCLSA-N 2 0 326.937 4.283 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)c1cccc(F)c1F ZINC000090963516 1050217246 /nfs/dbraw/zinc/21/72/46/1050217246.db2.gz FWBAEKGTXQLKPT-LSDHHAIUSA-N 2 0 348.437 4.317 20 0 EIADRP CC(C)CC[C@H]1CC[C@@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)C1 ZINC001177529922 1050242873 /nfs/dbraw/zinc/24/28/73/1050242873.db2.gz UXAMUHPDTZYRCW-AZUAARDMSA-N 2 0 332.532 4.322 20 0 EIADRP C(CC[NH2+][C@H]1CCC[C@@H](C2CCOCC2)C1)CC[NH+]1CCCCC1 ZINC001177678994 1050275783 /nfs/dbraw/zinc/27/57/83/1050275783.db2.gz HYNOZCVLSHWUSY-RTWAWAEBSA-N 2 0 336.564 4.218 20 0 EIADRP CN(C)c1cccc(Cl)c1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC001177678837 1050276734 /nfs/dbraw/zinc/27/67/34/1050276734.db2.gz GJRIPMISNFBHHM-UHFFFAOYSA-N 2 0 337.939 4.152 20 0 EIADRP CC[NH+](CC)CCCC[NH2+][C@H](C)Cc1ccc(OC(F)(F)F)cc1 ZINC001173083248 1050296275 /nfs/dbraw/zinc/29/62/75/1050296275.db2.gz SCSZYUUSAAIUIV-OAHLLOKOSA-N 2 0 346.437 4.228 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccccc2N2CCCC2)CC1 ZINC001173101875 1050301772 /nfs/dbraw/zinc/30/17/72/1050301772.db2.gz OQZOUGDVHPXMIB-UHFFFAOYSA-N 2 0 329.532 4.029 20 0 EIADRP CC[NH+](CC)C1CCC(n2cc(CC[NH3+])c3ccc(F)cc32)CC1 ZINC001173101532 1050302605 /nfs/dbraw/zinc/30/26/05/1050302605.db2.gz JMYRVBWTQJNEMH-UHFFFAOYSA-N 2 0 331.479 4.107 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(-c3ccccc3)c(Cl)c2)C1 ZINC001177795549 1050303563 /nfs/dbraw/zinc/30/35/63/1050303563.db2.gz VPEUZJQTAAUGPX-QGZVFWFLSA-N 2 0 328.887 4.438 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCc2cccc(C(F)(F)F)c2)CC1 ZINC001173104114 1050304415 /nfs/dbraw/zinc/30/44/15/1050304415.db2.gz JJHQHHVQQMPBQA-UHFFFAOYSA-N 2 0 342.449 4.491 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCCOc2cccc(Cl)c2)CC1 ZINC001173104664 1050305649 /nfs/dbraw/zinc/30/56/49/1050305649.db2.gz KULXLEZQJGEPIP-UHFFFAOYSA-N 2 0 338.923 4.352 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](CO)c2cccc3ccccc32)CC1 ZINC001173111160 1050310292 /nfs/dbraw/zinc/31/02/92/1050310292.db2.gz YDCOMXOYRGTLQZ-OBFZPWGMSA-N 2 0 340.511 4.116 20 0 EIADRP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+]C1CCC2(CCC2)CC1 ZINC001177835192 1050310466 /nfs/dbraw/zinc/31/04/66/1050310466.db2.gz LEFAQYUXHWELNP-UHFFFAOYSA-N 2 0 342.527 4.364 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@H](Oc3ccccc3)C2)CC1 ZINC001173112377 1050310661 /nfs/dbraw/zinc/31/06/61/1050310661.db2.gz WTITZIIEUCBGQW-GRERDSQWSA-N 2 0 330.516 4.183 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@H]2c2ccc(OC)cc2)CC1 ZINC001173111578 1050311001 /nfs/dbraw/zinc/31/10/01/1050311001.db2.gz HQSSXLTYSJTWNY-GRERDSQWSA-N 2 0 330.516 4.485 20 0 EIADRP c1ccc(-c2cccc(C[N@@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)c2)nc1 ZINC000092066758 1050314573 /nfs/dbraw/zinc/31/45/73/1050314573.db2.gz JCHQEAJKRRBCGZ-NFBKMPQASA-N 2 0 347.506 4.197 20 0 EIADRP c1ccc(-c2cccc(C[N@@H+]3CC[C@H]4[C@H](CCC[NH+]4C4CC4)C3)c2)nc1 ZINC000092066760 1050314711 /nfs/dbraw/zinc/31/47/11/1050314711.db2.gz JCHQEAJKRRBCGZ-OFNKIYASSA-N 2 0 347.506 4.197 20 0 EIADRP Fc1cccc(Cl)c1CC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC001177976040 1050359383 /nfs/dbraw/zinc/35/93/83/1050359383.db2.gz AUDXOZPFMAMFQL-UHFFFAOYSA-N 2 0 338.898 4.408 20 0 EIADRP C[C@@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001173208752 1050367467 /nfs/dbraw/zinc/36/74/67/1050367467.db2.gz BPZSPRLQBZQCBE-BPUDTRNYSA-N 2 0 348.534 4.481 20 0 EIADRP CCCC[C@@H](CC(C)C)[NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC001173252539 1050377299 /nfs/dbraw/zinc/37/72/99/1050377299.db2.gz JMUIUKIDIUSPLH-NRFANRHFSA-N 2 0 346.559 4.208 20 0 EIADRP CCCC[C@H](CC(C)C)[N@H+]1C[C@H]2CN(Cc3cccnc3)C[C@H]2C1 ZINC001173263854 1050387471 /nfs/dbraw/zinc/38/74/71/1050387471.db2.gz XAUAEHVGKWWTOD-QHAWAJNXSA-N 2 0 329.532 4.050 20 0 EIADRP CC[C@H]1CC[C@H](n2cc(CC[NH+]3CCC([NH3+])CC3)c3ccccc32)C1 ZINC001173269556 1050390241 /nfs/dbraw/zinc/39/02/41/1050390241.db2.gz XIGTYZNJSVDGSC-PXNSSMCTSA-N 2 0 339.527 4.358 20 0 EIADRP CC[C@@H]1CC[C@H]([N@H+](Cc2cccc(OC)c2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173271841 1050391690 /nfs/dbraw/zinc/39/16/90/1050391690.db2.gz RMIPXAIPMTYXTP-AFYVEPGGSA-N 2 0 330.516 4.346 20 0 EIADRP CCSC[C@@H](C)[NH+]1CCC2(CC[C@H]2[N@H+](C)Cc2ccco2)CC1 ZINC001173299050 1050401328 /nfs/dbraw/zinc/40/13/28/1050401328.db2.gz AIIGQEFRPFWKIF-SJLPKXTDSA-N 2 0 336.545 4.098 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cccc(Cl)n2)CC1)CC(C)C ZINC000773737031 1050430360 /nfs/dbraw/zinc/43/03/60/1050430360.db2.gz YMDAIYWJNPHXDE-UHFFFAOYSA-N 2 0 337.939 4.315 20 0 EIADRP c1cc(Oc2ccccc2)oc1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC001203254504 1050450852 /nfs/dbraw/zinc/45/08/52/1050450852.db2.gz CYGJCKRQJGXAHQ-UHFFFAOYSA-N 2 0 340.467 4.284 20 0 EIADRP Cc1ccccc1N(C)c1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@@H](F)CC2)cc1 ZINC001206200340 1050454434 /nfs/dbraw/zinc/45/44/34/1050454434.db2.gz RDIFAKHMJAFRJT-VQTJNVASSA-N 2 0 341.474 4.024 20 0 EIADRP COC(=O)CCCC[C@H](C)[NH2+]CCCCCCCCCCC[NH3+] ZINC001173444572 1050462846 /nfs/dbraw/zinc/46/28/46/1050462846.db2.gz KSBSILOOOJXOPV-SFHVURJKSA-N 2 0 328.541 4.168 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC001173540378 1050474943 /nfs/dbraw/zinc/47/49/43/1050474943.db2.gz WMLPRIWYNPAOML-HIFRSBDPSA-N 2 0 329.315 4.388 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+][C@@H]1CCC[N@H+](C)CC1 ZINC001173541803 1050475717 /nfs/dbraw/zinc/47/57/17/1050475717.db2.gz DAOQWMZFJIOVAQ-UKRRQHHQSA-N 2 0 329.315 4.388 20 0 EIADRP CC[C@@H]1CCC[C@@H]1C[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC001178748671 1050542394 /nfs/dbraw/zinc/54/23/94/1050542394.db2.gz WDLQUCHGRLPIKM-WOJBJXKFSA-N 2 0 330.516 4.077 20 0 EIADRP Cc1cccc(C[NH2+]CCCCC[NH+]2CCCC2)c1Br ZINC001178811910 1050559370 /nfs/dbraw/zinc/55/93/70/1050559370.db2.gz ZYUKMVAORMXHSU-UHFFFAOYSA-N 2 0 339.321 4.113 20 0 EIADRP CN(c1ccccc1C[NH2+]CC1(C)CCCCC1)C1CC[NH+](C)CC1 ZINC001178844487 1050568847 /nfs/dbraw/zinc/56/88/47/1050568847.db2.gz MOQHYWZVWHQIPJ-UHFFFAOYSA-N 2 0 343.559 4.277 20 0 EIADRP Cc1c(Cl)cccc1C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC001179095705 1050633109 /nfs/dbraw/zinc/63/31/09/1050633109.db2.gz MZTFZEDQBUZUDB-UHFFFAOYSA-N 2 0 343.902 4.045 20 0 EIADRP COc1ccc2cc(C[NH2+]CCC3CC[NH+](C(C)C)CC3)ccc2c1 ZINC001179277410 1050668709 /nfs/dbraw/zinc/66/87/09/1050668709.db2.gz FDYHTFOIUKRXJJ-UHFFFAOYSA-N 2 0 340.511 4.449 20 0 EIADRP C[C@@H](C[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC001180267119 1050942930 /nfs/dbraw/zinc/94/29/30/1050942930.db2.gz OSNQAAMBLHLISM-AZUAARDMSA-N 2 0 340.486 4.383 20 0 EIADRP CN(c1ccccc1)c1ccc(C[NH2+]CC(C)(C)C[NH+](C)C)cc1 ZINC000620434864 1051130688 /nfs/dbraw/zinc/13/06/88/1051130688.db2.gz UUJBNLKRTUHXOF-UHFFFAOYSA-N 2 0 325.500 4.132 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2scnc2C)ccc1OC ZINC000775387358 1051186070 /nfs/dbraw/zinc/18/60/70/1051186070.db2.gz XIBLFNOSFNYBPZ-CQSZACIVSA-N 2 0 347.528 4.153 20 0 EIADRP Clc1ccc([C@H]2CC[C@@H]([NH2+]CC3CC[NH+](C4CC4)CC3)C2)cc1 ZINC001181234168 1051191513 /nfs/dbraw/zinc/19/15/13/1051191513.db2.gz HWJPFHFCKJAPLH-PKOBYXMFSA-N 2 0 332.919 4.440 20 0 EIADRP C[C@H](CCOCc1ccccc1)[NH2+]C[C@H]1CCC[N@@H+]1C1CCCCC1 ZINC001181276817 1051195366 /nfs/dbraw/zinc/19/53/66/1051195366.db2.gz RQKBHDJMIWVGDA-DENIHFKCSA-N 2 0 344.543 4.369 20 0 EIADRP CC[N@H+](CCc1cccs1)Cc1ccc(-n2ccnc2)cc1C ZINC001190572316 1051218284 /nfs/dbraw/zinc/21/82/84/1051218284.db2.gz UXRNQDDNZUVYIB-UHFFFAOYSA-N 2 0 325.481 4.307 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)C1 ZINC000163218043 1051241474 /nfs/dbraw/zinc/24/14/74/1051241474.db2.gz REBSPULOAJQHLZ-DZGCQCFKSA-N 2 0 347.503 4.250 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000163229481 1051289797 /nfs/dbraw/zinc/28/97/97/1051289797.db2.gz NUFZEZZDBLTINP-NVXWUHKLSA-N 2 0 341.524 4.119 20 0 EIADRP CC[N@@H+]1CCCC[C@@H]1C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C ZINC001182001607 1051368298 /nfs/dbraw/zinc/36/82/98/1051368298.db2.gz MGSGDZATHOBDRT-MRXNPFEDSA-N 2 0 342.508 4.446 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@@H]3CCCCC3(F)F)CC2)C1 ZINC001182054103 1051386487 /nfs/dbraw/zinc/38/64/87/1051386487.db2.gz SDNQLPCNFSABMC-RYRKJORJSA-N 2 0 328.491 4.445 20 0 EIADRP Fc1cccc(C2(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)CC2)c1 ZINC000155278454 1051402170 /nfs/dbraw/zinc/40/21/70/1051402170.db2.gz UOFKALSFOVVLLN-UHFFFAOYSA-N 2 0 330.491 4.244 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](C[C@@H]2CCCC(C)(C)O2)CC1 ZINC001191549315 1051485951 /nfs/dbraw/zinc/48/59/51/1051485951.db2.gz AVAYVDYVVYEWAD-QUCCMNQESA-N 2 0 336.564 4.311 20 0 EIADRP COc1ccc(-c2csc(C[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@H]3C)c2)cc1 ZINC000157653906 1051661657 /nfs/dbraw/zinc/66/16/57/1051661657.db2.gz NYURUBODSGXAKA-QEEYODRMSA-N 2 0 344.524 4.242 20 0 EIADRP CC(C)COc1cccc(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3C3CC3)C2)c1 ZINC001192323748 1051691561 /nfs/dbraw/zinc/69/15/61/1051691561.db2.gz FCNKMXJVYXYQAC-SIKLNZKXSA-N 2 0 342.527 4.170 20 0 EIADRP c1cnc2c(c1)cccc2C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000078506156 1051709687 /nfs/dbraw/zinc/70/96/87/1051709687.db2.gz IWTDVADRLNSFOA-UHFFFAOYSA-N 2 0 331.463 4.120 20 0 EIADRP CCCC[C@@H]1CCC[C@H]1[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC001182783849 1051710801 /nfs/dbraw/zinc/71/08/01/1051710801.db2.gz YNGAHHOHLUMWKK-NHCUHLMSSA-N 2 0 329.532 4.242 20 0 EIADRP Fc1cccc2c1CC[C@@H]2[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC001192402037 1051722542 /nfs/dbraw/zinc/72/25/42/1051722542.db2.gz RKDBYOSCGUANFP-NRFANRHFSA-N 2 0 330.491 4.401 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1ccccn1 ZINC000158659765 1051772926 /nfs/dbraw/zinc/77/29/26/1051772926.db2.gz ZDBXKPMCAWAMNK-OTWHNJEPSA-N 2 0 337.511 4.410 20 0 EIADRP C[C@H]1C[N@H+](CCSc2cccc(Cl)c2)CCN1c1cc[nH+]cc1 ZINC001175775200 1051780242 /nfs/dbraw/zinc/78/02/42/1051780242.db2.gz PKGRPNGWJOMNDR-HNNXBMFYSA-N 2 0 347.915 4.038 20 0 EIADRP C[C@@H]1CC[N@H+](CCCc2ccc(Cl)c(Cl)c2)CC[C@@H]1C[NH3+] ZINC001205604868 1051794642 /nfs/dbraw/zinc/79/46/42/1051794642.db2.gz YIORDIYVIJNARP-UKRRQHHQSA-N 2 0 329.315 4.233 20 0 EIADRP C[N@H+]1Cc2c(Nc3ccc(C[NH3+])cc3)cccc2[C@H](c2ccccc2)C1 ZINC001175971773 1051853983 /nfs/dbraw/zinc/85/39/83/1051853983.db2.gz OPKOCWNFZZHHKG-NRFANRHFSA-N 2 0 343.474 4.466 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2ccc(C)c(OC)c2)CC1 ZINC001193324777 1051900185 /nfs/dbraw/zinc/90/01/85/1051900185.db2.gz RXBUOLFYDNHKNE-UHFFFAOYSA-N 2 0 332.532 4.338 20 0 EIADRP COc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cc1F ZINC000072980632 1051921675 /nfs/dbraw/zinc/92/16/75/1051921675.db2.gz RBHSIBWAAYEBGA-UHFFFAOYSA-N 2 0 342.458 4.110 20 0 EIADRP FC1(F)C[C@@H]1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@H]21 ZINC000621768927 1051943876 /nfs/dbraw/zinc/94/38/76/1051943876.db2.gz WRLQDDHEMYHMCH-OKYOBFRVSA-N 2 0 334.454 4.065 20 0 EIADRP FC1(F)C[C@@H]1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21 ZINC000621768928 1051944340 /nfs/dbraw/zinc/94/43/40/1051944340.db2.gz WRLQDDHEMYHMCH-WJFTUGDTSA-N 2 0 334.454 4.065 20 0 EIADRP Cc1cc(C[N@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@@H]3C2)ccc1C(F)(F)F ZINC001184301171 1051982510 /nfs/dbraw/zinc/98/25/10/1051982510.db2.gz GARQDWZFRRPWTE-GVDBMIGSSA-N 2 0 340.433 4.176 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)cc1OC ZINC000163595768 1051997786 /nfs/dbraw/zinc/99/77/86/1051997786.db2.gz MDLMDQSZGHAIIM-KRWDZBQOSA-N 2 0 348.531 4.113 20 0 EIADRP Cc1cccc([C@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c1 ZINC000165207027 1052054974 /nfs/dbraw/zinc/05/49/74/1052054974.db2.gz OMGPSGLGOJRTFW-SFHVURJKSA-N 2 0 326.484 4.176 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cc(Cl)sc1Cl ZINC000165984046 1052082344 /nfs/dbraw/zinc/08/23/44/1052082344.db2.gz LIEQRJFOGNGPEY-GHMZBOCLSA-N 2 0 339.332 4.062 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)C1 ZINC000166173048 1052087164 /nfs/dbraw/zinc/08/71/64/1052087164.db2.gz QMTQCNBNPDQVNN-URVUXULASA-N 2 0 344.543 4.256 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cc(C)cc(Br)c2)C[C@@H]1C ZINC000774903349 1052269909 /nfs/dbraw/zinc/26/99/09/1052269909.db2.gz MKSNUMMUCOJKBU-YOEHRIQHSA-N 2 0 339.321 4.062 20 0 EIADRP CC1CC[NH+](Cc2ccc(C[NH2+]Cc3cccc4n[nH]cc43)cc2)CC1 ZINC000623346548 1052626506 /nfs/dbraw/zinc/62/65/06/1052626506.db2.gz WJMZQOGONKLBHA-UHFFFAOYSA-N 2 0 348.494 4.085 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CCOc2ccccc2-c2ccccc2)CC1(C)C ZINC000623378449 1052641878 /nfs/dbraw/zinc/64/18/78/1052641878.db2.gz BERVJTMGFAHYNE-IBGZPJMESA-N 2 0 338.495 4.195 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+]C[C@@H]2CCCC[N@H+](C)C2)cc1 ZINC000623656265 1052698317 /nfs/dbraw/zinc/69/83/17/1052698317.db2.gz QMZCRKWVRIJEII-IBGZPJMESA-N 2 0 338.495 4.184 20 0 EIADRP CC[C@@H](C)Oc1cc(C[NH2+]C[C@H](C)C[NH+]2CCCCC2)ccc1OC ZINC000624019776 1052853885 /nfs/dbraw/zinc/85/38/85/1052853885.db2.gz ZAKIFPTXTZLEKB-ZWKOTPCHSA-N 2 0 348.531 4.084 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000624124053 1052868196 /nfs/dbraw/zinc/86/81/96/1052868196.db2.gz VZJICWSWENQDBP-ZQDZILKHSA-N 2 0 326.937 4.215 20 0 EIADRP CCC(F)(F)C(C)(C)C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000624155004 1052869835 /nfs/dbraw/zinc/86/98/35/1052869835.db2.gz CGQZICDWOJJTQJ-HNNXBMFYSA-N 2 0 342.474 4.349 20 0 EIADRP CC(C)[C@@H]1C[C@@H]([NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)CCO1 ZINC000381195275 1053057019 /nfs/dbraw/zinc/05/70/19/1053057019.db2.gz ZVBSNEPYWJPDKP-FSSWDIPSSA-N 2 0 344.543 4.082 20 0 EIADRP c1cc(C[NH+]2CCC(C[NH2+][C@@H]3CC[C@H]4CCCC[C@H]4C3)CC2)ccn1 ZINC000850516351 1053276187 /nfs/dbraw/zinc/27/61/87/1053276187.db2.gz BTOSQUNGOSPLGX-BHIFYINESA-N 2 0 341.543 4.242 20 0 EIADRP Cc1c([C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cnn1-c1ccccc1 ZINC000764770140 1053303399 /nfs/dbraw/zinc/30/33/99/1053303399.db2.gz WLVUBTHOYSREFF-QGZVFWFLSA-N 2 0 348.494 4.093 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000383365051 1053328771 /nfs/dbraw/zinc/32/87/71/1053328771.db2.gz UXUUVOAWPQDXLT-GHTZIAJQSA-N 2 0 326.459 4.389 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)CCC2 ZINC000339070522 1053339494 /nfs/dbraw/zinc/33/94/94/1053339494.db2.gz ZJWQYWOQQWEPRG-OAQYLSRUSA-N 2 0 338.495 4.103 20 0 EIADRP COc1ccc(CC[C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000764963360 1053398713 /nfs/dbraw/zinc/39/87/13/1053398713.db2.gz NRHJYGAQVXGWIT-RBUKOAKNSA-N 2 0 332.532 4.261 20 0 EIADRP C[C@H](C[NH2+][C@H](C)c1ccc(SC(F)F)cc1)C[NH+]1CCCC1 ZINC000765119275 1053445166 /nfs/dbraw/zinc/44/51/66/1053445166.db2.gz MSECVGCFRUDVSA-ZIAGYGMSSA-N 2 0 328.472 4.384 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)cc2)cs1 ZINC000339072179 1053475700 /nfs/dbraw/zinc/47/57/00/1053475700.db2.gz UQOGSYJIWKPCHE-GDIGMMSISA-N 2 0 341.524 4.396 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cnc(CC(C)C)s1 ZINC000161969785 1053493969 /nfs/dbraw/zinc/49/39/69/1053493969.db2.gz BSUJWYISOLXWSW-UHFFFAOYSA-N 2 0 345.556 4.473 20 0 EIADRP C[C@@H](C[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1)c1cccc(F)c1 ZINC000765360750 1053516884 /nfs/dbraw/zinc/51/68/84/1053516884.db2.gz SHQMWRMNRHXVFX-DLBZAZTESA-N 2 0 344.474 4.220 20 0 EIADRP CSCC1CCC([NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000385424950 1053522195 /nfs/dbraw/zinc/52/21/95/1053522195.db2.gz LCMVAGVBCYGMHR-RCKXYERXSA-N 2 0 346.584 4.408 20 0 EIADRP C[C@H]([NH2+]Cc1cnc2c(F)cccc2c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000865523483 1053535284 /nfs/dbraw/zinc/53/52/84/1053535284.db2.gz CFQLRQRFCUOGFV-MAUKXSAKSA-N 2 0 341.474 4.117 20 0 EIADRP c1ccc(CN2CC[C@H]([NH2+]CC[C@H]3CCCS3)CC23CC3)cc1 ZINC000865725615 1053577794 /nfs/dbraw/zinc/57/77/94/1053577794.db2.gz NCPJRROVXDZHGU-RBUKOAKNSA-N 2 0 330.541 4.059 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)CC1 ZINC000865717327 1053578028 /nfs/dbraw/zinc/57/80/28/1053578028.db2.gz WSVITYJDLIFLTJ-PZJWPPBQSA-N 2 0 329.532 4.208 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000865764980 1053587482 /nfs/dbraw/zinc/58/74/82/1053587482.db2.gz GZBZUUTVLSDBHP-VKAVYKQESA-N 2 0 330.516 4.089 20 0 EIADRP FC(F)(F)[C@@H]1CC=CC[C@H]1[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000865830105 1053601382 /nfs/dbraw/zinc/60/13/82/1053601382.db2.gz KRXFIMLPGHNGSF-IAGOWNOFSA-N 2 0 330.438 4.270 20 0 EIADRP Clc1nc2ccccc2cc1C[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000852753542 1053610748 /nfs/dbraw/zinc/61/07/48/1053610748.db2.gz DGFGTUOUIKHWEN-QGZVFWFLSA-N 2 0 343.902 4.100 20 0 EIADRP FC(F)Sc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)cc1 ZINC000853093535 1053643066 /nfs/dbraw/zinc/64/30/66/1053643066.db2.gz MLOHDKVIAFFBGR-INIZCTEOSA-N 2 0 340.483 4.213 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)CCc2cncc3ccccc32)C1 ZINC000866260910 1053667512 /nfs/dbraw/zinc/66/75/12/1053667512.db2.gz PHORDZFIMHHLHA-MOPGFXCFSA-N 2 0 339.527 4.266 20 0 EIADRP C[C@@H](CCc1cncc2ccccc21)[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000866518046 1053765569 /nfs/dbraw/zinc/76/55/69/1053765569.db2.gz RQKCGSHJBSNHGX-RYHLMMNBSA-N 2 0 339.527 4.408 20 0 EIADRP CC(C)C[C@H](C)C[N@@H+]1CC[C@H](Oc2ccnc(C[NH+](C)C(C)C)c2)C1 ZINC000856559697 1054085783 /nfs/dbraw/zinc/08/57/83/1054085783.db2.gz SMUOPAJPWAIMNW-RXVVDRJESA-N 2 0 347.547 4.057 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CC[C@@H]2CC2(F)F)ccc1OC ZINC000857082521 1054175227 /nfs/dbraw/zinc/17/52/27/1054175227.db2.gz WUHINHLAGAPSJR-WMLDXEAASA-N 2 0 340.458 4.233 20 0 EIADRP c1ccc([C@@H](CN2CCCC2)[NH2+][C@@H]2CCCc3ccccc3C2)cc1 ZINC001198901019 1054292757 /nfs/dbraw/zinc/29/27/57/1054292757.db2.gz OGUMCLBCHZDMQR-DHIUTWEWSA-N 2 0 334.507 4.361 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)cc2cccnc12 ZINC001199045872 1054332885 /nfs/dbraw/zinc/33/28/85/1054332885.db2.gz WUYXJPBXSMJFNN-UHFFFAOYSA-N 2 0 345.490 4.429 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCO[C@@H](C(C)(C)C)C3)CC2)CC1 ZINC000872050703 1054361625 /nfs/dbraw/zinc/36/16/25/1054361625.db2.gz CEGGSSKSQAENAS-ZUPWUQBJSA-N 2 0 336.564 4.213 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)CCO1 ZINC001199275049 1054374174 /nfs/dbraw/zinc/37/41/74/1054374174.db2.gz CGUXRPGAJZDKRD-QIJUGHKUSA-N 2 0 344.543 4.354 20 0 EIADRP COc1ccsc1C[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC001199267229 1054377325 /nfs/dbraw/zinc/37/73/25/1054377325.db2.gz NDDGJCMFBDJIEL-INIZCTEOSA-N 2 0 344.524 4.421 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCc3ccc(Cl)nc32)CC1 ZINC000857908114 1054382543 /nfs/dbraw/zinc/38/25/43/1054382543.db2.gz XAGDGHGDABJNSM-QGZVFWFLSA-N 2 0 335.923 4.070 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2cc(C)sc2C)cc1 ZINC001199329527 1054392202 /nfs/dbraw/zinc/39/22/02/1054392202.db2.gz VRZUPAFPEVGKLG-UHFFFAOYSA-N 2 0 346.540 4.375 20 0 EIADRP Cc1cc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)c2c(n1)CCCC2 ZINC001199336201 1054394808 /nfs/dbraw/zinc/39/48/08/1054394808.db2.gz IZCDXSPYJFSUBS-GOSISDBHSA-N 2 0 329.532 4.013 20 0 EIADRP CC(C)C[C@H]1CCC[C@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)C1 ZINC001199384054 1054402409 /nfs/dbraw/zinc/40/24/09/1054402409.db2.gz NOZNVTCQPIBVLT-UXHICEINSA-N 2 0 332.532 4.322 20 0 EIADRP CC[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CCO1 ZINC001199630289 1054435987 /nfs/dbraw/zinc/43/59/87/1054435987.db2.gz VKTKJEHVTOKXOB-IFMALSPDSA-N 2 0 344.543 4.498 20 0 EIADRP COc1ccc(CC[C@H](C)[NH2+]CC(C)(C)[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC001199760311 1054463675 /nfs/dbraw/zinc/46/36/75/1054463675.db2.gz PSZOPWJJRUCZSB-OTWHNJEPSA-N 2 0 346.559 4.362 20 0 EIADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)C1 ZINC000873254260 1054513909 /nfs/dbraw/zinc/51/39/09/1054513909.db2.gz OTVWISKPCACGMF-BYCMXARLSA-N 2 0 347.915 4.168 20 0 EIADRP FC(F)(F)[C@@H]1CC=CC[C@H]1C[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1 ZINC000873250237 1054515484 /nfs/dbraw/zinc/51/54/84/1054515484.db2.gz FIAPMMLKTBVFGY-JZAWBGDQSA-N 2 0 330.438 4.032 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(Oc2ccccc2)cn1 ZINC000873262203 1054516484 /nfs/dbraw/zinc/51/64/84/1054516484.db2.gz WEVKOXJAXDWJLT-FJIDUMEYSA-N 2 0 337.467 4.055 20 0 EIADRP CCOc1cccc2cc([C@@H](C)[NH2+]C[C@H]3C[C@H]4CC[C@@H](C3)[NH2+]4)oc21 ZINC000873265119 1054516950 /nfs/dbraw/zinc/51/69/50/1054516950.db2.gz TZNLMDXOYFRAMB-TXCZRRACSA-N 2 0 328.456 4.013 20 0 EIADRP COc1cc([C@@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)ccc1SC(F)F ZINC000873271788 1054520785 /nfs/dbraw/zinc/52/07/85/1054520785.db2.gz LKQYYSXHJXSHNR-NWDGAFQWSA-N 2 0 344.471 4.049 20 0 EIADRP C[C@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccns1 ZINC000858576980 1054521238 /nfs/dbraw/zinc/52/12/38/1054521238.db2.gz OFEMFFWEPFKHSK-ZLPCBKJTSA-N 2 0 329.513 4.237 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccns2)ccc1OC ZINC000858577436 1054524152 /nfs/dbraw/zinc/52/41/52/1054524152.db2.gz PWPNVXZKHVHODR-GJZGRUSLSA-N 2 0 347.528 4.405 20 0 EIADRP c1ccc2c(c1)CCC[C@@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)C2 ZINC001200863753 1054557913 /nfs/dbraw/zinc/55/79/13/1054557913.db2.gz IUWMKZYQQSSQOL-OAQYLSRUSA-N 2 0 326.528 4.321 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2ccc(Cl)c(F)c2)CC1 ZINC001200871788 1054562333 /nfs/dbraw/zinc/56/23/33/1054562333.db2.gz DBPFWAKVHSVVEW-UHFFFAOYSA-N 2 0 326.887 4.327 20 0 EIADRP Fc1c(C[NH2+]C2CCC([NH+]3CCCCC3)CC2)cccc1OC1CC1 ZINC001200880427 1054564985 /nfs/dbraw/zinc/56/49/85/1054564985.db2.gz SUFPJDQDOFAUJM-UHFFFAOYSA-N 2 0 346.490 4.254 20 0 EIADRP CN(Cc1ccc(C[NH+](C)C)cc1)Cc1ncc(Cl)cc1Cl ZINC000859211868 1054645467 /nfs/dbraw/zinc/64/54/67/1054645467.db2.gz GUOHLXHBVJAUDA-UHFFFAOYSA-N 2 0 338.282 4.082 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1ccc(C)cc1C ZINC000061069847 1054740684 /nfs/dbraw/zinc/74/06/84/1054740684.db2.gz NGAFRDKHUBGUQS-UHFFFAOYSA-N 2 0 340.511 4.314 20 0 EIADRP C[N@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+](CCc1ccccc1)CC2 ZINC001201596278 1054847455 /nfs/dbraw/zinc/84/74/55/1054847455.db2.gz BXKURMGJRGDNBA-OAQYLSRUSA-N 2 0 338.495 4.199 20 0 EIADRP CCOc1cccc(F)c1C[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC001201607395 1054863787 /nfs/dbraw/zinc/86/37/87/1054863787.db2.gz BFHFLJKRUAGCQH-UHFFFAOYSA-N 2 0 348.506 4.357 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]Cc2c(Cl)cccc2N2CC[NH+](C)CC2)C[C@H]1C ZINC001201928866 1054943912 /nfs/dbraw/zinc/94/39/12/1054943912.db2.gz FLTDBBPJAANPTK-ZACQAIPSSA-N 2 0 349.950 4.006 20 0 EIADRP C[N@H+](Cc1ccccc1)[C@H]1COC2(C1)CC[NH+](CCC(C)(C)C)CC2 ZINC001202072761 1055002258 /nfs/dbraw/zinc/00/22/58/1055002258.db2.gz BJLRWLVUUDRYMJ-HXUWFJFHSA-N 2 0 344.543 4.178 20 0 EIADRP COc1cccc(C[N@@H+]2CCC3(C2)CC[NH+](CCC(C)(C)C)CC3)c1 ZINC001202077546 1055038816 /nfs/dbraw/zinc/03/88/16/1055038816.db2.gz IVEMSXVQRVQJKM-UHFFFAOYSA-N 2 0 344.543 4.419 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCCCCCc1ccccc1 ZINC000863541583 1055224900 /nfs/dbraw/zinc/22/49/00/1055224900.db2.gz JQTCOTJCYMKMRL-KRWDZBQOSA-N 2 0 325.500 4.302 20 0 EIADRP C[C@@H](NCc1cc(C(F)(F)F)co1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000878411519 1055295499 /nfs/dbraw/zinc/29/54/99/1055295499.db2.gz LHUJNKKRVBAIKM-CHWSQXEVSA-N 2 0 330.394 4.041 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@@H]1CCCCc2cc(Br)ccc21 ZINC000338671173 1055505656 /nfs/dbraw/zinc/50/56/56/1055505656.db2.gz ABHOTQDEJKMKSH-QGZVFWFLSA-N 2 0 339.321 4.148 20 0 EIADRP CC(C)(C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(Cl)c(Cl)c1 ZINC000166407354 1055547373 /nfs/dbraw/zinc/54/73/73/1055547373.db2.gz QYNKIXXWONPCBS-HUUCEWRRSA-N 2 0 341.326 4.487 20 0 EIADRP Cc1cccc(O[C@@H]2CCCC[C@@H]2[NH2+]C2CC[NH+](C(C)C)CC2)c1 ZINC000542935088 1056804833 /nfs/dbraw/zinc/80/48/33/1056804833.db2.gz ASQFHJLIRJWLPS-LEWJYISDSA-N 2 0 330.516 4.147 20 0 EIADRP COc1ccc(OC)c([C@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)c1 ZINC000766510321 1060423737 /nfs/dbraw/zinc/42/37/37/1060423737.db2.gz GTJRVJALYHESFV-AOCRQIFASA-N 2 0 346.515 4.152 20 0 EIADRP c1ccc2c(c1)CCSC[C@H]2[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000766511251 1060428049 /nfs/dbraw/zinc/42/80/49/1060428049.db2.gz BXQGTXCFGINOOR-GZNCHQMQSA-N 2 0 344.568 4.404 20 0 EIADRP CC(C)(C)CC(C)(C)Nc1ccc(C[NH+]2CCC(C[NH3+])CC2)cc1 ZINC001169053353 1060610307 /nfs/dbraw/zinc/61/03/07/1060610307.db2.gz VYYDHUAAYGUMJE-UHFFFAOYSA-N 2 0 331.548 4.484 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C(C)(C)c1cc(Cl)cc(Cl)c1)C2 ZINC001169101337 1060637540 /nfs/dbraw/zinc/63/75/40/1060637540.db2.gz RESCQYXJMXCGIH-PHZGNYQRSA-N 2 0 327.299 4.443 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C1(c3ccccc3)CCC(F)(F)CC1)C2 ZINC001169117106 1060647129 /nfs/dbraw/zinc/64/71/29/1060647129.db2.gz VSZJLUQWIRYCCG-BCDXTJNWSA-N 2 0 334.454 4.306 20 0 EIADRP CC1(C)C[C@@H](Nc2cc(N3CCCCC3)cc[nH+]2)C[C@@](C)(C[NH3+])C1 ZINC001169147492 1060664976 /nfs/dbraw/zinc/66/49/76/1060664976.db2.gz XBRIIXYKLIQNTE-OXQOHEQNSA-N 2 0 330.520 4.028 20 0 EIADRP C[NH+](C)CCC(C)(C)Nc1ccc2c(c1)C[N@@H+](Cc1ccccc1)C2 ZINC001169717652 1060915764 /nfs/dbraw/zinc/91/57/64/1060915764.db2.gz HICLPRHJGFFQDZ-UHFFFAOYSA-N 2 0 337.511 4.345 20 0 EIADRP CC[C@@H](c1ccc(F)cc1)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000078847300 217134481 /nfs/dbraw/zinc/13/44/81/217134481.db2.gz RMNSWSDTZCVFLZ-FVJLSDCUSA-N 2 0 348.506 4.098 20 0 EIADRP CSc1ccc([C@@H](C)[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000298165306 526058371 /nfs/dbraw/zinc/05/83/71/526058371.db2.gz SXHFRPZEAVBUCT-OAHLLOKOSA-N 2 0 327.497 4.123 20 0 EIADRP CC1CC[NH+](CCCC[NH2+][C@H]2CSCCc3ccccc32)CC1 ZINC000532192954 1032076816 /nfs/dbraw/zinc/07/68/16/1032076816.db2.gz JZYXBZVTDHPIIR-FQEVSTJZSA-N 2 0 332.557 4.119 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H](CC1CC1)c1ccccc1 ZINC000532206132 1032092890 /nfs/dbraw/zinc/09/28/90/1032092890.db2.gz FFYYCJOHXFVIPM-NRFANRHFSA-N 2 0 338.495 4.258 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2ccc(Br)cc2)C1 ZINC000532214760 1032094769 /nfs/dbraw/zinc/09/47/69/1032094769.db2.gz LCFFWJGJKWZARJ-HUUCEWRRSA-N 2 0 339.321 4.220 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2c(F)cccc2F)CCCC1 ZINC000532219072 1032098521 /nfs/dbraw/zinc/09/85/21/1032098521.db2.gz KVGJJKXGTVTGDY-IIDMSEBBSA-N 2 0 336.470 4.095 20 0 EIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1cccc2cc[nH]c21 ZINC000532374316 1032213531 /nfs/dbraw/zinc/21/35/31/1032213531.db2.gz FPAPDCFIMMKZTG-OEWRPIJISA-N 2 0 347.506 4.414 20 0 EIADRP C[C@H](c1ccc(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3C)C2)cc1)C(F)(F)F ZINC000450504322 1032534204 /nfs/dbraw/zinc/53/42/04/1032534204.db2.gz UMSHESASPLNLOZ-OLMNPRSZSA-N 2 0 340.433 4.269 20 0 EIADRP CCC[C@H](NCC[C@@H](C)[N@H+](C)Cc1ccccc1)c1ccccn1 ZINC000500619758 1032726572 /nfs/dbraw/zinc/72/65/72/1032726572.db2.gz UQRIWIGODPXZCC-QUCCMNQESA-N 2 0 325.500 4.423 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]C[C@H]3CCC[C@@H]([NH3+])C3)cs2)cs1 ZINC000643541048 1018789115 /nfs/dbraw/zinc/78/91/15/1018789115.db2.gz CTCFLFUKKCAZIA-CORIIIEPSA-N 2 0 335.542 4.348 20 0 EIADRP CC[C@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1cccc(Br)c1 ZINC000643545817 1018893672 /nfs/dbraw/zinc/89/36/72/1018893672.db2.gz CNNWBUDXOUVDDX-HOTGVXAUSA-N 2 0 337.305 4.165 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643547266 1018919059 /nfs/dbraw/zinc/91/90/59/1018919059.db2.gz BXMNXXKFJCXENZ-DLBZAZTESA-N 2 0 339.527 4.488 20 0 EIADRP Brc1ccc2c(c1)CCC[C@@H]2[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000643547595 1018927816 /nfs/dbraw/zinc/92/78/16/1018927816.db2.gz HQYSTOVBZOZDPE-WBVHZDCISA-N 2 0 349.316 4.091 20 0 EIADRP C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccc(-c4cccc(F)c4)s3)C2)C1 ZINC000430163196 1018934475 /nfs/dbraw/zinc/93/44/75/1018934475.db2.gz LDBWNLWXCLRQRV-LJQANCHMSA-N 2 0 330.472 4.082 20 0 EIADRP CCc1nc(C)c([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)s1 ZINC000183196239 1019802121 /nfs/dbraw/zinc/80/21/21/1019802121.db2.gz PUNVBVCRHVONDB-OFQRWUPVSA-N 2 0 335.561 4.318 20 0 EIADRP COC1CCC(C)(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000530522684 1020046213 /nfs/dbraw/zinc/04/62/13/1020046213.db2.gz QCRUQZHTKDGISV-GRTSPXDGSA-N 2 0 344.543 4.082 20 0 EIADRP CC1CC[NH+](C[C@@H]2CCCN(CC[C@@H]3CC3(Cl)Cl)C2)CC1 ZINC001167255607 1020679045 /nfs/dbraw/zinc/67/90/45/1020679045.db2.gz JSZUAJWRNLHXIF-HZPDHXFCSA-N 2 0 333.347 4.014 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+](Cc1ccc(F)c(C(F)(F)F)c1)CC2 ZINC001204490255 1020811613 /nfs/dbraw/zinc/81/16/13/1020811613.db2.gz NMHGRUVYRYIDDK-UHFFFAOYSA-N 2 0 344.396 4.152 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000683472273 1020848891 /nfs/dbraw/zinc/84/88/91/1020848891.db2.gz KEKPDQXLXKAYGQ-QGZVFWFLSA-N 2 0 328.431 4.049 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3ccc4[nH]ccc4c3)CC2)CC1 ZINC000655752067 1020938060 /nfs/dbraw/zinc/93/80/60/1020938060.db2.gz HXKMQJRSWCRPRA-UHFFFAOYSA-N 2 0 325.500 4.301 20 0 EIADRP CC[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CCCCO1 ZINC000655850680 1021016580 /nfs/dbraw/zinc/01/65/80/1021016580.db2.gz YJJVKOVFKAMJNS-WIYBCGNWSA-N 2 0 342.527 4.119 20 0 EIADRP c1ccc([C@@H](C[C@H]2CCOC2)[NH2+]CCCCC[NH+]2CCCC2)cc1 ZINC000340479290 1021101076 /nfs/dbraw/zinc/10/10/76/1021101076.db2.gz LMFRNFMEDCPRGK-TZIWHRDSSA-N 2 0 330.516 4.010 20 0 EIADRP Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000683693641 1021104309 /nfs/dbraw/zinc/10/43/09/1021104309.db2.gz JMCXFBHOWNUIRW-WMLDXEAASA-N 2 0 328.422 4.308 20 0 EIADRP CN(c1ccccc1)c1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000683706477 1021127746 /nfs/dbraw/zinc/12/77/46/1021127746.db2.gz KTWPAGXVPCISJG-UHFFFAOYSA-N 2 0 349.522 4.419 20 0 EIADRP C[NH+]1CCC2(CCC[N@H+](Cc3csc(-c4ccsc4)n3)C2)CC1 ZINC000376001535 1021185176 /nfs/dbraw/zinc/18/51/76/1021185176.db2.gz VDYLHVYXHFYWFD-UHFFFAOYSA-N 2 0 347.553 4.179 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)CC[NH+](C)CC1 ZINC000570209053 1021241775 /nfs/dbraw/zinc/24/17/75/1021241775.db2.gz KLUYUKXRSQRYQR-ZDUSSCGKSA-N 2 0 346.462 4.183 20 0 EIADRP CCN1CCC[C@@H]1C[NH2+]C(CCC(F)(F)F)CCC(F)(F)F ZINC000924561871 1021562633 /nfs/dbraw/zinc/56/26/33/1021562633.db2.gz YHFOLWIKRNNGRN-GFCCVEGCSA-N 2 0 334.348 4.114 20 0 EIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000683816561 1021688862 /nfs/dbraw/zinc/68/88/62/1021688862.db2.gz SWOSAZKHECXURN-UTKZUKDTSA-N 2 0 330.516 4.007 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc3cnccc3c2)CC1 ZINC000683825905 1021720568 /nfs/dbraw/zinc/72/05/68/1021720568.db2.gz ZVGQZZWWDNSGKA-UHFFFAOYSA-N 2 0 325.500 4.179 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c(C)c1 ZINC000414063752 1021770188 /nfs/dbraw/zinc/77/01/88/1021770188.db2.gz MTMUCDJHYOIUFY-SFHVURJKSA-N 2 0 338.495 4.450 20 0 EIADRP CCc1ccccc1[C@H](N)C[NH2+][C@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000580302503 1021830254 /nfs/dbraw/zinc/83/02/54/1021830254.db2.gz WXTRPZISMMDWRZ-SVFBPWRDSA-N 2 0 337.511 4.268 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]CCn1ccnc1 ZINC000155688436 1021877792 /nfs/dbraw/zinc/87/77/92/1021877792.db2.gz JQHUSTAXBSWFKZ-GFCCVEGCSA-N 2 0 346.887 4.319 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc2c[nH+]cn2c1)c1ccc(OC(F)F)cc1 ZINC000414144657 1021955805 /nfs/dbraw/zinc/95/58/05/1021955805.db2.gz AATVJFYJUBDGQM-KRWDZBQOSA-N 2 0 331.366 4.177 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3cc4ccccc4[nH]3)CC2)CC1 ZINC000683928508 1021993933 /nfs/dbraw/zinc/99/39/33/1021993933.db2.gz QIZQDYLZTRPHCI-UHFFFAOYSA-N 2 0 325.500 4.301 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccccc1F ZINC000171126613 1022077690 /nfs/dbraw/zinc/07/76/90/1022077690.db2.gz ZFMRGNWIDRRSGC-MRXNPFEDSA-N 2 0 330.447 4.007 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@@H]2Cc4ccccc42)C3)cc1 ZINC000245731161 1033031779 /nfs/dbraw/zinc/03/17/79/1033031779.db2.gz QFHAFYNRQRYZEP-KJJMTIBFSA-N 2 0 332.491 4.112 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1cncc(F)c1 ZINC000155772844 1022161703 /nfs/dbraw/zinc/16/17/03/1022161703.db2.gz NQYXKBRCQLZBMB-IRXDYDNUSA-N 2 0 341.474 4.303 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@H]2Cc4ccccc42)C3)cc1 ZINC000245731167 1033033054 /nfs/dbraw/zinc/03/30/54/1033033054.db2.gz QFHAFYNRQRYZEP-YSFYHYPLSA-N 2 0 332.491 4.112 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(F)cc2Cl)CC1 ZINC000613491887 1022166217 /nfs/dbraw/zinc/16/62/17/1022166217.db2.gz CQBKXPZIIPLBLL-UHFFFAOYSA-N 2 0 326.887 4.423 20 0 EIADRP C[C@@H](C[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1)CC(F)(F)F ZINC000414264532 1022341106 /nfs/dbraw/zinc/34/11/06/1022341106.db2.gz KOEMPTAFJPUMJV-HZPDHXFCSA-N 2 0 342.449 4.260 20 0 EIADRP Cc1cn2c(n1)[C@@H](C[NH2+][C@H](Cc1ccc(F)cc1)C(C)C)CCC2 ZINC000378182857 1022475852 /nfs/dbraw/zinc/47/58/52/1022475852.db2.gz JUCKMVAGUSUSSS-IEBWSBKVSA-N 2 0 329.463 4.065 20 0 EIADRP COc1cccc([C@@H](C)[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000310858208 1022522972 /nfs/dbraw/zinc/52/29/72/1022522972.db2.gz BYMOXHZFKZYYNU-XMSQKQJNSA-N 2 0 338.495 4.258 20 0 EIADRP COc1cccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000310891193 1022680439 /nfs/dbraw/zinc/68/04/39/1022680439.db2.gz KPYVCGHXNWWOMP-AZUAARDMSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[N@H+](C)CCC[NH3+] ZINC000317109977 1022790720 /nfs/dbraw/zinc/79/07/20/1022790720.db2.gz CVWPZRVLZFVCNC-SECBINFHSA-N 2 0 328.300 4.066 20 0 EIADRP Cc1cccc([C@@H](C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC000581034496 1022807310 /nfs/dbraw/zinc/80/73/10/1022807310.db2.gz YSKGFGLKQDZHBE-LJQANCHMSA-N 2 0 338.495 4.320 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cnn(-c3ccccc3)c2)c1 ZINC000065976563 1022873205 /nfs/dbraw/zinc/87/32/05/1022873205.db2.gz SHQNLVQFICJMAZ-UHFFFAOYSA-N 2 0 348.494 4.002 20 0 EIADRP C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548154387 1022873630 /nfs/dbraw/zinc/87/36/30/1022873630.db2.gz NZNDNIVPHMBIEU-MTNREXPMSA-N 2 0 335.495 4.033 20 0 EIADRP Cc1nc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+](C)[C@@H]4CCC[C@H]43)cc2)cs1 ZINC000581326324 1023025429 /nfs/dbraw/zinc/02/54/29/1023025429.db2.gz TWKUHOPVVGUNGE-NLWGTHIKSA-N 2 0 341.524 4.081 20 0 EIADRP C[C@@]1(C[NH2+]Cc2ccc3ncccc3c2)CC[N@H+](Cc2ccccc2)C1 ZINC000311410434 1023157910 /nfs/dbraw/zinc/15/79/10/1023157910.db2.gz BUIIHIBKCVSXQC-QHCPKHFHSA-N 2 0 345.490 4.237 20 0 EIADRP COc1ccc([C@H]([NH2+]CCC2CC[NH+](C)CC2)c2ccccc2)cc1 ZINC000180455649 1023227936 /nfs/dbraw/zinc/22/79/36/1023227936.db2.gz BPYSZUKQFNVMMO-JOCHJYFZSA-N 2 0 338.495 4.106 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417347039 1023273937 /nfs/dbraw/zinc/27/39/37/1023273937.db2.gz VOFFRVCFZYDUPB-BGJMDTOESA-N 2 0 332.557 4.483 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)CC1 ZINC000581504564 1023311290 /nfs/dbraw/zinc/31/12/90/1023311290.db2.gz WQORKGLGAPWWGK-FQEVSTJZSA-N 2 0 346.563 4.379 20 0 EIADRP CCSc1ccc([C@@H](C)[NH2+]CC2(SC)CC[NH+](C)CC2)cc1 ZINC000584811032 1023336912 /nfs/dbraw/zinc/33/69/12/1023336912.db2.gz YDESUNKNAJFDMC-OAHLLOKOSA-N 2 0 338.586 4.277 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1cc(Cl)cc2cccnc21)c1ccccc1 ZINC000415049900 1023408035 /nfs/dbraw/zinc/40/80/35/1023408035.db2.gz HWCMGJCTTHEOJE-IBGZPJMESA-N 2 0 339.870 4.458 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1cnc(-c2cccs2)s1)c1ccccc1 ZINC000415061127 1023413965 /nfs/dbraw/zinc/41/39/65/1023413965.db2.gz XZJUCAJXDAEWPR-INIZCTEOSA-N 2 0 343.521 4.441 20 0 EIADRP COc1ccc(CC[C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1 ZINC000415060631 1023414056 /nfs/dbraw/zinc/41/40/56/1023414056.db2.gz XCYZFLSCWBVMSK-DYESRHJHSA-N 2 0 326.484 4.086 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H](c2ccc(Br)cc2)C2CCC2)CC1 ZINC000415077013 1023423391 /nfs/dbraw/zinc/42/33/91/1023423391.db2.gz DLUJAFDQRYTGKZ-OFLPRAFFSA-N 2 0 337.305 4.150 20 0 EIADRP C[C@H](C[C@@H]1CCC[NH2+]1)[NH2+]Cc1ccccc1COCc1ccccc1 ZINC000415076804 1023423443 /nfs/dbraw/zinc/42/34/43/1023423443.db2.gz GQXOJWLFUVRHGI-GCJKJVERSA-N 2 0 338.495 4.024 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000415086559 1023434610 /nfs/dbraw/zinc/43/46/10/1023434610.db2.gz UTFYGRVNUUIHTN-WMLDXEAASA-N 2 0 329.513 4.220 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CC1CC[NH2+]CC1 ZINC000415086839 1023437306 /nfs/dbraw/zinc/43/73/06/1023437306.db2.gz VBADBVFRVAZHBN-CQSZACIVSA-N 2 0 329.513 4.077 20 0 EIADRP CC[NH+](CC)C[C@@H]1CC[N@H+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500077004 1023484858 /nfs/dbraw/zinc/48/48/58/1023484858.db2.gz VVPQDPXBAIKMFR-HOTGVXAUSA-N 2 0 342.449 4.473 20 0 EIADRP CCC[N@H+](C)C[C@@H]1CC[NH+](C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500125067 1023513554 /nfs/dbraw/zinc/51/35/54/1023513554.db2.gz OZSFSCZNMILEBA-HOTGVXAUSA-N 2 0 342.449 4.473 20 0 EIADRP CCC[N@H+](C)C[C@H]1CC[NH+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000500125068 1023514934 /nfs/dbraw/zinc/51/49/34/1023514934.db2.gz OZSFSCZNMILEBA-HZPDHXFCSA-N 2 0 342.449 4.473 20 0 EIADRP [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCC[N@@H+]2Cc2cccc(C3CCCC3)c2)C1 ZINC000656785851 1023529438 /nfs/dbraw/zinc/52/94/38/1023529438.db2.gz KEENGOPTWCDCCA-YPAWHYETSA-N 2 0 342.527 4.205 20 0 EIADRP Clc1ccc2cccnc2c1C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000656784135 1023530001 /nfs/dbraw/zinc/53/00/01/1023530001.db2.gz YWPQMKMRWWNJGL-QGZVFWFLSA-N 2 0 343.902 4.100 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000311123372 1023577410 /nfs/dbraw/zinc/57/74/10/1023577410.db2.gz HPZJHEKDDHEXNG-GCJKJVERSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2[nH]ccc2c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311138182 1023584033 /nfs/dbraw/zinc/58/40/33/1023584033.db2.gz YESBTBOHVFOTRS-UWJYYQICSA-N 2 0 333.479 4.168 20 0 EIADRP COc1ccsc1[C@H](C)[NH2+]C[C@H]1CC[N@H+](C)[C@H]1c1ccccc1 ZINC000364312264 1023604634 /nfs/dbraw/zinc/60/46/34/1023604634.db2.gz BTBQEGLLVHVWBE-LESCRADOSA-N 2 0 330.497 4.100 20 0 EIADRP Cc1ccn(C2CC[NH+]([C@H](C)c3ccc(-n4ccnc4C)cc3)CC2)n1 ZINC000377632328 1023644404 /nfs/dbraw/zinc/64/44/04/1023644404.db2.gz UPOBDHMEFCGDAR-QGZVFWFLSA-N 2 0 349.482 4.084 20 0 EIADRP CC(C)=CCC[C@H](C)CC[NH+]1CCN(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)CC1 ZINC000377705696 1023699488 /nfs/dbraw/zinc/69/94/88/1023699488.db2.gz XUIFIVFLNYDGDL-CCDCCJRHSA-N 2 0 347.591 4.002 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccc(F)cc1Br ZINC000020049182 1023714667 /nfs/dbraw/zinc/71/46/67/1023714667.db2.gz OWOUXUCDPOMWGB-CYBMUJFWSA-N 2 0 345.300 4.188 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H](CC)c2ccc(Br)cc2)CC1 ZINC000020189831 1023746201 /nfs/dbraw/zinc/74/62/01/1023746201.db2.gz BKHOJJCLNJZXLR-QGZVFWFLSA-N 2 0 339.321 4.364 20 0 EIADRP CSc1ccc([C@H](C)[NH2+]Cc2cn(-c3cc[nH+]cc3)nc2C)cc1 ZINC000341479655 1023810761 /nfs/dbraw/zinc/81/07/61/1023810761.db2.gz GMSWNJCDZVSSNU-AWEZNQCLSA-N 2 0 338.480 4.148 20 0 EIADRP C[C@@H](CCCC(F)(F)F)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000390744203 1023819993 /nfs/dbraw/zinc/81/99/93/1023819993.db2.gz OMYRZDVLVWTWEV-DOTOQJQBSA-N 2 0 328.422 4.219 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(Cn2ccnc2)cc1)[C@@H]1C[C@H]1c1ccccc1 ZINC000549523869 1024118844 /nfs/dbraw/zinc/11/88/44/1024118844.db2.gz YWZWGBUXEDMORZ-WTNAPCKOSA-N 2 0 331.463 4.213 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CC[C@H]3C3CCC3)CC2)cc1 ZINC000510666491 1024200399 /nfs/dbraw/zinc/20/03/99/1024200399.db2.gz PEXHESCOEGRYRZ-VXKWHMMOSA-N 2 0 342.527 4.076 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cc3c(ccc(C)c3C)[nH]2)CC1 ZINC000473136677 1024367897 /nfs/dbraw/zinc/36/78/97/1024367897.db2.gz CQNJQGKLOWUKHF-UHFFFAOYSA-N 2 0 327.516 4.339 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc3ccsc32)[C@@H](C)C1 ZINC000652219680 1024390481 /nfs/dbraw/zinc/39/04/81/1024390481.db2.gz IJVSXDVMIVFHGP-LPHOPBHVSA-N 2 0 346.540 4.128 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc3ccsc32)[C@@H](C)C1 ZINC000652219681 1024391478 /nfs/dbraw/zinc/39/14/78/1024391478.db2.gz IJVSXDVMIVFHGP-QFBILLFUSA-N 2 0 346.540 4.128 20 0 EIADRP COc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cc1OC ZINC000090586758 1024446365 /nfs/dbraw/zinc/44/63/65/1024446365.db2.gz JFAXXFWUQAMPBR-ROUUACIJSA-N 2 0 348.531 4.031 20 0 EIADRP C[C@H]([NH2+]C/C=C/c1ccc(F)c(F)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000511909682 1024743788 /nfs/dbraw/zinc/74/37/88/1024743788.db2.gz FRJMJEVRSDFNCZ-VFYPNZCPSA-N 2 0 334.454 4.221 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2ccc(-c3ccncc3)cc2F)CC1 ZINC000092380951 1024800244 /nfs/dbraw/zinc/80/02/44/1024800244.db2.gz PZDZRADQYNSHEO-UHFFFAOYSA-N 2 0 341.474 4.051 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccccc2OC(F)(F)F)CC1 ZINC000535811514 1024957992 /nfs/dbraw/zinc/95/79/92/1024957992.db2.gz WIKSDDCPHKLECI-UHFFFAOYSA-N 2 0 344.421 4.137 20 0 EIADRP C[C@@H](c1ccc(OC(F)F)cc1)[NH+]1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000662294960 1025044270 /nfs/dbraw/zinc/04/42/70/1025044270.db2.gz XKNDRCZHXSRYSK-YOEHRIQHSA-N 2 0 338.442 4.061 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ncc(-c3cccc(Cl)c3)o2)[C@@H]1CCC[NH3+] ZINC000662312464 1025066837 /nfs/dbraw/zinc/06/68/37/1025066837.db2.gz GOZNJHGRYUAXHH-RHSMWYFYSA-N 2 0 347.890 4.334 20 0 EIADRP Cc1cc([C@H](C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c(C)o1 ZINC000067506495 1025232321 /nfs/dbraw/zinc/23/23/21/1025232321.db2.gz LZTHQDWOTXYDCZ-KRWDZBQOSA-N 2 0 342.483 4.222 20 0 EIADRP COCCC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1ccc(F)cc1 ZINC000663465244 1025389043 /nfs/dbraw/zinc/38/90/43/1025389043.db2.gz IUTILJYPQAACOD-GHTZIAJQSA-N 2 0 348.506 4.005 20 0 EIADRP CCCCc1ccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)cc1 ZINC000537959590 1025453921 /nfs/dbraw/zinc/45/39/21/1025453921.db2.gz MZKKXUYPYUABST-MTNREXPMSA-N 2 0 344.543 4.058 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)CC(F)(F)F)c1ccc(OCC[NH+](C)C)cc1 ZINC000663479158 1025453919 /nfs/dbraw/zinc/45/39/19/1025453919.db2.gz OATHVOMKRCPPSJ-AWEZNQCLSA-N 2 0 346.437 4.256 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]CC(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000415007666 1025528794 /nfs/dbraw/zinc/52/87/94/1025528794.db2.gz BPNJSSXIYXGOID-OAHLLOKOSA-N 2 0 332.438 4.204 20 0 EIADRP Cc1ccc2cc(C[NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)[nH]c2c1 ZINC000657296232 1025744763 /nfs/dbraw/zinc/74/47/63/1025744763.db2.gz DBXJWBQKCVRDPV-UHFFFAOYSA-N 2 0 333.479 4.362 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCSC[C@@H]1c1ccc(F)cc1 ZINC001167833330 1025788495 /nfs/dbraw/zinc/78/84/95/1025788495.db2.gz AFRDRCNGTCXCIM-VQIMIIECSA-N 2 0 338.536 4.426 20 0 EIADRP CC[C@@H]1C[C@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)CO1 ZINC000657304316 1025837813 /nfs/dbraw/zinc/83/78/13/1025837813.db2.gz YKRJZRDOGBWOPC-LEWJYISDSA-N 2 0 338.495 4.072 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](CC)[C@@H]1CCN(Cc2ccccc2)C1 ZINC001167838966 1025851331 /nfs/dbraw/zinc/85/13/31/1025851331.db2.gz XGONZEJYRFVWEM-RBBKRZOGSA-N 2 0 345.575 4.093 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@H](c2cccc(OC)c2)C1 ZINC001167839554 1025854157 /nfs/dbraw/zinc/85/41/57/1025854157.db2.gz ABJCKCYVLTVXBF-ICSRJNTNSA-N 2 0 332.532 4.385 20 0 EIADRP COc1ccc(CC[C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1 ZINC000415060634 1025862384 /nfs/dbraw/zinc/86/23/84/1025862384.db2.gz XCYZFLSCWBVMSK-UTKZUKDTSA-N 2 0 326.484 4.086 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]CCC2CC[NH+](C)CC2)sc1Br ZINC000512071972 1025881743 /nfs/dbraw/zinc/88/17/43/1025881743.db2.gz MIEAKUOBNIIOIT-GFCCVEGCSA-N 2 0 345.350 4.202 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1cncc(F)c1 ZINC000164023958 1025883341 /nfs/dbraw/zinc/88/33/41/1025883341.db2.gz HWWDBPKGHVTVLE-MRXNPFEDSA-N 2 0 327.447 4.057 20 0 EIADRP CCC[C@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccsc1 ZINC000187737330 1025889877 /nfs/dbraw/zinc/88/98/77/1025889877.db2.gz VQXBWMPESUJNQN-IBGZPJMESA-N 2 0 349.588 4.129 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cccc(F)c1 ZINC000187789299 1025902328 /nfs/dbraw/zinc/90/23/28/1025902328.db2.gz UXDYDHMUIKZVNW-HXUWFJFHSA-N 2 0 330.447 4.007 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cccc(F)c1 ZINC000187789566 1025903375 /nfs/dbraw/zinc/90/33/75/1025903375.db2.gz WGTSPSBRRWYMMG-HXUWFJFHSA-N 2 0 330.447 4.007 20 0 EIADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@@H+]1C)c1ccc(Oc2cccnc2)cc1 ZINC000344090898 1025999812 /nfs/dbraw/zinc/99/98/12/1025999812.db2.gz JPIJOTDWBMGIDZ-AEFFLSMTSA-N 2 0 325.456 4.009 20 0 EIADRP C[C@H]([NH2+]CCCN1CCCO[C@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000432447186 1026027139 /nfs/dbraw/zinc/02/71/39/1026027139.db2.gz OKURUDITGZEMKQ-KGLIPLIRSA-N 2 0 345.314 4.145 20 0 EIADRP C[N@@H+]1CCC[C@H](CNc2[nH+]ccc3[nH]ccc32)[C@@H]1c1cccs1 ZINC000663660327 1026062973 /nfs/dbraw/zinc/06/29/73/1026062973.db2.gz MBTLFTLPVWLIHX-CXAGYDPISA-N 2 0 326.469 4.119 20 0 EIADRP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)c1ccc(OC)cc1 ZINC001167971586 1026090163 /nfs/dbraw/zinc/09/01/63/1026090163.db2.gz ZRDQXSVQITYATR-SMLSOGCJSA-N 2 0 328.500 4.141 20 0 EIADRP Fc1ccc2c(c1)CCC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167975121 1026222830 /nfs/dbraw/zinc/22/28/30/1026222830.db2.gz HWAZKHWRQNKKDQ-SMLSOGCJSA-N 2 0 328.475 4.198 20 0 EIADRP C[NH+](C)CC1CC[NH+](Cc2ccc(-c3ccc(F)cc3)s2)CC1 ZINC000506850952 1026268065 /nfs/dbraw/zinc/26/80/65/1026268065.db2.gz KBLLUIINFABUSO-UHFFFAOYSA-N 2 0 332.488 4.328 20 0 EIADRP c1sc(-c2ccccc2)nc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000550262274 1026441817 /nfs/dbraw/zinc/44/18/17/1026441817.db2.gz BVRACKHMBKCYGO-UHFFFAOYSA-N 2 0 329.513 4.166 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(OCC)c(OC)c2)CC1 ZINC000506896618 1026508975 /nfs/dbraw/zinc/50/89/75/1026508975.db2.gz NQEYLRFGJCNWQE-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP CCCCCOc1cc(C[NH+]2CCC(C[NH+](C)C)CC2)ccc1OC ZINC000506933832 1026537370 /nfs/dbraw/zinc/53/73/70/1026537370.db2.gz XJJJVNWBJUYOSB-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@H]2CCc4ccccc42)C3)cc1 ZINC000499153707 1026608582 /nfs/dbraw/zinc/60/85/82/1026608582.db2.gz SLOXRDWBNPNOJL-QXUYBEEESA-N 2 0 332.491 4.459 20 0 EIADRP Cc1cccc2[nH]c(C[NH2+][C@@H](C)[C@H]3CCC[N@@H+](C4CCC4)C3)cc21 ZINC000657428872 1026628960 /nfs/dbraw/zinc/62/89/60/1026628960.db2.gz CQLSRBFZCNQMFZ-IRXDYDNUSA-N 2 0 325.500 4.219 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+]CC(Cc2ccccc2)Cc2ccccc2)C1 ZINC000582457711 1026666409 /nfs/dbraw/zinc/66/64/09/1026666409.db2.gz BHZWWKYVCGKOFB-JOCHJYFZSA-N 2 0 336.523 4.019 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000560249292 1026821844 /nfs/dbraw/zinc/82/18/44/1026821844.db2.gz HQXGPUOZLSQWFP-GMQQQROESA-N 2 0 344.543 4.431 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)[C@@H]1CCCOC1 ZINC000507513043 1026822396 /nfs/dbraw/zinc/82/23/96/1026822396.db2.gz QNKHQFOOXBDKMS-LMVRJCEZSA-N 2 0 344.543 4.069 20 0 EIADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccc(Oc2ccc(F)cc2)nc1 ZINC000657482506 1026840826 /nfs/dbraw/zinc/84/08/26/1026840826.db2.gz YJWFTXNHDSSBOK-UHFFFAOYSA-N 2 0 345.462 4.223 20 0 EIADRP CC1CC[NH+](Cc2ccc(C[NH2+][C@H]3CCCc4cccnc43)cc2)CC1 ZINC000684954056 1026888757 /nfs/dbraw/zinc/88/87/57/1026888757.db2.gz OWRILNHQHCONCI-QFIPXVFZSA-N 2 0 349.522 4.481 20 0 EIADRP Cc1ccccc1SC[C@@H](C)C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC001167599044 1026943354 /nfs/dbraw/zinc/94/33/54/1026943354.db2.gz NWSPWVTUTKYFDW-FXAWDEMLSA-N 2 0 346.584 4.387 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC([C@@H]2CC[NH2+]C2)CC1 ZINC000582726341 1027016071 /nfs/dbraw/zinc/01/60/71/1027016071.db2.gz XRZUSKMUBSEXMU-CZUORRHYSA-N 2 0 326.406 4.088 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000582726340 1027016838 /nfs/dbraw/zinc/01/68/38/1027016838.db2.gz XRZUSKMUBSEXMU-CJNGLKHVSA-N 2 0 326.406 4.088 20 0 EIADRP CC(C)[NH+]1CCC([NH2+]CCCCc2cccc(C(F)(F)F)c2)CC1 ZINC000474472357 1027099840 /nfs/dbraw/zinc/09/98/40/1027099840.db2.gz NWDPATMNOOPEKV-UHFFFAOYSA-N 2 0 342.449 4.491 20 0 EIADRP CS[C@@H]1CCCC[NH+]([C@H](C)CC[N@H+]2CCCC[C@@H](SC)C2)C1 ZINC000441107027 1027302553 /nfs/dbraw/zinc/30/25/53/1027302553.db2.gz WNMUZKYXZQAXDA-KZNAEPCWSA-N 2 0 344.634 4.200 20 0 EIADRP C[C@H]1CC([NH2+]C2(c3ccc(N)cc3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168038994 1027315945 /nfs/dbraw/zinc/31/59/45/1027315945.db2.gz ASHSFRIRTNOHRH-ROUUACIJSA-N 2 0 349.522 4.289 20 0 EIADRP Cc1ccc(-c2nc(C[NH2+]CCCCC[NH+]3CCCC3)cs2)cc1 ZINC000520259150 1027355857 /nfs/dbraw/zinc/35/58/57/1027355857.db2.gz WJMCOOJNKHAQGS-UHFFFAOYSA-N 2 0 343.540 4.474 20 0 EIADRP C[C@@H]1CC([N@@H+]2CCC(F)(F)[C@@H](C)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168041209 1027432694 /nfs/dbraw/zinc/43/26/94/1027432694.db2.gz QZIAUKFOONSEBV-GVDBMIGSSA-N 2 0 336.470 4.405 20 0 EIADRP CCOC[C@@H]1CCC[C@H]1[NH2+]C1CCN([C@H](C)c2ccccc2)CC1 ZINC000474724648 1027441600 /nfs/dbraw/zinc/44/16/00/1027441600.db2.gz CLKJQMIZHQUYAM-SLYNCCJLSA-N 2 0 330.516 4.007 20 0 EIADRP CCOC[C@@H]1CCC[C@@H]1[NH2+]C1CCN([C@@H](C)c2ccccc2)CC1 ZINC000474724645 1027441850 /nfs/dbraw/zinc/44/18/50/1027441850.db2.gz CLKJQMIZHQUYAM-CUWPLCDZSA-N 2 0 330.516 4.007 20 0 EIADRP CCOC[C@@H]1CCC[C@@H]1[NH2+]C1CCN([C@H](C)c2ccccc2)CC1 ZINC000474724647 1027442342 /nfs/dbraw/zinc/44/23/42/1027442342.db2.gz CLKJQMIZHQUYAM-LMNJBCLMSA-N 2 0 330.516 4.007 20 0 EIADRP CCO[P@](C)(=O)CC[C@@H](C)[NH2+]C1CCC(C)([NH+]2CCCC2)CC1 ZINC000896387993 1027447467 /nfs/dbraw/zinc/44/74/67/1027447467.db2.gz PFPJYOXPWZBTQZ-OSPVRFOGSA-N 2 0 344.480 4.096 20 0 EIADRP Cn1cc(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)c2ccccc21 ZINC000657661695 1027458939 /nfs/dbraw/zinc/45/89/39/1027458939.db2.gz ITAZMWGFKYSNLI-UHFFFAOYSA-N 2 0 339.527 4.108 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]2)C1 ZINC000320915252 1027563030 /nfs/dbraw/zinc/56/30/30/1027563030.db2.gz DOOGLPPWFUVPDY-FRFSOERESA-N 2 0 326.406 4.230 20 0 EIADRP COc1cccc([C@@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)c1 ZINC001167995087 1027739105 /nfs/dbraw/zinc/73/91/05/1027739105.db2.gz VOKSIDVKSHPBSP-CZJMCEMMSA-N 2 0 340.511 4.238 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000582952355 1027753184 /nfs/dbraw/zinc/75/31/84/1027753184.db2.gz WFOMHDCJYMNBRT-IUODEOHRSA-N 2 0 335.904 4.071 20 0 EIADRP c1cncc([C@@H]2CCCC[NH+]2C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167995325 1027767856 /nfs/dbraw/zinc/76/78/56/1027767856.db2.gz ARBDEPPVANFRDH-JKWVGCSGSA-N 2 0 325.500 4.014 20 0 EIADRP Cc1ccc2c(c1)c1c(n2C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC[NH2+]C1 ZINC001167995764 1027801487 /nfs/dbraw/zinc/80/14/87/1027801487.db2.gz PYGHMNQAOZCMDY-DFNIBXOVSA-N 2 0 349.522 4.173 20 0 EIADRP C[N@H+](CCc1cccc(Cl)c1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167995739 1027808553 /nfs/dbraw/zinc/80/85/53/1027808553.db2.gz PHKCILUYTBYYDR-YOFSQIOKSA-N 2 0 332.919 4.220 20 0 EIADRP C[C@H]([NH2+][C@@H](C)C1CCSCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000474942045 1027809231 /nfs/dbraw/zinc/80/92/31/1027809231.db2.gz KKSJKFHPEWBXPL-ZWOKBUDYSA-N 2 0 332.557 4.018 20 0 EIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@H](C)CCc2cccc(C(F)(F)F)c2)C1 ZINC000583052206 1027903458 /nfs/dbraw/zinc/90/34/58/1027903458.db2.gz XZOKBYUPMBPEDD-NVXWUHKLSA-N 2 0 342.449 4.346 20 0 EIADRP C[C@H](C[NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1cc(F)cc(F)c1 ZINC000648068311 1027954809 /nfs/dbraw/zinc/95/48/09/1027954809.db2.gz QAONFGZFXCFFHL-FPDPHYFHSA-N 2 0 344.449 4.003 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)cc1Cl ZINC000522546632 1028007776 /nfs/dbraw/zinc/00/77/76/1028007776.db2.gz XDWMPKPMAMJBFI-GUYCJALGSA-N 2 0 326.912 4.366 20 0 EIADRP CC(C)[NH+]1CCC([NH2+]CC2(c3ccc(C(F)(F)F)cc3)CC2)CC1 ZINC000188658659 1028016797 /nfs/dbraw/zinc/01/67/97/1028016797.db2.gz GMDJHDLULSPRPO-UHFFFAOYSA-N 2 0 340.433 4.199 20 0 EIADRP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000123612695 1028077884 /nfs/dbraw/zinc/07/78/84/1028077884.db2.gz YIILYVAUFVPYPE-AWEZNQCLSA-N 2 0 331.529 4.487 20 0 EIADRP Cc1ccc(OCCC[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)cc1C ZINC000523450341 1028125499 /nfs/dbraw/zinc/12/54/99/1028125499.db2.gz RTSWSMIGSDNZJH-FQEVSTJZSA-N 2 0 330.516 4.023 20 0 EIADRP CSCC1CCC([NH2+][C@H](C)c2ccc(-n3ccnc3)cc2)CC1 ZINC000395346295 1028170270 /nfs/dbraw/zinc/17/02/70/1028170270.db2.gz GRRWHIRWMSGJNY-KLHKWILBSA-N 2 0 329.513 4.445 20 0 EIADRP CC[C@@H](C)[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)Cc1ccccc1 ZINC000346152055 1028284757 /nfs/dbraw/zinc/28/47/57/1028284757.db2.gz OMOXVTFVFXUVPH-QGZVFWFLSA-N 2 0 334.467 4.376 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)[C@@H](c1ccccc1)C(C)C ZINC000346178417 1028309449 /nfs/dbraw/zinc/30/94/49/1028309449.db2.gz PRNARHNAGNXDDS-OAQYLSRUSA-N 2 0 334.467 4.405 20 0 EIADRP Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1cc(-n3ccnc3)cs1)CCC2 ZINC000346194455 1028318483 /nfs/dbraw/zinc/31/84/83/1028318483.db2.gz GSBJTGGPNOHMJZ-INIZCTEOSA-N 2 0 344.509 4.208 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@H]1/C=C\c1ccccc1 ZINC000346350244 1028385028 /nfs/dbraw/zinc/38/50/28/1028385028.db2.gz JTRFTWXYTDLOFE-VFCOFNOGSA-N 2 0 344.462 4.254 20 0 EIADRP FC(F)(F)c1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000261827616 1028418781 /nfs/dbraw/zinc/41/87/81/1028418781.db2.gz XHBUGBICBCMFCN-GVDBMIGSSA-N 2 0 326.406 4.106 20 0 EIADRP C[N@H+](CCCCOC(C)(C)C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000475048592 1028456852 /nfs/dbraw/zinc/45/68/52/1028456852.db2.gz IDKRSYOXVRRCRN-HXUWFJFHSA-N 2 0 332.532 4.036 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(O)CC2)cc1)C1CCCCCC1 ZINC000346567265 1028500905 /nfs/dbraw/zinc/50/09/05/1028500905.db2.gz SQMIWYFITJNTJL-GOSISDBHSA-N 2 0 344.543 4.092 20 0 EIADRP CC[NH+](CC)CCOC1CC[NH+]([C@@H](C)c2ccc3c(c2)CCC3)CC1 ZINC000445380555 1028501357 /nfs/dbraw/zinc/50/13/57/1028501357.db2.gz LIJQNHVRJWOKGH-SFHVURJKSA-N 2 0 344.543 4.059 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]C[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000583395822 1028656608 /nfs/dbraw/zinc/65/66/08/1028656608.db2.gz NZPPOTNBWWOBQX-DJZPMSPPSA-N 2 0 327.299 4.027 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCC12CCOCC2 ZINC000548794487 1028695311 /nfs/dbraw/zinc/69/53/11/1028695311.db2.gz HYECITHUGVEMOS-GHTZIAJQSA-N 2 0 342.527 4.110 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[NH2+]CC(C)(C)C1)[C@H](C)c1nc2ccccc2s1 ZINC000635009908 1028817682 /nfs/dbraw/zinc/81/76/82/1028817682.db2.gz IFQGDPFMGZPDMO-SOUVJXGZSA-N 2 0 331.529 4.156 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000650713038 1028862142 /nfs/dbraw/zinc/86/21/42/1028862142.db2.gz CEAHRGYAPRYJKS-HZPDHXFCSA-N 2 0 326.406 4.060 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccc(OCCC(C)C)cc1 ZINC000650718386 1028878149 /nfs/dbraw/zinc/87/81/49/1028878149.db2.gz JTFUZULFXKDQMC-UHFFFAOYSA-N 2 0 326.484 4.121 20 0 EIADRP C[C@H]([NH3+])C1CC[NH+](Cc2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000347185989 1028909153 /nfs/dbraw/zinc/90/91/53/1028909153.db2.gz ZIKFCARCHDNTAB-LBPRGKRZSA-N 2 0 335.904 4.023 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC1 ZINC000650745830 1029072808 /nfs/dbraw/zinc/07/28/08/1029072808.db2.gz OTHMKBWOOOUHCO-GOSISDBHSA-N 2 0 346.421 4.096 20 0 EIADRP C[C@@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc(OC(F)F)cc1 ZINC000522973584 1029139470 /nfs/dbraw/zinc/13/94/70/1029139470.db2.gz BRQKXHXEUKHIBU-CJNGLKHVSA-N 2 0 328.447 4.305 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CCSc2ccc(Cl)cc21 ZINC000650758447 1029212519 /nfs/dbraw/zinc/21/25/19/1029212519.db2.gz PWPNZJYQDYCNGE-QGZVFWFLSA-N 2 0 332.900 4.386 20 0 EIADRP c1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC2CC[NH2+]CC2)CCC3)cc1 ZINC000650764165 1029280051 /nfs/dbraw/zinc/28/00/51/1029280051.db2.gz RLBVWGBDZGCCMY-KRWDZBQOSA-N 2 0 341.524 4.167 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)CCS2 ZINC000343493595 1029357043 /nfs/dbraw/zinc/35/70/43/1029357043.db2.gz DCBDPCXJCHHLIS-QFBILLFUSA-N 2 0 348.556 4.476 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+]([C@@H](C)c2ncc(-c3ccccc3)o2)CC1 ZINC000524991500 1029386138 /nfs/dbraw/zinc/38/61/38/1029386138.db2.gz ZRVDTETYGCHDMI-KRWDZBQOSA-N 2 0 341.499 4.455 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000475191016 1029387484 /nfs/dbraw/zinc/38/74/84/1029387484.db2.gz ICPYSCVDVOEZAI-UHOFOFEASA-N 2 0 338.948 4.358 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)CCS2 ZINC000343507361 1029395364 /nfs/dbraw/zinc/39/53/64/1029395364.db2.gz OSBHINNBIIFORX-IBGZPJMESA-N 2 0 348.556 4.334 20 0 EIADRP CCOCC1CC[NH+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001168059681 1029440347 /nfs/dbraw/zinc/44/03/47/1029440347.db2.gz GHENJZRINXOISQ-RTBURBONSA-N 2 0 344.543 4.177 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@@H]3CCC[C@H]3c3ccccc3)C2)cc1 ZINC000475274037 1029479875 /nfs/dbraw/zinc/47/98/75/1029479875.db2.gz HKAOSXPXPKMLRO-AKIFATBCSA-N 2 0 334.507 4.434 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)cc1F ZINC000168502987 1029485593 /nfs/dbraw/zinc/48/55/93/1029485593.db2.gz RCRJDIVGLIYOLL-DLBZAZTESA-N 2 0 344.474 4.486 20 0 EIADRP CC(C)Cc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@H]3CCOC3)CC2)cc1 ZINC000132741355 1029506692 /nfs/dbraw/zinc/50/66/92/1029506692.db2.gz LTVVAWPAFCFBSP-UYAOXDASSA-N 2 0 344.543 4.037 20 0 EIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]CCCCOC(C)(C)C ZINC000475321683 1029516708 /nfs/dbraw/zinc/51/67/08/1029516708.db2.gz ZXGVUHSGOBYDSG-KXTWHKPSSA-N 2 0 346.559 4.328 20 0 EIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]CCCCOC(C)(C)C ZINC000475321688 1029519626 /nfs/dbraw/zinc/51/96/26/1029519626.db2.gz ZXGVUHSGOBYDSG-RTBURBONSA-N 2 0 346.559 4.328 20 0 EIADRP CC(C)COc1ccc(C(C)(C)C[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000166534760 1029533551 /nfs/dbraw/zinc/53/35/51/1029533551.db2.gz GKTMFPVRUSMESE-VQTJNVASSA-N 2 0 344.543 4.215 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cc2ccccc2s1 ZINC000446817219 1029580413 /nfs/dbraw/zinc/58/04/13/1029580413.db2.gz GYDWWPGMKKJUJB-BBWFWOEESA-N 2 0 346.540 4.441 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H](c2ccc(C)cc2)C2CCCC2)CC1 ZINC000446822070 1029588490 /nfs/dbraw/zinc/58/84/90/1029588490.db2.gz USDUXDNRBBXGGX-JOCHJYFZSA-N 2 0 344.543 4.317 20 0 EIADRP C[C@@H](CCc1ccc(Cl)s1)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446886957 1029631565 /nfs/dbraw/zinc/63/15/65/1029631565.db2.gz MFFIIZXEUQHLBZ-ZDUSSCGKSA-N 2 0 326.937 4.187 20 0 EIADRP Clc1ccccc1[C@@H]1CCC[C@H]1[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446885403 1029631703 /nfs/dbraw/zinc/63/17/03/1029631703.db2.gz WHEKTEKXEDMGHL-AZUAARDMSA-N 2 0 332.919 4.440 20 0 EIADRP Clc1ccccc1[C@H]1CCC[C@H]1[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446885406 1029632074 /nfs/dbraw/zinc/63/20/74/1029632074.db2.gz WHEKTEKXEDMGHL-UYAOXDASSA-N 2 0 332.919 4.440 20 0 EIADRP Fc1cccc(F)c1-c1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)o1 ZINC000446887142 1029632311 /nfs/dbraw/zinc/63/23/11/1029632311.db2.gz OMYUKGPRTIVEDB-UHFFFAOYSA-N 2 0 346.421 4.189 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657839224 1029739719 /nfs/dbraw/zinc/73/97/19/1029739719.db2.gz PLEIZMJYRLJVNW-OAGGEKHMSA-N 2 0 339.474 4.428 20 0 EIADRP Cc1cc(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)c(OC(F)F)cc1C ZINC000092073659 1029899117 /nfs/dbraw/zinc/89/91/17/1029899117.db2.gz WDZLPKXJLDKUBJ-CQSZACIVSA-N 2 0 335.398 4.008 20 0 EIADRP Cc1cc(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)cc(C)c1OC(F)F ZINC000092072040 1029900362 /nfs/dbraw/zinc/90/03/62/1029900362.db2.gz JKJSBAIZTOTIMU-OAHLLOKOSA-N 2 0 335.398 4.008 20 0 EIADRP Cc1ccccc1[C@@H](C)[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000171126542 1030062617 /nfs/dbraw/zinc/06/26/17/1030062617.db2.gz HADDMWYWZYGBQO-GOSISDBHSA-N 2 0 326.484 4.176 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)[C@H](C)C1 ZINC000525860284 1030083033 /nfs/dbraw/zinc/08/30/33/1030083033.db2.gz REHZEMRASDYTNT-NMIHRBCNSA-N 2 0 344.543 4.049 20 0 EIADRP FC1(F)CC[C@H](C[N@@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC000450981577 1030157168 /nfs/dbraw/zinc/15/71/68/1030157168.db2.gz IYLQQWYUBYFUKN-OALUTQOASA-N 2 0 334.454 4.020 20 0 EIADRP Clc1cccc2c1OCCC[C@@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447574760 1030162159 /nfs/dbraw/zinc/16/21/59/1030162159.db2.gz WPXMBVXIOCSOJZ-SFHVURJKSA-N 2 0 334.891 4.018 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cccc(OC(F)(F)F)c1 ZINC000447557017 1030168354 /nfs/dbraw/zinc/16/83/54/1030168354.db2.gz KFPYHLQHUHOUER-CYBMUJFWSA-N 2 0 342.405 4.110 20 0 EIADRP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447557116 1030169293 /nfs/dbraw/zinc/16/92/93/1030169293.db2.gz ISOMKJRCZLXZII-IBGZPJMESA-N 2 0 348.918 4.326 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CC2(c3c(Cl)cccc3Cl)CCC2)CC[N@@H+]1C ZINC000447563832 1030170912 /nfs/dbraw/zinc/17/09/12/1030170912.db2.gz FWOBGAWISJEGNH-KGLIPLIRSA-N 2 0 341.326 4.487 20 0 EIADRP CCOc1cccc2cc([C@@H](C)[NH2+]CC3CC[NH+](C4CC4)CC3)oc21 ZINC000447576886 1030203897 /nfs/dbraw/zinc/20/38/97/1030203897.db2.gz DCYDFMSANMXBAE-OAHLLOKOSA-N 2 0 342.483 4.357 20 0 EIADRP C[C@H](CC(F)(F)F)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447601973 1030218578 /nfs/dbraw/zinc/21/85/78/1030218578.db2.gz RBPKUHFFCRJILV-DZUCGIPZSA-N 2 0 326.406 4.113 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]C[C@@H]2CCCCS2)C3)cc1 ZINC000447601363 1030222820 /nfs/dbraw/zinc/22/28/20/1030222820.db2.gz PKMPQMPGHGZDEZ-HAGHYFMRSA-N 2 0 330.541 4.057 20 0 EIADRP Fc1ccc(Cl)cc1C[NH+]1CCC(CCCn2ccnc2)CC1 ZINC000526058205 1030255935 /nfs/dbraw/zinc/25/59/35/1030255935.db2.gz OUFZNHRJTSULIL-UHFFFAOYSA-N 2 0 335.854 4.368 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+]CC2=CC[N@H+](C)CC2)cc1OCCC ZINC000392288460 1030330021 /nfs/dbraw/zinc/33/00/21/1030330021.db2.gz LVVVXZRTGJHRKV-KRWDZBQOSA-N 2 0 346.515 4.177 20 0 EIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc2cnccc2c1 ZINC000685456448 1030335641 /nfs/dbraw/zinc/33/56/41/1030335641.db2.gz QTQMCPQZGBQKKF-UHFFFAOYSA-N 2 0 333.479 4.319 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H](C)c2ccc(C(F)F)nc2)CC1 ZINC000657901715 1030409793 /nfs/dbraw/zinc/40/97/93/1030409793.db2.gz SRDCICLPIBBUTD-OAHLLOKOSA-N 2 0 339.474 4.428 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ncc(C(C)(C)C)s2)C1 ZINC000447939242 1030430125 /nfs/dbraw/zinc/43/01/25/1030430125.db2.gz JMDYOHQHSGEEFU-HZPDHXFCSA-N 2 0 337.577 4.288 20 0 EIADRP CC[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)CCO1 ZINC000648423715 1030435029 /nfs/dbraw/zinc/43/50/29/1030435029.db2.gz WUALTKPMLVBRDW-JRGCBEDISA-N 2 0 330.516 4.108 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccnn2-c2ccccc2)c1 ZINC000447927428 1030443287 /nfs/dbraw/zinc/44/32/87/1030443287.db2.gz FFBNWHRCDDUVPZ-UHFFFAOYSA-N 2 0 348.494 4.004 20 0 EIADRP Cc1ccc2cc(C[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)ccc2n1 ZINC000527106302 1030484697 /nfs/dbraw/zinc/48/46/97/1030484697.db2.gz JJAQDEKFWIZZQV-UHFFFAOYSA-N 2 0 325.500 4.095 20 0 EIADRP COC1CCC(C)(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000530522687 1030497637 /nfs/dbraw/zinc/49/76/37/1030497637.db2.gz QCRUQZHTKDGISV-UREXAPBRSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@@H]([NH2+]CCc1cncn1C)c1ccc(SC2CCCC2)cc1 ZINC000530513344 1030504149 /nfs/dbraw/zinc/50/41/49/1030504149.db2.gz KTTQZBSUDMGVNK-OAHLLOKOSA-N 2 0 329.513 4.348 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CCN(Cc2cc(C(C)(C)C)on2)CC1 ZINC000685566890 1030521546 /nfs/dbraw/zinc/52/15/46/1030521546.db2.gz PGRVOJAJASBGJI-QGZVFWFLSA-N 2 0 347.547 4.449 20 0 EIADRP Cc1c([C@@H](C)NC2CC[NH+](C3CCCC3)CC2)cnn1C(C)(C)C ZINC000191328343 1030618809 /nfs/dbraw/zinc/61/88/09/1030618809.db2.gz ZZVPANPSRNECTO-OAHLLOKOSA-N 2 0 332.536 4.004 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000548851785 1030634577 /nfs/dbraw/zinc/63/45/77/1030634577.db2.gz FHCPGEDZZOCZAD-YVGNARHYSA-N 2 0 326.406 4.040 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc3ccncc3s2)C1 ZINC000657932153 1030636808 /nfs/dbraw/zinc/63/68/08/1030636808.db2.gz UQPQMHBWDDNADY-HZPDHXFCSA-N 2 0 331.529 4.315 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000398133003 1030713048 /nfs/dbraw/zinc/71/30/48/1030713048.db2.gz KDLIBUYHNUNNGB-DYESRHJHSA-N 2 0 333.479 4.168 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]Cc2ccc(Cl)cn2)cc1F ZINC000374856468 1030716612 /nfs/dbraw/zinc/71/66/12/1030716612.db2.gz LACVYLVEXUVGBX-GFCCVEGCSA-N 2 0 344.821 4.219 20 0 EIADRP C[C@@H](Oc1ccc([C@H](C)[NH2+]CCc2cncn2C)cc1)c1ccccc1 ZINC000657982953 1030742022 /nfs/dbraw/zinc/74/20/22/1030742022.db2.gz PCPDHLYGPYKHJB-ZWKOTPCHSA-N 2 0 349.478 4.453 20 0 EIADRP C[C@H](Cc1ccc(Cl)cc1)[NH+]1CCC(C2CC[NH+](C)CC2)CC1 ZINC001168181044 1030818853 /nfs/dbraw/zinc/81/88/53/1030818853.db2.gz WNNPRGYDQSQTGL-MRXNPFEDSA-N 2 0 334.935 4.325 20 0 EIADRP c1nc([C@@H]2CCC[N@@H+](Cc3ccnc4ccccc34)C2)n2c1CCCC2 ZINC000548859326 1030837023 /nfs/dbraw/zinc/83/70/23/1030837023.db2.gz ZJIIAKOYXPMNLV-GOSISDBHSA-N 2 0 346.478 4.147 20 0 EIADRP c1ccc([C@H](CC2CC2)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658163905 1030860542 /nfs/dbraw/zinc/86/05/42/1030860542.db2.gz BXVKXBCSUKPBIQ-QHCPKHFHSA-N 2 0 349.522 4.425 20 0 EIADRP Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658165407 1030862970 /nfs/dbraw/zinc/86/29/70/1030862970.db2.gz JJXMOPFVKZXLCA-AVRDEDQJSA-N 2 0 349.522 4.440 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2cc3cc(Cl)cnc3o2)C1 ZINC000648424300 1030865481 /nfs/dbraw/zinc/86/54/81/1030865481.db2.gz WZYBAPKHGCMZKI-AWEZNQCLSA-N 2 0 335.879 4.083 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC[C@@]2(C)CC2(F)F)CC1 ZINC000658220204 1030885719 /nfs/dbraw/zinc/88/57/19/1030885719.db2.gz KNETZZVOTAPNIG-APWZRJJASA-N 2 0 336.470 4.107 20 0 EIADRP C[C@]1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)CC1(F)F ZINC000658219633 1030885946 /nfs/dbraw/zinc/88/59/46/1030885946.db2.gz CJANBTSUOQPLGU-AKHDSKFASA-N 2 0 334.454 4.065 20 0 EIADRP C[C@@H]([NH2+]C(CCC(F)(F)F)CCC(F)(F)F)C1CC[NH+](C)CC1 ZINC000658252612 1030926083 /nfs/dbraw/zinc/92/60/83/1030926083.db2.gz FSMQWNWRQNDULQ-LLVKDONJSA-N 2 0 348.375 4.360 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)CC1 ZINC000122754487 1031011328 /nfs/dbraw/zinc/01/13/28/1031011328.db2.gz IRFNDYSZHMWNPA-LJQANCHMSA-N 2 0 328.500 4.145 20 0 EIADRP Cc1cccnc1[C@H]1CCC[C@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)C1 ZINC000658353735 1031022860 /nfs/dbraw/zinc/02/28/60/1031022860.db2.gz QRIHGLPMLKDTMJ-SFTDATJTSA-N 2 0 341.543 4.128 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)C1CCOCC1 ZINC000532454071 1031091517 /nfs/dbraw/zinc/09/15/17/1031091517.db2.gz LGTDYIHBCZLAKJ-QFIPXVFZSA-N 2 0 344.543 4.213 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](CC)CC1)c1ccc(Br)cc1 ZINC000044517272 1031113100 /nfs/dbraw/zinc/11/31/00/1031113100.db2.gz CVJFACUMDHNPKS-KRWDZBQOSA-N 2 0 339.321 4.222 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cccc(F)c1 ZINC000171126269 1031186392 /nfs/dbraw/zinc/18/63/92/1031186392.db2.gz FZMOERULCPUINJ-MRXNPFEDSA-N 2 0 330.447 4.007 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(C[NH+]2CCC(C)CC2)c1)C1CCOCC1 ZINC000532485241 1031216388 /nfs/dbraw/zinc/21/63/88/1031216388.db2.gz SSISJOGOKSNCJK-QFIPXVFZSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000532500225 1031238120 /nfs/dbraw/zinc/23/81/20/1031238120.db2.gz MTWAJEYWZKZGLJ-SPLOXXLWSA-N 2 0 344.449 4.440 20 0 EIADRP COc1cccc2c(C[N@@H+]3CC[C@@H](C[NH+](C)CC4CC4)C3)cccc12 ZINC000449035687 1031368245 /nfs/dbraw/zinc/36/82/45/1031368245.db2.gz HRDWMIDBRJOJSB-SFHVURJKSA-N 2 0 338.495 4.012 20 0 EIADRP COc1cc2ccccc2cc1C[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000449063071 1031393189 /nfs/dbraw/zinc/39/31/89/1031393189.db2.gz NMOFUNDLGVVBHU-UHFFFAOYSA-N 2 0 334.463 4.200 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@@H]3CCOC4(CCC4)C3)cc2)C1 ZINC000449074132 1031426936 /nfs/dbraw/zinc/42/69/36/1031426936.db2.gz BLRAZDRQHRYDEV-GHTZIAJQSA-N 2 0 342.527 4.110 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]C2CCC(OC3CCCC3)CC2)CC1 ZINC000449082071 1031438208 /nfs/dbraw/zinc/43/82/08/1031438208.db2.gz KFFASICHFWCBOS-UHFFFAOYSA-N 2 0 336.564 4.359 20 0 EIADRP CC[C@H]([NH2+]CC1(N[C@@H](C)c2ccccc2)CCOCC1)C1CCC1 ZINC000449155196 1031484253 /nfs/dbraw/zinc/48/42/53/1031484253.db2.gz KNYXFAHVINABJS-PXNSSMCTSA-N 2 0 330.516 4.055 20 0 EIADRP C[C@@H](NC1(C[NH2+][C@@H]2CCOC3(CCC3)C2)CCCC1)c1ccccc1 ZINC000449154733 1031484690 /nfs/dbraw/zinc/48/46/90/1031484690.db2.gz JJLDQHRMQUNESO-UYAOXDASSA-N 2 0 342.527 4.341 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](CN[C@H](C)c2sccc2Br)C1 ZINC000531702762 1031489059 /nfs/dbraw/zinc/48/90/59/1031489059.db2.gz WGUHFPFAIGUXIU-CHWSQXEVSA-N 2 0 345.350 4.282 20 0 EIADRP COc1cccc2c(C[NH2+]C3CC[NH+](C4CCCC4)CC3)cccc12 ZINC000449192447 1031511345 /nfs/dbraw/zinc/51/13/45/1031511345.db2.gz YHLGVMUWFREIIQ-UHFFFAOYSA-N 2 0 338.495 4.345 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21 ZINC000449217890 1031553390 /nfs/dbraw/zinc/55/33/90/1031553390.db2.gz COBKHGBOAJWTIG-IUODEOHRSA-N 2 0 328.422 4.191 20 0 EIADRP CSCCCCC[NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1 ZINC000449256217 1031572813 /nfs/dbraw/zinc/57/28/13/1031572813.db2.gz HZDHCBAEAMPQMG-GOSISDBHSA-N 2 0 334.573 4.205 20 0 EIADRP CC1(C)CC([NH2+]Cc2ccc(OC(F)F)c(Cl)c2)CC(C)(C)[NH2+]1 ZINC000236628989 1031577714 /nfs/dbraw/zinc/57/77/14/1031577714.db2.gz RJAVRMMEFNKPQI-UHFFFAOYSA-N 2 0 346.849 4.340 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CCO1 ZINC000449240902 1031579330 /nfs/dbraw/zinc/57/93/30/1031579330.db2.gz PSONSVGXWUTHOI-MSOLQXFVSA-N 2 0 338.580 4.460 20 0 EIADRP C[C@H](NCCC[N@@H+]1CCCC[C@@H]1C)c1ncc(-c2ccccc2)n1C ZINC000453093399 1031585310 /nfs/dbraw/zinc/58/53/10/1031585310.db2.gz RCJUIOYTVFWRDU-ROUUACIJSA-N 2 0 340.515 4.002 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CC2CC[NH+](C3CC3)CC2)CC1 ZINC000449285660 1031595394 /nfs/dbraw/zinc/59/53/94/1031595394.db2.gz FKPHVCBTKQFGGS-UHFFFAOYSA-N 3 0 349.607 4.130 20 0 EIADRP CC[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000453184467 1031687691 /nfs/dbraw/zinc/68/76/91/1031687691.db2.gz ZZHTURGNDMOUHT-VCOUNFBDSA-N 2 0 337.511 4.423 20 0 EIADRP C[C@H](CCCc1cccnc1)[NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000453193669 1031703532 /nfs/dbraw/zinc/70/35/32/1031703532.db2.gz GKZLQYYKLZPGLB-HBFSDRIKSA-N 2 0 329.532 4.035 20 0 EIADRP Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)ccc1F ZINC000453261493 1031784971 /nfs/dbraw/zinc/78/49/71/1031784971.db2.gz RTHJFZBCKPBHMT-IAGOWNOFSA-N 2 0 344.474 4.486 20 0 EIADRP CC(C)[C@@H]1C[C@H](C[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3C)CC2)CCO1 ZINC000449495660 1031803973 /nfs/dbraw/zinc/80/39/73/1031803973.db2.gz OVXXVEOFDORXDN-QCFAMHMHSA-N 2 0 336.564 4.070 20 0 EIADRP CC(C)Oc1ccc([C@H]2CCC[C@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000449560109 1031847993 /nfs/dbraw/zinc/84/79/93/1031847993.db2.gz GEUWPKXYXNJYOZ-QBCYDMNMSA-N 2 0 342.527 4.325 20 0 EIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]C1C[C@H]3CC[C@@H](C1)[N@H+]3C)CCCO2 ZINC000453335185 1031861141 /nfs/dbraw/zinc/86/11/41/1031861141.db2.gz DCPGHNOQYOZINF-AQDPXUSMSA-N 2 0 328.500 4.239 20 0 EIADRP C[C@H]([C@@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC[C@]2(CCSC2)C1 ZINC000453356546 1031885483 /nfs/dbraw/zinc/88/54/83/1031885483.db2.gz KWGXOJFLWIXNKH-NRSPTQNISA-N 2 0 344.568 4.116 20 0 EIADRP CN(C)Cc1cnc(C[NH2+]C[C@@H]2CCCC[C@@H]2c2ccccc2)s1 ZINC000449687745 1031940959 /nfs/dbraw/zinc/94/09/59/1031940959.db2.gz DKIZHJPMJYGJFC-PKOBYXMFSA-N 2 0 343.540 4.268 20 0 EIADRP Cc1cc([C@H]([NH2+]CCCC[N@@H+](C)C2CC2)c2cccnc2)ccc1F ZINC000453405919 1031942364 /nfs/dbraw/zinc/94/23/64/1031942364.db2.gz QVPWEBAUPKUTRR-NRFANRHFSA-N 2 0 341.474 4.083 20 0 EIADRP CN(C)Cc1cnc(C[NH2+]C[C@H]2CCCC[C@@H]2c2ccccc2)s1 ZINC000449687743 1031942309 /nfs/dbraw/zinc/94/23/09/1031942309.db2.gz DKIZHJPMJYGJFC-IEBWSBKVSA-N 2 0 343.540 4.268 20 0 EIADRP Cc1cc(Br)c(C[NH2+]C2CCC(C[NH+](C)C)CC2)s1 ZINC000453569707 1032008250 /nfs/dbraw/zinc/00/82/50/1032008250.db2.gz JJXQDGNYKMDPJC-UHFFFAOYSA-N 2 0 345.350 4.029 20 0 EIADRP Cc1cc(C[NH2+]CCCC[N@@H+](C)C2CC2)ccc1Oc1cccnc1 ZINC000453604263 1032038703 /nfs/dbraw/zinc/03/87/03/1032038703.db2.gz YNVBHHWVVKDNKM-UHFFFAOYSA-N 2 0 339.483 4.146 20 0 EIADRP FC1(F)CCC([NH2+][C@@H]2CCC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)CC1 ZINC000512632313 1033555493 /nfs/dbraw/zinc/55/54/93/1033555493.db2.gz YZSBOIQZBGAPKD-YSIASYRMSA-N 2 0 348.481 4.455 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)c1cccnc1 ZINC000246596557 1033585951 /nfs/dbraw/zinc/58/59/51/1033585951.db2.gz PTASLIRQFJRMOA-CEXWTWQISA-N 2 0 337.511 4.410 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(-c3ncco3)cc2F)CC1 ZINC000411425862 1033891528 /nfs/dbraw/zinc/89/15/28/1033891528.db2.gz MZDNXWODDUWIPA-UHFFFAOYSA-N 2 0 345.462 4.035 20 0 EIADRP Brc1cccc(C[NH2+]CCCCC[NH+]2CCCCC2)c1 ZINC000500890494 1033958593 /nfs/dbraw/zinc/95/85/93/1033958593.db2.gz MQXMJXQNFYYNFR-UHFFFAOYSA-N 2 0 339.321 4.195 20 0 EIADRP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC([C@H]2CCC[NH2+]2)CC1 ZINC000261722905 1034078363 /nfs/dbraw/zinc/07/83/63/1034078363.db2.gz LYXUBZKTVBOUGR-SUMWQHHRSA-N 2 0 326.406 4.230 20 0 EIADRP Cc1cc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc(C)c1O ZINC000397629402 1034462123 /nfs/dbraw/zinc/46/21/23/1034462123.db2.gz ZTKDAGIUCXTZHZ-UHFFFAOYSA-N 2 0 338.495 4.011 20 0 EIADRP Clc1ccc([C@H]2C[C@H]([NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@H]4C3)C2)cc1Cl ZINC000647796724 1034622466 /nfs/dbraw/zinc/62/24/66/1034622466.db2.gz LDSJANMPIDPYBL-OXGONZEZSA-N 2 0 339.310 4.217 20 0 EIADRP c1cc2cccc(C[N@H+]3CCC[C@@H](C[NH+]4CCCCCC4)C3)c2[nH]1 ZINC000513425171 1034926730 /nfs/dbraw/zinc/92/67/30/1034926730.db2.gz QNJNNRMDJGNJHA-SFHVURJKSA-N 2 0 325.500 4.256 20 0 EIADRP Cc1nc(C)c(C[NH2+]CC[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)s1 ZINC000513493696 1034985004 /nfs/dbraw/zinc/98/50/04/1034985004.db2.gz CDCMRPVIUGMDNV-BEFAXECRSA-N 2 0 343.540 4.150 20 0 EIADRP C[C@H](c1cc(F)ccc1F)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501017327 1035351284 /nfs/dbraw/zinc/35/12/84/1035351284.db2.gz AZRDQTGDYCVLSY-OAHLLOKOSA-N 2 0 345.437 4.269 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+]C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000501419517 1035442324 /nfs/dbraw/zinc/44/23/24/1035442324.db2.gz GZYHKHYRHXXEET-LTBFUDJGSA-N 2 0 326.406 4.040 20 0 EIADRP CC(C)n1c2ccccc2nc1[C@@H]1CCC[N@@H+]1CC[C@@H]1CCC[NH2+]C1 ZINC000420307241 1035504117 /nfs/dbraw/zinc/50/41/17/1035504117.db2.gz BILYTKVVPVAZCR-PXNSSMCTSA-N 2 0 340.515 4.144 20 0 EIADRP Cc1nc([C@@H](C)[N@@H+]2CCC[C@@H](CC[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420319107 1035512321 /nfs/dbraw/zinc/51/23/21/1035512321.db2.gz XDBOUXCEDPHRDM-CABCVRRESA-N 2 0 347.890 4.425 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]CC[C@H]1CC[NH2+]C1 ZINC000420418679 1035573567 /nfs/dbraw/zinc/57/35/67/1035573567.db2.gz XDYDWSLVNPCRNC-TZMCWYRMSA-N 2 0 349.931 4.422 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCc2ccc(F)cc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000485257799 1035801012 /nfs/dbraw/zinc/80/10/12/1035801012.db2.gz HADPKMFKABLZFO-XWFZLUIHSA-N 2 0 338.470 4.313 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C[C@@H]2CCCC(F)(F)C2)CC1 ZINC000502317416 1036073664 /nfs/dbraw/zinc/07/36/64/1036073664.db2.gz NCGMIHLFXBBAIJ-NUJGCVRESA-N 2 0 328.491 4.445 20 0 EIADRP CCOCC(C)(C)C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000571598267 1036090897 /nfs/dbraw/zinc/09/08/97/1036090897.db2.gz OJULJZOTECWFRS-UHFFFAOYSA-N 2 0 332.532 4.082 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@@H]3CCCC(F)(F)C3)CC2)C1 ZINC000502368811 1036143013 /nfs/dbraw/zinc/14/30/13/1036143013.db2.gz GNBRFZKDVXZTAP-NUJGCVRESA-N 2 0 328.491 4.445 20 0 EIADRP COc1ccc(-c2ccccc2)cc1C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000513746457 1036234226 /nfs/dbraw/zinc/23/42/26/1036234226.db2.gz XJIQAXJSSVDVQF-UHFFFAOYSA-N 2 0 338.495 4.136 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502729034 1036590338 /nfs/dbraw/zinc/59/03/38/1036590338.db2.gz VICITSWNRADEPX-ROUUACIJSA-N 2 0 332.536 4.161 20 0 EIADRP COc1ccc([C@H]([NH2+]Cc2cccc(C[NH+](C)C)c2)C2CC2)c(F)c1 ZINC000421821894 1036775413 /nfs/dbraw/zinc/77/54/13/1036775413.db2.gz UREKJIQFTXMYMO-OAQYLSRUSA-N 2 0 342.458 4.137 20 0 EIADRP Fc1ccc2c(c1)CC[C@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)C2 ZINC001168414387 1036827726 /nfs/dbraw/zinc/82/77/26/1036827726.db2.gz FRDSHCUIEMEDSJ-FQEVSTJZSA-N 2 0 330.491 4.070 20 0 EIADRP c1nc2cc(C[NH2+]Cc3cccc(C[NH+]4CCCCCC4)c3)ccc2[nH]1 ZINC000589647210 1036858655 /nfs/dbraw/zinc/85/86/55/1036858655.db2.gz NQCOYVPJMMWRIA-UHFFFAOYSA-N 2 0 348.494 4.229 20 0 EIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CC2CCC(F)(F)CC2)CC1 ZINC000503079223 1036894590 /nfs/dbraw/zinc/89/45/90/1036894590.db2.gz UXCGXKKSNLMOQA-MAUKXSAKSA-N 2 0 328.491 4.445 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]C/C=C/c3ccncc3)cc2)C1 ZINC000486943616 1036897715 /nfs/dbraw/zinc/89/77/15/1036897715.db2.gz OBKWRIRGHWCTDJ-KPUAHBEZSA-N 2 0 335.495 4.117 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2cccc3[nH]ccc32)CC1 ZINC000503121268 1036919670 /nfs/dbraw/zinc/91/96/70/1036919670.db2.gz NTWFWTFDXFEFGK-VGSWGCGISA-N 2 0 339.527 4.343 20 0 EIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3cccc4[nH]ccc43)CC2)C1 ZINC000503116683 1036930740 /nfs/dbraw/zinc/93/07/40/1036930740.db2.gz HLQZNHXIXHROAW-PXNSSMCTSA-N 2 0 339.527 4.343 20 0 EIADRP C[NH+](C)CCC1CC[NH+](CCCOc2ccc3ccccc3c2)CC1 ZINC000590126668 1036980715 /nfs/dbraw/zinc/98/07/15/1036980715.db2.gz VFZAGTALEOHUJP-UHFFFAOYSA-N 2 0 340.511 4.272 20 0 EIADRP C[C@@H]1CC2(C[N@@H+]1Cc1cccc(C[NH+]3CCCCC3)c1)CCOCC2 ZINC000646097542 1037069518 /nfs/dbraw/zinc/06/95/18/1037069518.db2.gz XLIXXUQNFBYVJU-LJQANCHMSA-N 2 0 342.527 4.064 20 0 EIADRP CC1CC[NH+](Cc2ccccc2CNC(=[NH2+])Nc2ccccc2)CC1 ZINC000057887221 1037290185 /nfs/dbraw/zinc/29/01/85/1037290185.db2.gz OBQVQSNFUBZMHH-UHFFFAOYSA-N 2 0 336.483 4.055 20 0 EIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(SC(F)(F)F)cc2)C1 ZINC000058061060 1037463212 /nfs/dbraw/zinc/46/32/12/1037463212.db2.gz XAYLOGREIHODJS-CQSZACIVSA-N 2 0 332.435 4.118 20 0 EIADRP Cc1csc([C@H](C)C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000273470303 1037473678 /nfs/dbraw/zinc/47/36/78/1037473678.db2.gz RXDDCUHYKATPNV-GJYPPUQNSA-N 2 0 343.540 4.055 20 0 EIADRP C[NH+](C)CC[C@@H]([NH2+]Cc1ccc(F)c(Br)c1)C(C)(C)C ZINC000604770691 1037511269 /nfs/dbraw/zinc/51/12/69/1037511269.db2.gz BCWFWHLFTYEJKJ-OAHLLOKOSA-N 2 0 345.300 4.044 20 0 EIADRP CC(C)([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1cccs1 ZINC000604893034 1037563941 /nfs/dbraw/zinc/56/39/41/1037563941.db2.gz ZURUGIRZGOPXLJ-UHFFFAOYSA-N 2 0 344.524 4.248 20 0 EIADRP CC(C)[C@H]1C[C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CS1 ZINC000488436639 1037592677 /nfs/dbraw/zinc/59/26/77/1037592677.db2.gz YAGQONXUJIIPBB-VCDOQTMRSA-N 2 0 344.568 4.302 20 0 EIADRP C[C@@H]1C[C@@H]1c1ccc(CNC[C@H]2CC[N@H+](CCc3ccccc3)C2)o1 ZINC000488513687 1037642971 /nfs/dbraw/zinc/64/29/71/1037642971.db2.gz LMQRTQDPUWGUKD-QFUCXCTJSA-N 2 0 338.495 4.057 20 0 EIADRP C[C@H](C[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(C(F)(F)F)cc1 ZINC000414654314 1037670509 /nfs/dbraw/zinc/67/05/09/1037670509.db2.gz ITXDZNKXGOJOFZ-AJSFGMTHSA-N 2 0 326.406 4.024 20 0 EIADRP CCC[N@H+](Cc1ccc(-c2ccccc2OC)cc1)C1CC[NH2+]CC1 ZINC000414659102 1037698952 /nfs/dbraw/zinc/69/89/52/1037698952.db2.gz RTSQSLBPGVFUMI-UHFFFAOYSA-N 2 0 338.495 4.326 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](CC(F)(F)F)c1ccccc1 ZINC000422705256 1037802398 /nfs/dbraw/zinc/80/23/98/1037802398.db2.gz BOICMLMFKGXFJN-CXAGYDPISA-N 2 0 337.389 4.193 20 0 EIADRP CC[C@H](C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1 ZINC000422718433 1037813561 /nfs/dbraw/zinc/81/35/61/1037813561.db2.gz PQZPWPJFTNGKOH-AGHHOFFYSA-N 2 0 336.479 4.026 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](c1ccc(F)cc1)C1CCC1 ZINC000422718236 1037814040 /nfs/dbraw/zinc/81/40/40/1037814040.db2.gz PMSBLRFWBQWYJS-VLIAUNLRSA-N 2 0 327.447 4.180 20 0 EIADRP CC[C@@H]1C[C@H](C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CCO1 ZINC000503572729 1037823227 /nfs/dbraw/zinc/82/32/27/1037823227.db2.gz HHKMJPMHYLVUCB-ZHHKINOHSA-N 2 0 344.543 4.082 20 0 EIADRP Cc1cccc([C@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1C ZINC000422747215 1037823851 /nfs/dbraw/zinc/82/38/51/1037823851.db2.gz PMTVXJZNPUUBNG-WEYGHZABSA-N 2 0 336.479 4.210 20 0 EIADRP Cc1c2ccccc2oc1C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422748890 1037825431 /nfs/dbraw/zinc/82/54/31/1037825431.db2.gz WQCLRHGHHZHJIG-PGRDOPGGSA-N 2 0 348.446 4.087 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1 ZINC000422800115 1037836480 /nfs/dbraw/zinc/83/64/80/1037836480.db2.gz AUMPSWPXEUKPHC-RYUDHWBXSA-N 2 0 337.389 4.279 20 0 EIADRP Cc1ccc([C@@H]2OCCC[C@@H]2C[NH2+][C@@H]2C[C@@H]([NH3+])c3ccccc32)cc1 ZINC000422804648 1037837321 /nfs/dbraw/zinc/83/73/21/1037837321.db2.gz HZLWWIINTYYVGC-CIQXWFTPSA-N 2 0 336.479 4.197 20 0 EIADRP C[C@@H]1C[C@@H](C[NH+]2CCC(c3nc4cc(Cl)ccc4o3)CC2)CC[NH2+]1 ZINC000414694038 1037838047 /nfs/dbraw/zinc/83/80/47/1037838047.db2.gz CRBSWYNSKVXEEU-KGLIPLIRSA-N 2 0 347.890 4.049 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000422863235 1037848844 /nfs/dbraw/zinc/84/88/44/1037848844.db2.gz RJVNQIDYGIVBLD-HOCLYGCPSA-N 2 0 329.513 4.295 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cccc(NC(=O)c2ccccc2)c1 ZINC000422866233 1037849048 /nfs/dbraw/zinc/84/90/48/1037849048.db2.gz PWSANVQUJRYODH-DLBZAZTESA-N 2 0 339.483 4.107 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC1CCC(c2ccccc2)CC1 ZINC000422892216 1037855777 /nfs/dbraw/zinc/85/57/77/1037855777.db2.gz XVAWHNSOQUENTJ-PPDQVPDSSA-N 2 0 337.511 4.473 20 0 EIADRP CC[C@@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422873365 1037861021 /nfs/dbraw/zinc/86/10/21/1037861021.db2.gz LDRJDSACROUMPI-HZPDHXFCSA-N 2 0 341.499 4.185 20 0 EIADRP Cc1cccc(C2(C[NH2+][C@H](C)c3ccc(C[NH3+])nc3C)CCCC2)c1 ZINC000422901761 1037862999 /nfs/dbraw/zinc/86/29/99/1037862999.db2.gz CDTFPPRMIMQZED-QGZVFWFLSA-N 2 0 337.511 4.320 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1ccccc1C(F)(F)F ZINC000422927720 1037870996 /nfs/dbraw/zinc/87/09/96/1037870996.db2.gz ZWVDKYXTLJJKSZ-YPMHNXCESA-N 2 0 337.389 4.279 20 0 EIADRP CC[C@H](C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C)Oc1cccc(Cl)c1 ZINC000422927381 1037871079 /nfs/dbraw/zinc/87/10/79/1037871079.db2.gz GKJPMZSJTQCCLK-CXAGYDPISA-N 2 0 347.890 4.010 20 0 EIADRP [NH3+]C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CC2c3ccccc3C1c1ccccc12 ZINC000422940096 1037876468 /nfs/dbraw/zinc/87/64/68/1037876468.db2.gz IQFUVVLLNSOVOM-JLFJNAHLSA-N 2 0 332.491 4.001 20 0 EIADRP COC[C@@H](CCC[NH3+])[NH2+][C@@H](c1cccc(C(F)(F)F)c1)C(C)(C)C ZINC000422920652 1037881125 /nfs/dbraw/zinc/88/11/25/1037881125.db2.gz MMJBESLTFXPCRR-CVEARBPZSA-N 2 0 346.437 4.136 20 0 EIADRP Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422974247 1037893629 /nfs/dbraw/zinc/89/36/29/1037893629.db2.gz QQCCNPFJCGUWQA-RDTXWAMCSA-N 2 0 327.472 4.114 20 0 EIADRP c1ccc(-c2cccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)c2)nc1 ZINC000422997586 1037897778 /nfs/dbraw/zinc/89/77/78/1037897778.db2.gz OLXKLVUDFPKWAL-BAGYTPMASA-N 2 0 335.495 4.149 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+][C@@H]2C[C@H]([NH3+])c3ccccc32)C[N@@H+]1Cc1ccccc1 ZINC000423007216 1037899452 /nfs/dbraw/zinc/89/94/52/1037899452.db2.gz XCIZUZMXZAGSDI-HIIFVVRCSA-N 3 0 349.522 4.022 20 0 EIADRP C[C@@H]([NH2+][C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1)C1C[NH2+]C1 ZINC000423019394 1037902571 /nfs/dbraw/zinc/90/25/71/1037902571.db2.gz VLNIMHKCKAHBPZ-RFAUZJTJSA-N 2 0 332.797 4.007 20 0 EIADRP CCc1ccc(C[NH+]2CCN(c3cc[nH+]c4ccccc43)CC2)s1 ZINC000606156303 1037907194 /nfs/dbraw/zinc/90/71/94/1037907194.db2.gz YUJNRGRPBSTCFQ-UHFFFAOYSA-N 2 0 337.492 4.181 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)Cc1ccc(C(C)C)cc1 ZINC000423023354 1037907727 /nfs/dbraw/zinc/90/77/27/1037907727.db2.gz JQFXIDNPUIWJBM-HOTGVXAUSA-N 2 0 325.500 4.254 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000423028957 1037909604 /nfs/dbraw/zinc/90/96/04/1037909604.db2.gz UFYNWXJRZQBIJU-FRFSOERESA-N 2 0 328.422 4.449 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1cc(F)cc(Br)c1 ZINC000423064188 1037930295 /nfs/dbraw/zinc/93/02/95/1037930295.db2.gz QUYSIMHCKZXHCG-OZVIIMIRSA-N 2 0 343.284 4.017 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1Cl ZINC000423069866 1037934375 /nfs/dbraw/zinc/93/43/75/1037934375.db2.gz FENXJWULJPDBFY-HEFCMCLBSA-N 2 0 342.870 4.247 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(Cl)c1 ZINC000423082215 1037946786 /nfs/dbraw/zinc/94/67/86/1037946786.db2.gz WPUQIYRVBOMEOS-HEFCMCLBSA-N 2 0 342.870 4.247 20 0 EIADRP FC1(c2cccc(Cl)c2)CC([NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)C1 ZINC000423095834 1037954053 /nfs/dbraw/zinc/95/40/53/1037954053.db2.gz NEAFSVDJRHBSFR-OLOUCDKRSA-N 2 0 336.882 4.178 20 0 EIADRP [NH3+][C@@H]1CCCCC[C@H]1[NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000423097296 1037955524 /nfs/dbraw/zinc/95/55/24/1037955524.db2.gz QRVGNSBVGNVHQQ-MWQQHZPXSA-N 2 0 326.406 4.201 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CCC2)CC1 ZINC000423098485 1037958139 /nfs/dbraw/zinc/95/81/39/1037958139.db2.gz CWQVIOGHRREBDK-JCYILVPMSA-N 2 0 326.406 4.406 20 0 EIADRP Fc1ccc2[nH]cc(CCC[NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)c2c1 ZINC000423116360 1037960971 /nfs/dbraw/zinc/96/09/71/1037960971.db2.gz POQGUTCSGFOAIY-DFQSSKMNSA-N 2 0 343.490 4.140 20 0 EIADRP FC(F)(F)c1cccc([C@@H]2CCC[C@@H]2[NH2+][C@H]2CCC[NH2+]CC2)c1 ZINC000423103143 1037963874 /nfs/dbraw/zinc/96/38/74/1037963874.db2.gz KSESKEJSJVRLSR-ULQDDVLXSA-N 2 0 326.406 4.073 20 0 EIADRP FC(F)(F)c1cccc([C@@H]([NH2+][C@H]2CCC[NH2+]CC2)C2CCC2)c1 ZINC000423107104 1037985925 /nfs/dbraw/zinc/98/59/25/1037985925.db2.gz PGOSBYKHDLFFOF-IRXDYDNUSA-N 2 0 326.406 4.278 20 0 EIADRP C[C@@H]([NH2+]CC1CCC(F)(F)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000503906774 1038004981 /nfs/dbraw/zinc/00/49/81/1038004981.db2.gz ANTHSHUCMJENGA-OAHLLOKOSA-N 2 0 340.458 4.103 20 0 EIADRP [NH3+][C@@H]1C[C@H]([NH2+]CC[C@H](c2ccccc2)C(F)(F)F)c2ccccc21 ZINC000423140107 1038013857 /nfs/dbraw/zinc/01/38/57/1038013857.db2.gz XHYHTQUZEGSOTH-KURKYZTESA-N 2 0 334.385 4.457 20 0 EIADRP Clc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C2CC[NH2+]CC2)CCC3)cc1 ZINC000423178452 1038031936 /nfs/dbraw/zinc/03/19/36/1038031936.db2.gz GDDXLGRFGQVJJX-HNNXBMFYSA-N 2 0 347.915 4.183 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)CC1 ZINC000503953060 1038045907 /nfs/dbraw/zinc/04/59/07/1038045907.db2.gz QMDFGYFFPYIEHF-UHFFFAOYSA-N 2 0 334.813 4.180 20 0 EIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]C1CCC([NH3+])CC1 ZINC000423215640 1038056632 /nfs/dbraw/zinc/05/66/32/1038056632.db2.gz NGSVGBNIBQURLS-YWBBTBBSSA-N 2 0 331.287 4.009 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000423233110 1038070156 /nfs/dbraw/zinc/07/01/56/1038070156.db2.gz NYNMIJJKHGXTDK-MFNRNEDNSA-N 2 0 326.406 4.201 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423264073 1038074647 /nfs/dbraw/zinc/07/46/47/1038074647.db2.gz XZTCDZXTPGJXNB-DOTOQJQBSA-N 2 0 343.540 4.467 20 0 EIADRP COc1ccc([C@@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2ccccc2Cl)cc1 ZINC000423250936 1038081743 /nfs/dbraw/zinc/08/17/43/1038081743.db2.gz RFVGDDFBRUHGGO-FOIQADDNSA-N 2 0 344.886 4.027 20 0 EIADRP c1ccc([C@@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)c2ccc3ccccc3n2)cc1 ZINC000423256074 1038084224 /nfs/dbraw/zinc/08/42/24/1038084224.db2.gz DJHRUZRDIMJYQK-FDDCHVKYSA-N 2 0 345.490 4.304 20 0 EIADRP CSC[C@@H]([NH2+]CC[C@@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1 ZINC000423256465 1038084488 /nfs/dbraw/zinc/08/44/88/1038084488.db2.gz FFNYWDAPQLLFTI-XJKSGUPXSA-N 2 0 346.462 4.089 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(Br)s2)cc1 ZINC000423290403 1038090615 /nfs/dbraw/zinc/09/06/15/1038090615.db2.gz CUVGXUFCAPPGSY-MNOVXSKESA-N 2 0 339.302 4.381 20 0 EIADRP CCOC(=O)C(C)(C)CCC[C@H](C)[NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000593611651 1038099747 /nfs/dbraw/zinc/09/97/47/1038099747.db2.gz DMIFDQJBZBOGCT-HNNXBMFYSA-N 2 0 340.552 4.033 20 0 EIADRP CC1(C[NH2+][C@H]2CCCc3nc(-c4ccccc4)sc32)CC[NH2+]CC1 ZINC000423317436 1038116354 /nfs/dbraw/zinc/11/63/54/1038116354.db2.gz BKDDWERTXCOQKY-INIZCTEOSA-N 2 0 341.524 4.167 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1OC ZINC000423296236 1038120416 /nfs/dbraw/zinc/12/04/16/1038120416.db2.gz YPWQTYXVPALZEG-PMPSAXMXSA-N 2 0 342.483 4.005 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2cccc(Br)c2)cc1 ZINC000423294575 1038120496 /nfs/dbraw/zinc/12/04/96/1038120496.db2.gz UWYXFQVUWVNAKV-OLZOCXBDSA-N 2 0 333.273 4.320 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000423345299 1038134052 /nfs/dbraw/zinc/13/40/52/1038134052.db2.gz YPZSBFPTINLMBL-CYBMUJFWSA-N 2 0 347.503 4.298 20 0 EIADRP CS[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000593717200 1038135205 /nfs/dbraw/zinc/13/52/05/1038135205.db2.gz ZEHWZGGUOMCWNJ-YMQHIKHWSA-N 2 0 344.568 4.446 20 0 EIADRP Clc1ccccc1C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1cccs1 ZINC000423337253 1038148305 /nfs/dbraw/zinc/14/83/05/1038148305.db2.gz ALVAGFWUPREOFL-KRWDZBQOSA-N 2 0 332.900 4.195 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[C@@H](C[NH3+])C2)CCC3)cc1 ZINC000574310512 1038164385 /nfs/dbraw/zinc/16/43/85/1038164385.db2.gz STVQCSMUMUECFI-DJIMGWMZSA-N 2 0 341.524 4.213 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cccc(Br)c1 ZINC000423358048 1038169379 /nfs/dbraw/zinc/16/93/79/1038169379.db2.gz NCCKZMNHSYBSDL-SFHVURJKSA-N 2 0 345.284 4.293 20 0 EIADRP C[C@H]([NH2+]CC1=CC[NH2+]CC1)c1ccc(-c2c(F)cccc2F)cc1 ZINC000423365666 1038186024 /nfs/dbraw/zinc/18/60/24/1038186024.db2.gz ZYUQEGZLLLDPSH-AWEZNQCLSA-N 2 0 328.406 4.202 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H]2CC[NH2+][C@@H](C)C2)CCC3)cc1 ZINC000423379261 1038189793 /nfs/dbraw/zinc/18/97/93/1038189793.db2.gz MWODHEHMDOJCOR-BHYGNILZSA-N 2 0 341.524 4.226 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cccc(OC(F)(F)F)c1 ZINC000423386632 1038192506 /nfs/dbraw/zinc/19/25/06/1038192506.db2.gz MCPFWOCNZVWMGH-LBPRGKRZSA-N 2 0 336.357 4.039 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@@H]2CC[NH2+]C[C@H]2C)CCC3)cc1 ZINC000423395835 1038202771 /nfs/dbraw/zinc/20/27/71/1038202771.db2.gz NPUYQDKSPQQPHQ-DJIMGWMZSA-N 2 0 341.524 4.084 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+][C@H]2CC[NH2+]C[C@H]2C)CCC3)cc1 ZINC000423395838 1038202894 /nfs/dbraw/zinc/20/28/94/1038202894.db2.gz NPUYQDKSPQQPHQ-HYVNUMGLSA-N 2 0 341.524 4.084 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(SCC(F)F)cc1 ZINC000423395183 1038203049 /nfs/dbraw/zinc/20/30/49/1038203049.db2.gz RUCWGOWXVUXIEG-CYBMUJFWSA-N 2 0 348.462 4.498 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CC[NH2+]1 ZINC000423375482 1038204475 /nfs/dbraw/zinc/20/44/75/1038204475.db2.gz KPEZLNGROAWWSL-WQVCFCJDSA-N 2 0 345.487 4.057 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)CC[NH2+]1 ZINC000423376765 1038204943 /nfs/dbraw/zinc/20/49/43/1038204943.db2.gz LDSICDYJOQAHAL-DVOMOZLQSA-N 2 0 345.487 4.057 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3nc(-c4ccccc4F)sc32)CC[NH2+]1 ZINC000423376769 1038206158 /nfs/dbraw/zinc/20/61/58/1038206158.db2.gz LDSICDYJOQAHAL-WWGRRREGSA-N 2 0 345.487 4.057 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423405142 1038215769 /nfs/dbraw/zinc/21/57/69/1038215769.db2.gz ZNXLZCIWLYXKHF-MBNYWOFBSA-N 2 0 332.435 4.132 20 0 EIADRP Cc1ccccc1COc1ccc([C@@H](C)[NH2+][C@@H](C)CCC[NH3+])cc1 ZINC000423450522 1038231825 /nfs/dbraw/zinc/23/18/25/1038231825.db2.gz HJSSKROCIVEUQC-ZWKOTPCHSA-N 2 0 326.484 4.352 20 0 EIADRP FC(F)(F)c1cccc([C@@H]([NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)C2CC2)c1 ZINC000423436922 1038236605 /nfs/dbraw/zinc/23/66/05/1038236605.db2.gz MBHVSJOIYUNMPZ-KSZLIROESA-N 2 0 338.417 4.134 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@H]1C1CC[NH2+]CC1)c1ccc(SCC(F)F)cc1 ZINC000423438818 1038236956 /nfs/dbraw/zinc/23/69/56/1038236956.db2.gz NLYVAPQHRRCZCA-OAUYIBNBSA-N 2 0 340.483 4.083 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](c1ccc(Br)cc1)C1CC1 ZINC000423440463 1038237655 /nfs/dbraw/zinc/23/76/55/1038237655.db2.gz TUGBULSQAPJBLL-BLLLJJGKSA-N 2 0 325.294 4.007 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H](c1ccc(Br)cc1Cl)C1CC1 ZINC000423455316 1038238290 /nfs/dbraw/zinc/23/82/90/1038238290.db2.gz MKKKAGIQWZEMPD-BMIGLBTASA-N 2 0 345.712 4.271 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)cc1OC ZINC000423455437 1038239107 /nfs/dbraw/zinc/23/91/07/1038239107.db2.gz FDQXYTBMLOMXPT-JZXOWHBKSA-N 2 0 334.504 4.042 20 0 EIADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]C(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000423464763 1038242922 /nfs/dbraw/zinc/24/29/22/1038242922.db2.gz HFQWHTSXVXCUEI-KUHUBIRLSA-N 2 0 330.422 4.161 20 0 EIADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1 ZINC000423467459 1038244661 /nfs/dbraw/zinc/24/46/61/1038244661.db2.gz IYTMEFHQWWHVNF-XEYPJELSSA-N 2 0 336.470 4.027 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]CCC[C@H]3CCC[NH2+]3)cs2)cs1 ZINC000423469574 1038244688 /nfs/dbraw/zinc/24/46/88/1038244688.db2.gz COSBYMXYXKBWDG-WFASDCNBSA-N 2 0 335.542 4.363 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000423467917 1038244730 /nfs/dbraw/zinc/24/47/30/1038244730.db2.gz UPDCDSVKNBJSLC-USXIJHARSA-N 2 0 341.524 4.295 20 0 EIADRP Cc1cc([C@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)sc1Br ZINC000423478379 1038248859 /nfs/dbraw/zinc/24/88/59/1038248859.db2.gz LDUDOLWHLCPGMG-RYUDHWBXSA-N 2 0 331.323 4.002 20 0 EIADRP Brc1ccc([C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)C2CC2)cc1 ZINC000423480980 1038252807 /nfs/dbraw/zinc/25/28/07/1038252807.db2.gz NVXUVOMWRHNOIS-IAGOWNOFSA-N 2 0 337.305 4.022 20 0 EIADRP COC[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(Cl)cc1 ZINC000423499394 1038254916 /nfs/dbraw/zinc/25/49/16/1038254916.db2.gz AVHGZUQEQWDIAM-MOPGFXCFSA-N 2 0 332.875 4.097 20 0 EIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1nc2c(s1)CCCC2 ZINC000423504562 1038258344 /nfs/dbraw/zinc/25/83/44/1038258344.db2.gz NNBTXWXLDBTOBA-GDBMZVCRSA-N 2 0 329.513 4.153 20 0 EIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000423511484 1038269639 /nfs/dbraw/zinc/26/96/39/1038269639.db2.gz TUXXUHHSYFHMJU-DYESRHJHSA-N 2 0 334.467 4.003 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+][C@@H](CCC[NH3+])c2ccccc2)C1 ZINC000423512567 1038270216 /nfs/dbraw/zinc/27/02/16/1038270216.db2.gz OOVKAFJRJGMAPJ-NJYVYQBISA-N 2 0 337.511 4.486 20 0 EIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000423512185 1038270786 /nfs/dbraw/zinc/27/07/86/1038270786.db2.gz UPGRADMULNRKGR-UWJYYQICSA-N 2 0 334.467 4.003 20 0 EIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000423511485 1038271616 /nfs/dbraw/zinc/27/16/16/1038271616.db2.gz TUXXUHHSYFHMJU-LAUBAEHRSA-N 2 0 334.467 4.003 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+][C@H]1CCc2cc(F)c(F)c(F)c21)c1ccccc1 ZINC000423522247 1038274444 /nfs/dbraw/zinc/27/44/44/1038274444.db2.gz UHTDRJNJVYIIJV-CVEARBPZSA-N 2 0 334.385 4.161 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423539944 1038284999 /nfs/dbraw/zinc/28/49/99/1038284999.db2.gz JBVGCTAWOYZGGG-XLSPSMHOSA-N 2 0 328.500 4.001 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423538343 1038285132 /nfs/dbraw/zinc/28/51/32/1038285132.db2.gz GDYYBKPREZUORG-GFOCRRMGSA-N 2 0 340.433 4.004 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423539924 1038285978 /nfs/dbraw/zinc/28/59/78/1038285978.db2.gz JBVGCTAWOYZGGG-LJCCNALRSA-N 2 0 328.500 4.001 20 0 EIADRP CC(C)Oc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)cc1Cl ZINC000423540230 1038286107 /nfs/dbraw/zinc/28/61/07/1038286107.db2.gz DCWTVFWWYRVUQN-QMCVQRASSA-N 2 0 336.907 4.166 20 0 EIADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc2ccccc2c1OC(F)F ZINC000423569964 1038298648 /nfs/dbraw/zinc/29/86/48/1038298648.db2.gz WMDNGMIWQQNKML-CQSZACIVSA-N 2 0 346.421 4.402 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@@H](c1ccc(F)cc1)c1ccccc1Cl ZINC000490143892 1038356265 /nfs/dbraw/zinc/35/62/65/1038356265.db2.gz NONLBDXOAMZASC-IBGZPJMESA-N 2 0 334.866 4.500 20 0 EIADRP Cc1ccc(COc2ccc(C[NH2+][C@H]3CC[N@H+](C)[C@H](C)C3)cc2)cc1 ZINC000608061369 1038453526 /nfs/dbraw/zinc/45/35/26/1038453526.db2.gz RGXOILJNFWAARJ-NQIIRXRSSA-N 2 0 338.495 4.146 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H](CC2CCOCC2)c2ccccc2)CC1 ZINC001168312084 1038787615 /nfs/dbraw/zinc/78/76/15/1038787615.db2.gz JIBALBQCPDEQDC-CBNMVNINSA-N 2 0 330.516 4.007 20 0 EIADRP C[C@@H](CC[NH2+][C@@H](Cc1ccncc1)c1cccs1)[NH+]1CCCCC1 ZINC000424279986 1038790680 /nfs/dbraw/zinc/79/06/80/1038790680.db2.gz LDFMJCRJYHBWOY-HKUYNNGSSA-N 2 0 343.540 4.281 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](Cc2ccncc2)c2cccs2)CC1 ZINC000424311928 1038797774 /nfs/dbraw/zinc/79/77/74/1038797774.db2.gz LKXKONDXHDHTGM-LJQANCHMSA-N 2 0 343.540 4.139 20 0 EIADRP CCc1ccc([C@H](CC)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)cc1 ZINC000539058429 1038805086 /nfs/dbraw/zinc/80/50/86/1038805086.db2.gz JONIJNGJMLMQFX-BHDDXSALSA-N 2 0 344.543 4.058 20 0 EIADRP CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000480770558 1038808128 /nfs/dbraw/zinc/80/81/28/1038808128.db2.gz OOVQGMGCPSIRMN-PXNSSMCTSA-N 2 0 334.935 4.371 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(F)cc1Cl ZINC000539072156 1038821766 /nfs/dbraw/zinc/82/17/66/1038821766.db2.gz VEDDCVFJGJBYBI-RBSFLKMASA-N 2 0 342.886 4.019 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(Cl)c(F)c1 ZINC000539072301 1038822573 /nfs/dbraw/zinc/82/25/73/1038822573.db2.gz PJLGDIXAFNPVBJ-RBSFLKMASA-N 2 0 342.886 4.019 20 0 EIADRP Cc1cccc2c1CC[C@H]2[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000539082139 1038829295 /nfs/dbraw/zinc/82/92/95/1038829295.db2.gz LWJGXWRRGFMAKB-HTAPYJJXSA-N 2 0 338.495 4.274 20 0 EIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+][C@@H]1C[C@@H]1Cc1ccccc1 ZINC000539088418 1038830221 /nfs/dbraw/zinc/83/02/21/1038830221.db2.gz SHKGEYDSSOOHOU-HGSOSGBHSA-N 2 0 334.507 4.118 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]CCOc2ccccc2-c2ccccc2)[C@@H](C)C1 ZINC000539093779 1038834603 /nfs/dbraw/zinc/83/46/03/1038834603.db2.gz TWODIFIATSLHCX-GHTZIAJQSA-N 2 0 338.495 4.052 20 0 EIADRP CC(C)(C[NH2+]Cc1ccc(Cl)c2cccnc12)C[NH+]1CCCC1 ZINC000480909734 1038867024 /nfs/dbraw/zinc/86/70/24/1038867024.db2.gz IPIBOKLQKHLVSN-UHFFFAOYSA-N 2 0 331.891 4.100 20 0 EIADRP c1ccc(CCN2CCC([NH2+][C@@H]3CC[C@@H]4CCC[C@H]4C3)CC2)cc1 ZINC000462120570 1038938704 /nfs/dbraw/zinc/93/87/04/1038938704.db2.gz UKPSHLOKUJQFIP-JAXLGGSGSA-N 2 0 326.528 4.252 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)c(OC(F)F)cc1C ZINC000414808091 1039025556 /nfs/dbraw/zinc/02/55/56/1039025556.db2.gz JZOLPNLJEHLNEM-CQSZACIVSA-N 2 0 334.410 4.214 20 0 EIADRP Cc1cc(Br)c(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)s1 ZINC000414816345 1039083945 /nfs/dbraw/zinc/08/39/45/1039083945.db2.gz PNGMKDDQGIGMJJ-NSHDSACASA-N 2 0 339.302 4.129 20 0 EIADRP CC[C@@H]1CCCC[C@@H]1[NH2+]CC1(C[NH2+][C@H]2CCCC[C@@H]2CC)COC1 ZINC000481189167 1039098791 /nfs/dbraw/zinc/09/87/91/1039098791.db2.gz JCOVERUEOQPRJY-YRPNKDGESA-N 2 0 336.564 4.120 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1ccc2c(c1)OCO2 ZINC000120448211 1039112910 /nfs/dbraw/zinc/11/29/10/1039112910.db2.gz SKYIQRDBUVPWBA-MRXNPFEDSA-N 2 0 340.467 4.108 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCc2c[nH]c3cc(Cl)cc(Cl)c23)CC[N@@H+]1C ZINC000477855749 1039136459 /nfs/dbraw/zinc/13/64/59/1039136459.db2.gz IIFFFLGGDGYIIG-RISCZKNCSA-N 2 0 340.298 4.090 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@@H](C)c3cccs3)CC2)cc1 ZINC000120668067 1039169217 /nfs/dbraw/zinc/16/92/17/1039169217.db2.gz JDNAQQLJRRMUDL-INIZCTEOSA-N 2 0 344.524 4.320 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CC(C)(C)C[NH+]2CCCC2)ccc1SC ZINC000477934125 1039222440 /nfs/dbraw/zinc/22/24/40/1039222440.db2.gz UGBZTMIYRVOWFT-OAHLLOKOSA-N 2 0 336.545 4.190 20 0 EIADRP Cc1ncc([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)s1 ZINC000090406506 1039224804 /nfs/dbraw/zinc/22/48/04/1039224804.db2.gz LNHJXLDPPXPRBF-CYBMUJFWSA-N 2 0 335.542 4.076 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(C)cc1 ZINC000481310544 1039259250 /nfs/dbraw/zinc/25/92/50/1039259250.db2.gz OJMJQQZMVBKEGM-OAQYLSRUSA-N 2 0 326.484 4.176 20 0 EIADRP C[C@@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000120988165 1039261943 /nfs/dbraw/zinc/26/19/43/1039261943.db2.gz DNAMMQKMZUQZMJ-ZUOKHONESA-N 2 0 330.422 4.050 20 0 EIADRP CC[C@@H](Cc1ccc(Cl)cc1Cl)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000414838494 1039299139 /nfs/dbraw/zinc/29/91/39/1039299139.db2.gz WXEAYVXAWKNOMX-LSVZVQIISA-N 2 0 327.299 4.187 20 0 EIADRP CO[C@@H]1C[C@H](c2ccccc2)CC[C@H]1[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000552322731 1039379993 /nfs/dbraw/zinc/37/99/93/1039379993.db2.gz XJKASLZCPSSSOV-HMXCVIKNSA-N 2 0 344.543 4.190 20 0 EIADRP CC(C)COc1ccc([C@@H](C)[NH2+]C2CC[NH+](C3CCC3)CC2)cc1 ZINC000481433271 1039425698 /nfs/dbraw/zinc/42/56/98/1039425698.db2.gz JNHIVPCXRFKVDQ-QGZVFWFLSA-N 2 0 330.516 4.389 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccc(Br)s1 ZINC000555613909 1039427769 /nfs/dbraw/zinc/42/77/69/1039427769.db2.gz DCAYZAAVGKFDMW-ZDUSSCGKSA-N 2 0 345.350 4.427 20 0 EIADRP C[C@@H](NC1CC[NH+](C2CCC2)CC1)c1ccccc1OC(F)(F)F ZINC000481446546 1039438922 /nfs/dbraw/zinc/43/89/22/1039438922.db2.gz RECMBMKOQGYLBS-CYBMUJFWSA-N 2 0 342.405 4.253 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000122163992 1039604242 /nfs/dbraw/zinc/60/42/42/1039604242.db2.gz VDDUFOJCKWMKQL-PBHICJAKSA-N 2 0 340.433 4.057 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cccc(C)c1 ZINC000514105733 1039611858 /nfs/dbraw/zinc/61/18/58/1039611858.db2.gz SWTXMXKGQUFBIV-NRFANRHFSA-N 2 0 326.484 4.176 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cccc(Cl)c1 ZINC000122348273 1039653591 /nfs/dbraw/zinc/65/35/91/1039653591.db2.gz FOQCJLZFOUZXRQ-HNNXBMFYSA-N 2 0 332.875 4.131 20 0 EIADRP C[N@H+](CC1CCN(c2cc[nH+]cc2)CC1)C[C@@H]1CCCC(F)(F)C1 ZINC000514145210 1039655797 /nfs/dbraw/zinc/65/57/97/1039655797.db2.gz LQLODPYZYOTTRC-QGZVFWFLSA-N 2 0 337.458 4.055 20 0 EIADRP CCc1ccc([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)s1 ZINC000122403687 1039703234 /nfs/dbraw/zinc/70/32/34/1039703234.db2.gz YUJMMDVGSLRQSQ-OAHLLOKOSA-N 2 0 332.513 4.102 20 0 EIADRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc2ccccc2c1OC(F)F ZINC000643533800 1039710902 /nfs/dbraw/zinc/71/09/02/1039710902.db2.gz FDMCTSKTJSCDLV-GUYCJALGSA-N 2 0 346.421 4.234 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCOc2c(Cl)cccc2Cl)[C@H](C)C1 ZINC000429781289 1039734368 /nfs/dbraw/zinc/73/43/68/1039734368.db2.gz SLHKRVDIHLAAPB-CZUORRHYSA-N 2 0 345.314 4.034 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3cc(F)c(OC)cc32)c1 ZINC000281088737 1039800846 /nfs/dbraw/zinc/80/08/46/1039800846.db2.gz AGCFFFBCBCPGFW-FQEVSTJZSA-N 2 0 342.458 4.063 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CC1CC[NH+](C)CC1 ZINC000550890381 1039813308 /nfs/dbraw/zinc/81/33/08/1039813308.db2.gz HBNPRJXOGWNPAX-INIZCTEOSA-N 2 0 327.516 4.156 20 0 EIADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)c1ccc(SCC(F)(F)F)cc1 ZINC000481959271 1039913371 /nfs/dbraw/zinc/91/33/71/1039913371.db2.gz LGFASBVGDLLKOE-STQMWFEESA-N 2 0 334.451 4.332 20 0 EIADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)c1cccc(OCc2ccccc2)c1 ZINC000481957765 1039914452 /nfs/dbraw/zinc/91/44/52/1039914452.db2.gz MVWZNIIRFYYGQJ-ROUUACIJSA-N 2 0 326.484 4.256 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2ncc(-c3ccc(F)cc3)o2)CC1 ZINC000123269381 1039990170 /nfs/dbraw/zinc/99/01/70/1039990170.db2.gz DUZYEMKSBIWGBX-UHFFFAOYSA-N 2 0 345.462 4.035 20 0 EIADRP Cc1cc(C[NH+](C)C)cc(N[C@H]2CC[N@H+](C)[C@H](c3ccccc3)C2)c1 ZINC000551147673 1040005996 /nfs/dbraw/zinc/00/59/96/1040005996.db2.gz HNIDGWRGKPLORZ-UNMCSNQZSA-N 2 0 337.511 4.304 20 0 EIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccc(F)cc3)s2)C1 ZINC000551208833 1040059610 /nfs/dbraw/zinc/05/96/10/1040059610.db2.gz XGEGJPYBAQUYKZ-OAHLLOKOSA-N 2 0 332.488 4.374 20 0 EIADRP CCC[NH+]1CCC([NH2+]CCCc2c(Cl)cccc2Cl)CC1 ZINC000482234907 1040093816 /nfs/dbraw/zinc/09/38/16/1040093816.db2.gz OXXIQPSLFPSGRI-UHFFFAOYSA-N 2 0 329.315 4.390 20 0 EIADRP C[N@@H+]1CC[C@]2(CC[NH+](CC(Cc3ccccc3)Cc3ccccc3)C2)C1 ZINC000430135326 1040119484 /nfs/dbraw/zinc/11/94/84/1040119484.db2.gz SWGKBQVAHAFYBJ-DEOSSOPVSA-N 2 0 348.534 4.116 20 0 EIADRP CC[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccccc1Br ZINC000482353472 1040200227 /nfs/dbraw/zinc/20/02/27/1040200227.db2.gz QFFKJCWCJWPKPT-KRWDZBQOSA-N 2 0 339.321 4.222 20 0 EIADRP C[C@H](NC[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1cc(F)cc(F)c1 ZINC000482441687 1040247490 /nfs/dbraw/zinc/24/74/90/1040247490.db2.gz VPIMHNQDQPTRNK-WMZOPIPTSA-N 2 0 344.449 4.180 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+]C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000514812799 1040263765 /nfs/dbraw/zinc/26/37/65/1040263765.db2.gz UEQQHFQKQQGNJF-XBNGYDHASA-N 2 0 340.433 4.430 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000482539713 1040335568 /nfs/dbraw/zinc/33/55/68/1040335568.db2.gz RXRQBGLUWPNEMU-OAHLLOKOSA-N 2 0 343.540 4.035 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1cccc(OCc2ccccc2)c1 ZINC000482559580 1040349610 /nfs/dbraw/zinc/34/96/10/1040349610.db2.gz YAHJWUFSMGVTBR-GOSISDBHSA-N 2 0 338.495 4.258 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(OC)c1 ZINC000479461736 1040366692 /nfs/dbraw/zinc/36/66/92/1040366692.db2.gz DLJDMMGEBSUECV-UGKGYDQZSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@@H]1Cc2ccc(F)cc2[C@H]1[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000479466320 1040390427 /nfs/dbraw/zinc/39/04/27/1040390427.db2.gz RNJJXZYXLKYOIR-NRJQMVOHSA-N 2 0 338.470 4.171 20 0 EIADRP CC(C)[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000539509582 1040502608 /nfs/dbraw/zinc/50/26/08/1040502608.db2.gz HFUSDOHKLFOCMF-QGZVFWFLSA-N 2 0 326.406 4.254 20 0 EIADRP CC(C)(C[NH2+][C@H]1CN(Cc2ccccc2)C(C)(C)C1)C(F)(F)F ZINC000669830618 1040508155 /nfs/dbraw/zinc/50/81/55/1040508155.db2.gz OADLARAKDSRJLO-OAHLLOKOSA-N 2 0 328.422 4.218 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](C)c2cccc(C)c2C)[C@@H](C)C1 ZINC000483124216 1040719659 /nfs/dbraw/zinc/71/96/59/1040719659.db2.gz GJCOTELRKQFGFP-DSKINZAPSA-N 2 0 332.532 4.091 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CSc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000483177809 1040746904 /nfs/dbraw/zinc/74/69/04/1040746904.db2.gz QDATVOINPSXIJF-DNVCBOLYSA-N 2 0 342.508 4.125 20 0 EIADRP C[C@H]([NH2+]CCSc1ccccc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000479904087 1040762300 /nfs/dbraw/zinc/76/23/00/1040762300.db2.gz STIQHMYILBQJPZ-KRWDZBQOSA-N 2 0 344.524 4.070 20 0 EIADRP CCC[C@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000483258618 1040795917 /nfs/dbraw/zinc/79/59/17/1040795917.db2.gz NJGSIKZABLLINO-XLIONFOSSA-N 2 0 345.531 4.166 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+]CCC[NH+]2CCCCC2)cc1 ZINC000462666708 1040829673 /nfs/dbraw/zinc/82/96/73/1040829673.db2.gz XCDCWGAIHOAFOG-UHFFFAOYSA-N 2 0 338.495 4.328 20 0 EIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000480007610 1040850053 /nfs/dbraw/zinc/85/00/53/1040850053.db2.gz KSZYCRIKOKMRPD-VQTJNVASSA-N 2 0 346.559 4.328 20 0 EIADRP Clc1cccc(Oc2ccccc2)c1C[NH2+]CCn1ccnc1 ZINC000480001158 1040855782 /nfs/dbraw/zinc/85/57/82/1040855782.db2.gz XEGAFMOHPBNWPR-UHFFFAOYSA-N 2 0 327.815 4.119 20 0 EIADRP c1ccc([C@@H](CC2CC2)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000537935665 1040897678 /nfs/dbraw/zinc/89/76/78/1040897678.db2.gz AUZPNYTYKBZPAZ-JOCHJYFZSA-N 2 0 335.495 4.429 20 0 EIADRP CC1(C)C[C@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c2ccccc21 ZINC000537937140 1040901221 /nfs/dbraw/zinc/90/12/21/1040901221.db2.gz XYRHVBBGZROBQD-NRFANRHFSA-N 2 0 335.495 4.310 20 0 EIADRP CCC1(C[NH2+][C@@H](C)C2CCOCC2)CC[NH+](Cc2ccccc2)CC1 ZINC000537939776 1040901762 /nfs/dbraw/zinc/90/17/62/1040901762.db2.gz FBRAHUUEAWGCAB-IBGZPJMESA-N 2 0 344.543 4.084 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCC[C@H]([C@H]3CCOC3)C2)cc1 ZINC000462791416 1040939584 /nfs/dbraw/zinc/93/95/84/1040939584.db2.gz PBIFTTZOTRKBHA-FDFHNCONSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1cc(Cl)ccc1OC(F)F ZINC000515649934 1040950812 /nfs/dbraw/zinc/95/08/12/1040950812.db2.gz RLWQXYITEPQMNV-NSHDSACASA-N 2 0 340.801 4.251 20 0 EIADRP c1ccc(C[N@@H+]2C[C@@H]3CC[C@@H]([NH2+][C@@H]4CCCSCC4)C[C@@H]3C2)cc1 ZINC000898519250 1040971567 /nfs/dbraw/zinc/97/15/67/1040971567.db2.gz OBFQDPVLDUINKF-DOIPELPJSA-N 2 0 344.568 4.162 20 0 EIADRP COc1cccc2c1CC[C@@H]2[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000537968844 1040972170 /nfs/dbraw/zinc/97/21/70/1040972170.db2.gz ZOBLZEISBXJOGS-NRFANRHFSA-N 2 0 338.495 4.313 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2cc(C)ccc2OC(F)F)CC1 ZINC000483725072 1040977273 /nfs/dbraw/zinc/97/72/73/1040977273.db2.gz DJIKHLLIMYFYQB-OAHLLOKOSA-N 2 0 340.458 4.369 20 0 EIADRP C[C@@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(SCC(F)(F)F)cc1 ZINC000480160684 1041018013 /nfs/dbraw/zinc/01/80/13/1041018013.db2.gz PJRZWWHRYKWHMH-CQSZACIVSA-N 2 0 346.462 4.478 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CCC[NH+]2CCC(C)CC2)ccc1SC ZINC000480174242 1041035654 /nfs/dbraw/zinc/03/56/54/1041035654.db2.gz SFRSPBQZQRHDPX-MRXNPFEDSA-N 2 0 336.545 4.190 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@H](c3ccccc3)C3CC3)C2)cc1 ZINC000538103098 1041058377 /nfs/dbraw/zinc/05/83/77/1041058377.db2.gz UCVDGXKNAXNMFA-NFBKMPQASA-N 2 0 334.507 4.292 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)[C@@H](C)C1 ZINC000436293351 1041058885 /nfs/dbraw/zinc/05/88/85/1041058885.db2.gz CWRYXMKBPIFSNM-IKICRFKJSA-N 2 0 340.433 4.271 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)[C@@H](C)C1 ZINC000436293354 1041060640 /nfs/dbraw/zinc/06/06/40/1041060640.db2.gz CWRYXMKBPIFSNM-QXRTWZOPSA-N 2 0 340.433 4.271 20 0 EIADRP CC(C)[C@H]([NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1)c1cccnc1 ZINC000538115701 1041066541 /nfs/dbraw/zinc/06/65/41/1041066541.db2.gz AWLKXZWBWGWDFY-NQIIRXRSSA-N 2 0 325.500 4.279 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2cc3c(cccc3F)[nH]2)CC1 ZINC000436310932 1041077994 /nfs/dbraw/zinc/07/79/94/1041077994.db2.gz XZOVTSWJXNXDTK-UHFFFAOYSA-N 2 0 331.479 4.155 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@H]3C)cc2)cs1 ZINC000480272827 1041151952 /nfs/dbraw/zinc/15/19/52/1041151952.db2.gz DYRDXGVCGBITEV-MMMWYMCRSA-N 2 0 343.540 4.498 20 0 EIADRP Cc1ccccc1O[C@H]1CCCC[C@@H]1[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000538193728 1041159104 /nfs/dbraw/zinc/15/91/04/1041159104.db2.gz CDXDNKAIVPTZQF-UNMCSNQZSA-N 2 0 342.527 4.149 20 0 EIADRP Cc1ccc2c(c1)CC[C@H]2[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000540143049 1041163855 /nfs/dbraw/zinc/16/38/55/1041163855.db2.gz BZAPHNCSVUFNDJ-VGOFRKELSA-N 2 0 338.495 4.274 20 0 EIADRP CCCC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)c1ccccc1 ZINC000540158067 1041183086 /nfs/dbraw/zinc/18/30/86/1041183086.db2.gz SPLAHUJQBZULJV-BDTNDASRSA-N 2 0 344.543 4.275 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000484280778 1041183889 /nfs/dbraw/zinc/18/38/89/1041183889.db2.gz TXDAZEMWWUPJOA-GXTWGEPZSA-N 2 0 333.303 4.001 20 0 EIADRP CCc1nc2c(s1)[C@@H]([NH2+]CC1CC[NH+](CCC(C)C)CC1)CCC2 ZINC000484304047 1041191330 /nfs/dbraw/zinc/19/13/30/1041191330.db2.gz UADJWPIGEPYKFE-KRWDZBQOSA-N 2 0 349.588 4.431 20 0 EIADRP Cc1cc(C)cc(OC[C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167960763 1041191883 /nfs/dbraw/zinc/19/18/83/1041191883.db2.gz BURNLQVMBHECDN-LBFURVHYSA-N 2 0 342.527 4.066 20 0 EIADRP CCc1nc(C)c([C@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)s1 ZINC000484297793 1041199044 /nfs/dbraw/zinc/19/90/44/1041199044.db2.gz VNRNLRVCZQKEOS-HNNXBMFYSA-N 2 0 337.577 4.423 20 0 EIADRP C[C@H]([NH2+]Cc1cc2c(cccc2F)[nH]1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000436399881 1041204893 /nfs/dbraw/zinc/20/48/93/1041204893.db2.gz GUVWAWGODCBOAG-GJZGRUSLSA-N 2 0 329.463 4.050 20 0 EIADRP c1ccc(C[C@H]2CC[C@H]([NH2+]CC3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000436401417 1041206816 /nfs/dbraw/zinc/20/68/16/1041206816.db2.gz PDVVMOACFIUGQX-YADHBBJMSA-N 2 0 349.522 4.299 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@@H](c2ccccc2)C(C)C)[C@@H](C)C1 ZINC000480331513 1041216255 /nfs/dbraw/zinc/21/62/55/1041216255.db2.gz HBIHUOZWCJGSGI-NNWRFLSQSA-N 2 0 346.559 4.153 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]CC[C@@H]2CCC[N@@H+]2C)cc1 ZINC000538259733 1041219460 /nfs/dbraw/zinc/21/94/60/1041219460.db2.gz NEMQVUHNXZRIPY-PXNSSMCTSA-N 2 0 338.495 4.497 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1cccc(O)c1 ZINC000194839349 1041228041 /nfs/dbraw/zinc/22/80/41/1041228041.db2.gz VXGOHABCKGKHRE-SFHVURJKSA-N 2 0 338.495 4.475 20 0 EIADRP COc1ccc2cc([C@H](C)[NH2+][C@H]3CCC[C@@H]([NH+](C)C)C3)ccc2c1 ZINC000484471722 1041248864 /nfs/dbraw/zinc/24/88/64/1041248864.db2.gz ILZUVRGOJICWPD-RYGJVYDSSA-N 2 0 326.484 4.372 20 0 EIADRP Clc1sccc1C[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000480392016 1041262836 /nfs/dbraw/zinc/26/28/36/1041262836.db2.gz BHDPXRCRGYSFDK-UHFFFAOYSA-N 2 0 340.945 4.465 20 0 EIADRP c1ccc(C[C@@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C2CC2)cc1 ZINC000484490417 1041263749 /nfs/dbraw/zinc/26/37/49/1041263749.db2.gz QEIATDOXEMDNHX-JOCHJYFZSA-N 2 0 326.528 4.394 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H]([NH+](C)C)C2)c2ccccc12 ZINC000484496512 1041304515 /nfs/dbraw/zinc/30/45/15/1041304515.db2.gz RMDHTRPAXXILHP-YESZJQIVSA-N 2 0 326.484 4.372 20 0 EIADRP CSc1ccccc1[C@@H](C)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000194919134 1041316699 /nfs/dbraw/zinc/31/66/99/1041316699.db2.gz TUCPPNJVOCPNGA-MRXNPFEDSA-N 2 0 341.524 4.371 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H](c2ccccc2OC)C2CCCC2)CC1 ZINC000540259932 1041326752 /nfs/dbraw/zinc/32/67/52/1041326752.db2.gz WIHZEGODTLULNA-NRFANRHFSA-N 2 0 330.516 4.391 20 0 EIADRP Fc1cccc(C2([NH2+]C3CC[NH+](CC4CC4)CC3)CCCCC2)c1 ZINC001168363077 1041338853 /nfs/dbraw/zinc/33/88/53/1041338853.db2.gz SFIIINKVUCTFRW-UHFFFAOYSA-N 2 0 330.491 4.449 20 0 EIADRP Cc1ccc([C@H]([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C2CC2)cc1 ZINC000540315282 1041359705 /nfs/dbraw/zinc/35/97/05/1041359705.db2.gz FZBNWZLFMJTTSR-QFIPXVFZSA-N 2 0 335.495 4.347 20 0 EIADRP CC(C)(C[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12)C(F)(F)F ZINC000554722032 1041364326 /nfs/dbraw/zinc/36/43/26/1041364326.db2.gz DJVVFMKVCLMZRO-IXDOHACOSA-N 2 0 340.433 4.075 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CCc2cccc(F)c2)CCN1Cc1ccccc1 ZINC000463138083 1041372452 /nfs/dbraw/zinc/37/24/52/1041372452.db2.gz UNOZMODIRBJRIK-DYESRHJHSA-N 2 0 326.459 4.011 20 0 EIADRP Cc1cccc([C@@H](C)C[NH2+]C2CCN(CCc3ccccc3)CC2)c1 ZINC000463191783 1041408049 /nfs/dbraw/zinc/40/80/49/1041408049.db2.gz QCPYYDADTHBNSC-FQEVSTJZSA-N 2 0 336.523 4.395 20 0 EIADRP CCc1nc(C)c([C@@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)s1 ZINC000480601800 1041412048 /nfs/dbraw/zinc/41/20/48/1041412048.db2.gz BOBDJYXHAHISHN-OWCLPIDISA-N 2 0 337.577 4.423 20 0 EIADRP CCc1nc(C)c([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)s1 ZINC000480601798 1041412215 /nfs/dbraw/zinc/41/22/15/1041412215.db2.gz BOBDJYXHAHISHN-JYJNAYRXSA-N 2 0 337.577 4.423 20 0 EIADRP CC(C)C[C@@H]1C[C@H]([NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)CCO1 ZINC000538579547 1041431047 /nfs/dbraw/zinc/43/10/47/1041431047.db2.gz XACSQFSAXHDBFI-AYWYSENESA-N 2 0 336.564 4.213 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cccc(OC(F)F)c1 ZINC000480622502 1041437069 /nfs/dbraw/zinc/43/70/69/1041437069.db2.gz YNWFIJDBFSTDKB-HOTGVXAUSA-N 2 0 340.458 4.451 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(-n2cccn2)cc1 ZINC000480631813 1041444992 /nfs/dbraw/zinc/44/49/92/1041444992.db2.gz QXAXBFPIROSAGF-OALUTQOASA-N 2 0 340.515 4.178 20 0 EIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]C3(Cc4ccccc4)CC3)CC2)C1 ZINC000480668080 1041460766 /nfs/dbraw/zinc/46/07/66/1041460766.db2.gz VDHWVBLGLJIIEX-RXVVDRJESA-N 2 0 326.528 4.394 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@@H]3CCSc4ccccc43)C2)cc1 ZINC000195134368 1041487026 /nfs/dbraw/zinc/48/70/26/1041487026.db2.gz UIUPMCIFKFYCKM-UYAOXDASSA-N 2 0 338.520 4.335 20 0 EIADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1 ZINC000480732570 1041496650 /nfs/dbraw/zinc/49/66/50/1041496650.db2.gz SOZSITHMHXIRFA-PMXSJFBMSA-N 2 0 336.564 4.213 20 0 EIADRP CC(C)c1ccc(-c2nc(CN3CC[C@H]([C@H](C)[NH3+])C3)cs2)cc1 ZINC000484908986 1041516004 /nfs/dbraw/zinc/51/60/04/1041516004.db2.gz SCZGAYAXZZWWMF-YOEHRIQHSA-N 2 0 329.513 4.103 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2ccc3c[nH]nc3c2)CC1 ZINC000538725054 1041516819 /nfs/dbraw/zinc/51/68/19/1041516819.db2.gz RMLQDPQPABXLPQ-KRWDZBQOSA-N 2 0 340.515 4.039 20 0 EIADRP c1sc2ccccc2c1C[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C2CC2)C1 ZINC000538799444 1041539269 /nfs/dbraw/zinc/53/92/69/1041539269.db2.gz GDYBWSBGAIJXDZ-BEFAXECRSA-N 2 0 326.509 4.350 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](Cc3ccc(-c4ccc(F)cc4)o3)CC[C@@H]21 ZINC000538799215 1041540108 /nfs/dbraw/zinc/54/01/08/1041540108.db2.gz URBUTZRBHMMBOC-APWZRJJASA-N 2 0 328.431 4.002 20 0 EIADRP C[N@H+](CCCc1ccccc1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000538945282 1041586982 /nfs/dbraw/zinc/58/69/82/1041586982.db2.gz YLGPSWRZRFMDLF-UHFFFAOYSA-N 2 0 337.511 4.253 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)cc(C)c1F ZINC000539039147 1041616951 /nfs/dbraw/zinc/61/69/51/1041616951.db2.gz SMQKTWVVNAVUPY-QGZVFWFLSA-N 2 0 341.474 4.405 20 0 EIADRP Cc1ccccc1O[C@@H]1CCCC[C@@H]1[NH2+]C1CC[NH+](C(C)C)CC1 ZINC000541078952 1041800465 /nfs/dbraw/zinc/80/04/65/1041800465.db2.gz VHTVRRZKNVAIIV-PZJWPPBQSA-N 2 0 330.516 4.147 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CCC[C@@H]2[NH2+][C@H]2CCC[NH2+]CC2)cc1 ZINC000414918933 1041984029 /nfs/dbraw/zinc/98/40/29/1041984029.db2.gz TUEMGTYRBOOZPH-ULQDDVLXSA-N 2 0 326.406 4.073 20 0 EIADRP C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1cc(-n2ccnc2)cs1 ZINC000541537121 1041999674 /nfs/dbraw/zinc/99/96/74/1041999674.db2.gz JUYVNUGDSYWPNH-GFCCVEGCSA-N 2 0 333.407 4.405 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000402757737 1042004826 /nfs/dbraw/zinc/00/48/26/1042004826.db2.gz GDVVHUYJVJMJAI-YQQAZPJKSA-N 2 0 328.422 4.075 20 0 EIADRP C[C@@H](Cc1ccccc1F)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000438208215 1042088264 /nfs/dbraw/zinc/08/82/64/1042088264.db2.gz LYJYWFHKAXNLFS-INIZCTEOSA-N 2 0 346.515 4.320 20 0 EIADRP C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc(Cl)cc3)s2)C1 ZINC000541909515 1042166893 /nfs/dbraw/zinc/16/68/93/1042166893.db2.gz ZBRIOAJLPPVCRQ-AWEZNQCLSA-N 2 0 334.916 4.452 20 0 EIADRP CC[N@H+](C)C[C@H]1CC[NH+](CCCSc2ccccc2Cl)C1 ZINC000464792245 1042169839 /nfs/dbraw/zinc/16/98/39/1042169839.db2.gz WCRXDXGUHJTXFC-OAHLLOKOSA-N 2 0 326.937 4.096 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2ccc(OC)c(OC)c2)CC1 ZINC000542176931 1042327941 /nfs/dbraw/zinc/32/79/41/1042327941.db2.gz LQQANHKJJCFSJT-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP Clc1ccc2c(c1)[C@H]([N@@H+]1CC[C@H]3[C@H](CCCN3C3CC3)C1)CC2 ZINC000542212124 1042338659 /nfs/dbraw/zinc/33/86/59/1042338659.db2.gz FQGRZSJWVBXBRT-UIAACRFSSA-N 2 0 330.903 4.276 20 0 EIADRP Fc1cccc(-c2ccc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)s2)c1 ZINC000509573144 1042385120 /nfs/dbraw/zinc/38/51/20/1042385120.db2.gz ZAKVTVPFASGJLJ-IRXDYDNUSA-N 2 0 330.472 4.271 20 0 EIADRP Fc1cccc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)s2)c1 ZINC000509573146 1042385226 /nfs/dbraw/zinc/38/52/26/1042385226.db2.gz ZAKVTVPFASGJLJ-SJORKVTESA-N 2 0 330.472 4.271 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)c1ccncc1 ZINC000173927456 1042630568 /nfs/dbraw/zinc/63/05/68/1042630568.db2.gz HHOBQLUNJLYZFJ-QRVBRYPASA-N 2 0 337.511 4.410 20 0 EIADRP C[C@@H]([NH2+]CCO[C@H]1CCCC[C@H]1C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492427285 1042648681 /nfs/dbraw/zinc/64/86/81/1042648681.db2.gz YRWKSXRUOHNWSJ-WKDRNLAYSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1ccc2[nH]cnc2c1 ZINC000518765608 1042674414 /nfs/dbraw/zinc/67/44/14/1042674414.db2.gz QCKCQNXWVRMDBT-KRWDZBQOSA-N 2 0 348.494 4.227 20 0 EIADRP CCc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000309707877 1042818806 /nfs/dbraw/zinc/81/88/06/1042818806.db2.gz IMPNKUCFLQEITC-FUHWJXTLSA-N 2 0 328.525 4.311 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(Cl)cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000309875646 1042823333 /nfs/dbraw/zinc/82/33/33/1042823333.db2.gz SYKBHBQASWVKIU-LPHOPBHVSA-N 2 0 328.887 4.340 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1ccc(OCc2ccccc2)cc1 ZINC000311016329 1042850782 /nfs/dbraw/zinc/85/07/82/1042850782.db2.gz NADWJIPWPYTHFU-JBYIUTFZSA-N 2 0 338.495 4.084 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccsc3)CC2)cc1 ZINC000178157492 1042860160 /nfs/dbraw/zinc/86/01/60/1042860160.db2.gz VKLYAFAPQRJSHV-MRXNPFEDSA-N 2 0 344.524 4.320 20 0 EIADRP C[C@H]([NH2+]Cc1cccc2cccnc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311609393 1042862695 /nfs/dbraw/zinc/86/26/95/1042862695.db2.gz DZEDYWIJGNPCND-AVRDEDQJSA-N 2 0 345.490 4.235 20 0 EIADRP CC[C@@H]1C[C@H](C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)CCO1 ZINC000507784919 1042934988 /nfs/dbraw/zinc/93/49/88/1042934988.db2.gz UERKNUIPWHBCQB-FGZHOGPDSA-N 2 0 344.543 4.036 20 0 EIADRP C[C@H]1CC([NH2+]CCOc2ccccc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168005137 1042956171 /nfs/dbraw/zinc/95/61/71/1042956171.db2.gz GPFVXYLRLKNPMK-OALUTQOASA-N 2 0 338.495 4.097 20 0 EIADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000493978306 1042990911 /nfs/dbraw/zinc/99/09/11/1042990911.db2.gz RMCJMPHOFFAYNX-PGRDOPGGSA-N 2 0 340.511 4.393 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(F)cc1N(C)C ZINC000183198568 1043040101 /nfs/dbraw/zinc/04/01/01/1043040101.db2.gz FPTWWGJFYBMTKI-YESZJQIVSA-N 2 0 347.522 4.195 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000183185694 1043040303 /nfs/dbraw/zinc/04/03/03/1043040303.db2.gz ILTAOIGWUOPEKF-YQVWRLOYSA-N 2 0 330.516 4.389 20 0 EIADRP CCc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)s1 ZINC000309862456 1043086302 /nfs/dbraw/zinc/08/63/02/1043086302.db2.gz DOIGIMJMPNFNCI-SFHVURJKSA-N 2 0 328.525 4.312 20 0 EIADRP [NH3+]C1(C[NH2+][C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CCCC1 ZINC000665246944 1043221504 /nfs/dbraw/zinc/22/15/04/1043221504.db2.gz RTWIRAJQVYAVTO-CVEARBPZSA-N 2 0 326.406 4.203 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CC2(c3ccc(F)cc3Cl)CCCC2)CC[N@@H+]1C ZINC000427882720 1043247359 /nfs/dbraw/zinc/24/73/59/1043247359.db2.gz ANQQNIRAJHNZNV-ZBFHGGJFSA-N 2 0 338.898 4.363 20 0 EIADRP COc1cccc2cc(C[NH2+]CCCC[N@H+]3C[C@H](C)C[C@H](C)C3)oc21 ZINC000727643565 1043255725 /nfs/dbraw/zinc/25/57/25/1043255725.db2.gz BNHXCXDIECWQRZ-CALCHBBNSA-N 2 0 344.499 4.289 20 0 EIADRP C[C@H](NC1CC[NH+](C2CCCCC2)CC1)[C@@H](c1ccccc1)[NH+](C)C ZINC000186320931 1043268080 /nfs/dbraw/zinc/26/80/80/1043268080.db2.gz HEWLSXITCBHJEJ-AVRDEDQJSA-N 2 0 343.559 4.065 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCCCc3cc(Br)ccc32)CC1 ZINC000338785103 1043272732 /nfs/dbraw/zinc/27/27/32/1043272732.db2.gz ADYSTIJFJYSLNK-GOSISDBHSA-N 2 0 349.316 4.068 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)C1CCSCC1 ZINC000187121231 1043328687 /nfs/dbraw/zinc/32/86/87/1043328687.db2.gz CTKFYEROFMIZAA-HNNXBMFYSA-N 2 0 338.586 4.081 20 0 EIADRP C(CC[NH+]1CCC(CCC[NH+]2CCCC2)CC1)CC1CCOCC1 ZINC000499577735 1043332761 /nfs/dbraw/zinc/33/27/61/1043332761.db2.gz XNXCSFXMNYHAPN-UHFFFAOYSA-N 2 0 336.564 4.171 20 0 EIADRP C[C@H]1CC(Nc2cccc(F)c2C[NH3+])C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168011591 1043335503 /nfs/dbraw/zinc/33/55/03/1043335503.db2.gz PTVVMFCREJZXFP-HOTGVXAUSA-N 2 0 341.474 4.138 20 0 EIADRP Cn1cncc1CCC[N@H+](Cc1ccc(F)cc1F)C1CCCC1 ZINC000520833245 1043395678 /nfs/dbraw/zinc/39/56/78/1043395678.db2.gz RWLDDCHDTLNYRC-UHFFFAOYSA-N 2 0 333.426 4.076 20 0 EIADRP CC[NH+](CC)CCCC[NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1 ZINC001168012058 1043421918 /nfs/dbraw/zinc/42/19/18/1043421918.db2.gz VIRBCXOXTHATHH-WOJBJXKFSA-N 3 0 345.575 4.140 20 0 EIADRP C[C@H]1CC(Nc2ccc(CC[NH3+])cc2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168012383 1043423662 /nfs/dbraw/zinc/42/36/62/1043423662.db2.gz ZHGCVKMRMZVSOY-ROUUACIJSA-N 2 0 337.511 4.041 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000474027738 1043431555 /nfs/dbraw/zinc/43/15/55/1043431555.db2.gz CIQWBZBIJUSQIQ-FQEVSTJZSA-N 2 0 328.500 4.024 20 0 EIADRP CN(c1ccccc1C[N@H+](C)C[C@H]1CC=CCC1)C1CC[NH+](C)CC1 ZINC000542483080 1043478833 /nfs/dbraw/zinc/47/88/33/1043478833.db2.gz VFDJGZRXLWJLNQ-IBGZPJMESA-N 2 0 341.543 4.005 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccnn1-c1ccccc1 ZINC000467363858 1043578770 /nfs/dbraw/zinc/57/87/70/1043578770.db2.gz GPKABMQGQNLWIT-LJQANCHMSA-N 2 0 340.515 4.179 20 0 EIADRP C(=C/C[N@@H+]1CCC[C@H]1c1ccccn1)\C[NH+]1CCC[C@@H]1c1ccccn1 ZINC000674371434 1043647322 /nfs/dbraw/zinc/64/73/22/1043647322.db2.gz QRCNTDULJDXPFL-WKEQBZBWSA-N 2 0 348.494 4.007 20 0 EIADRP CC(C)O[C@@H](C[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000428251061 1043695860 /nfs/dbraw/zinc/69/58/60/1043695860.db2.gz YALIBPCCQYJKHA-RTWAWAEBSA-N 2 0 330.516 4.103 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)[C@@H]1CCCCO1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000681394481 1043733437 /nfs/dbraw/zinc/73/34/37/1043733437.db2.gz SHHQWXJWQPWNHM-JBACZVJFSA-N 2 0 344.543 4.082 20 0 EIADRP c1ccc2c(c1)[nH]c1c2C[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000442644721 1043793541 /nfs/dbraw/zinc/79/35/41/1043793541.db2.gz ICOCXCHUFMEHAZ-LJQANCHMSA-N 2 0 345.490 4.021 20 0 EIADRP Cc1c([C@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)cnn1C(C)C ZINC000191179519 1043793898 /nfs/dbraw/zinc/79/38/98/1043793898.db2.gz CLDQIXNBMIJRJN-KSZLIROESA-N 2 0 334.552 4.181 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccc2c(c1)CCC(C)(C)O2 ZINC000731675798 1043814856 /nfs/dbraw/zinc/81/48/56/1043814856.db2.gz ZWTMRRWDSBFOEK-QGZVFWFLSA-N 2 0 332.532 4.390 20 0 EIADRP c1cc(C[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)co1 ZINC000731678543 1043815809 /nfs/dbraw/zinc/81/58/09/1043815809.db2.gz HKPPBOYMNHNONL-UHFFFAOYSA-N 2 0 326.484 4.104 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000442762948 1043825921 /nfs/dbraw/zinc/82/59/21/1043825921.db2.gz ALTCDVXYEGCYNG-UNEWFSDZSA-N 2 0 328.422 4.271 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000442762938 1043826143 /nfs/dbraw/zinc/82/61/43/1043826143.db2.gz ALTCDVXYEGCYNG-FRFSOERESA-N 2 0 328.422 4.271 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000442793256 1043842969 /nfs/dbraw/zinc/84/29/69/1043842969.db2.gz OAJRERATAJCWEN-DOTOQJQBSA-N 2 0 328.422 4.273 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]Cc3ccc4ncccc4c3)CC2)C1 ZINC000192982781 1043987452 /nfs/dbraw/zinc/98/74/52/1043987452.db2.gz RWWYCQXGMLSRCG-DYESRHJHSA-N 2 0 337.511 4.368 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000675489077 1044360346 /nfs/dbraw/zinc/36/03/46/1044360346.db2.gz FTWITTOWMBUAKI-MOPGFXCFSA-N 2 0 325.500 4.222 20 0 EIADRP C[C@H]1CC(n2cnc3ccc(C[NH3+])cc32)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168020129 1044367944 /nfs/dbraw/zinc/36/79/44/1044367944.db2.gz KQOIHXPYFPWLHH-IRXDYDNUSA-N 2 0 348.494 4.109 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]CCC(C)(C)c2ccccc2)[C@@H](C)C1 ZINC000675770733 1044485859 /nfs/dbraw/zinc/48/58/59/1044485859.db2.gz YLVAVAKSBPVVMV-PZJWPPBQSA-N 2 0 346.559 4.081 20 0 EIADRP C[C@H]([NH2+]CCCOc1ccc(Cl)cc1Cl)C1CC[NH+](C)CC1 ZINC000675787956 1044499330 /nfs/dbraw/zinc/49/93/30/1044499330.db2.gz QSAFZSNELAROLA-ZDUSSCGKSA-N 2 0 345.314 4.082 20 0 EIADRP c1cncc([C@H]([NH2+]C2CC[NH+](CC3CC3)CC2)C2CCCCC2)c1 ZINC000675812143 1044513259 /nfs/dbraw/zinc/51/32/59/1044513259.db2.gz ITUXOHTYBWCQRD-OAQYLSRUSA-N 2 0 327.516 4.167 20 0 EIADRP CCC[C@@H]([NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccccn1 ZINC000675817956 1044515321 /nfs/dbraw/zinc/51/53/21/1044515321.db2.gz ZHIYONBCPOHGQS-DYESRHJHSA-N 2 0 341.499 4.214 20 0 EIADRP CCC[C@@H]([NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccccn1 ZINC000675815273 1044515683 /nfs/dbraw/zinc/51/56/83/1044515683.db2.gz AOJGPKRKCJBZFQ-DYESRHJHSA-N 2 0 341.499 4.214 20 0 EIADRP C[C@@H]([NH2+][C@@H](Cc1ccccc1)c1ccccc1F)C1CC[NH+](C)CC1 ZINC000675898225 1044543201 /nfs/dbraw/zinc/54/32/01/1044543201.db2.gz GLNVENRJTNQFMS-VGSWGCGISA-N 2 0 340.486 4.429 20 0 EIADRP CCC(CC)(C[NH2+][C@H](C)C1CC[NH+](C)CC1)N[C@H](C)c1ccccc1 ZINC000675894941 1044544162 /nfs/dbraw/zinc/54/41/62/1044544162.db2.gz WFGUGAQOFCUOOK-RTBURBONSA-N 2 0 345.575 4.216 20 0 EIADRP c1ccc(C[C@H]([NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)C2CCCCC2)cc1 ZINC000480742557 1044572479 /nfs/dbraw/zinc/57/24/79/1044572479.db2.gz CKUDWWFRSXWQEU-BDTNDASRSA-N 2 0 326.528 4.394 20 0 EIADRP C[C@@H](Cc1cccc(F)c1)[NH2+]C1CC[NH+](C[C@H]2CC=CCC2)CC1 ZINC001168476306 1044626852 /nfs/dbraw/zinc/62/68/52/1044626852.db2.gz SUHQPJAXWBOSHS-ROUUACIJSA-N 2 0 330.491 4.167 20 0 EIADRP COc1ccc2nc(C[NH2+]CCCC[N@@H+]3CCCC[C@H]3C)sc2c1 ZINC000474346091 1044872259 /nfs/dbraw/zinc/87/22/59/1044872259.db2.gz CLGDAFMYVCVCMB-OAHLLOKOSA-N 2 0 347.528 4.049 20 0 EIADRP COC1CCC(CC[NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)CC1 ZINC000543594956 1044879182 /nfs/dbraw/zinc/87/91/82/1044879182.db2.gz KILIBTDAZDLRDC-QXWDQEIOSA-N 2 0 336.564 4.214 20 0 EIADRP CCC(C)(C)c1ccc(C[N@@H+]2CCO[C@@H]3C[C@@H]([NH+](C)C)CC[C@@H]32)cc1 ZINC000509022460 1044944193 /nfs/dbraw/zinc/94/41/93/1044944193.db2.gz PUPVVBJVJQUNND-PCCBWWKXSA-N 2 0 344.543 4.058 20 0 EIADRP CC(C)(C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cccc(C(F)(F)F)c1 ZINC000166464013 1044976272 /nfs/dbraw/zinc/97/62/72/1044976272.db2.gz RPAJFLJHLSUMIE-DLBZAZTESA-N 2 0 340.433 4.199 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000347913510 1044999499 /nfs/dbraw/zinc/99/94/99/1044999499.db2.gz AEMWYYDXMLOGKU-MSOLQXFVSA-N 2 0 340.515 4.096 20 0 EIADRP Clc1ccc(CCCC[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1Cl ZINC000474458782 1045006878 /nfs/dbraw/zinc/00/68/78/1045006878.db2.gz JBKKYJGSBCWODQ-HNNXBMFYSA-N 2 0 341.326 4.390 20 0 EIADRP CCN1CCC([NH2+][C@H](Cc2ccccc2F)c2ccccc2)CC1 ZINC000429367101 1045023480 /nfs/dbraw/zinc/02/34/80/1045023480.db2.gz AQXULPYJTBGBDZ-OAQYLSRUSA-N 2 0 326.459 4.183 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cn2ccc(=S)c3ccccc32)CC1 ZINC000738091388 1045031716 /nfs/dbraw/zinc/03/17/16/1045031716.db2.gz YMZFBAMZSSZTMY-UHFFFAOYSA-N 2 0 343.540 4.380 20 0 EIADRP COC1(C[C@H](C)[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CCC1 ZINC000429443343 1045143210 /nfs/dbraw/zinc/14/32/10/1045143210.db2.gz CQKFREACEJJMMX-ZJOUEHCJSA-N 2 0 344.543 4.224 20 0 EIADRP CCN(Cc1ccn(C2CCCC2)n1)Cc1ccc(C[NH+](C)C)cc1 ZINC000626062954 1045165321 /nfs/dbraw/zinc/16/53/21/1045165321.db2.gz MKTVLMVRHVQLKE-UHFFFAOYSA-N 2 0 340.515 4.082 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2scnc2C2CC2)c1 ZINC000486991669 1045221149 /nfs/dbraw/zinc/22/11/49/1045221149.db2.gz XONGLYAXZBZSJP-UHFFFAOYSA-N 2 0 329.513 4.151 20 0 EIADRP C[C@@H]([NH2+]CC1(c2cccc(C(F)(F)F)c2)CC1)C1CC[NH+](C)CC1 ZINC000161628196 1045304291 /nfs/dbraw/zinc/30/42/91/1045304291.db2.gz UPDIQHPRQICKSK-CQSZACIVSA-N 2 0 340.433 4.057 20 0 EIADRP Cl/C=C(\Cl)C[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000762926568 1045416874 /nfs/dbraw/zinc/41/68/74/1045416874.db2.gz LENOOGVQPKXRCY-ATVHPVEESA-N 2 0 339.310 4.294 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc(F)cc1 ZINC000397502247 1045586532 /nfs/dbraw/zinc/58/65/32/1045586532.db2.gz ADQMEQXQKONREJ-QGZVFWFLSA-N 2 0 326.459 4.389 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1cccc(F)c1 ZINC000397545091 1045631263 /nfs/dbraw/zinc/63/12/63/1045631263.db2.gz NRXJFCMXBKBHHQ-QGZVFWFLSA-N 2 0 326.459 4.389 20 0 EIADRP CC(C)[C@H](C[NH2+][C@@H](CC(C)(C)C)c1ccccc1)N1CC[NH+](C)CC1 ZINC000326429354 1045809327 /nfs/dbraw/zinc/80/93/27/1045809327.db2.gz VTYJDEZPQXGTRD-SFTDATJTSA-N 2 0 345.575 4.026 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+]C2CC(C(F)F)C2)C1 ZINC000768679854 1045826934 /nfs/dbraw/zinc/82/69/34/1045826934.db2.gz XLRCIWNEGNLHQD-QAQJPARQSA-N 2 0 336.470 4.298 20 0 EIADRP FC1(F)CCCC[C@H]1C[N@@H+]1CC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001170206011 1045925070 /nfs/dbraw/zinc/92/50/70/1045925070.db2.gz QGMUZIFQPJXYFS-VQTJNVASSA-N 2 0 348.481 4.410 20 0 EIADRP CCCCCC[N@H+](C)CC(=O)Nc1cc(C[NH+]2CCCC2)ccc1C ZINC000769364354 1045937431 /nfs/dbraw/zinc/93/74/31/1045937431.db2.gz DFMBOEJZWVRTSI-UHFFFAOYSA-N 2 0 345.531 4.041 20 0 EIADRP CC[C@@H]1C[C@@H]([N@H+]2C[C@H]3c4ccccc4[C@H]([NH+](C)C(C)C)[C@H]3C2)CCO1 ZINC001170222649 1045949638 /nfs/dbraw/zinc/94/96/38/1045949638.db2.gz OMOUBGBLPIMZCG-OHJZQYHNSA-N 2 0 342.527 4.055 20 0 EIADRP Cc1oc(-c2ccccc2)nc1C[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000123386087 1045993316 /nfs/dbraw/zinc/99/33/16/1045993316.db2.gz PPMUBTUTAGLARC-UHFFFAOYSA-N 2 0 341.499 4.204 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](C)[C@H](C)c2nc3ccccc3s2)CC1 ZINC000161622181 1046012446 /nfs/dbraw/zinc/01/24/46/1046012446.db2.gz AGSKNECYPUYYIX-GJZGRUSLSA-N 2 0 331.529 4.252 20 0 EIADRP C[NH2+]CCC1CC[NH+](Cc2nc(C)c(-c3ccc(Cl)cc3)o2)CC1 ZINC000262003690 1046173705 /nfs/dbraw/zinc/17/37/05/1046173705.db2.gz QMXHPTRUTUIFTI-UHFFFAOYSA-N 2 0 347.890 4.125 20 0 EIADRP COc1ccccc1[C@H](C)[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000125472065 1046310411 /nfs/dbraw/zinc/31/04/11/1046310411.db2.gz NHVSZNSNJFRDPB-INIZCTEOSA-N 2 0 344.524 4.320 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c(C)c1 ZINC000162576506 1046357097 /nfs/dbraw/zinc/35/70/97/1046357097.db2.gz ZGONKUFTNVWJIC-SFHVURJKSA-N 2 0 326.484 4.095 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@@H]1Cc1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508709191 1046358225 /nfs/dbraw/zinc/35/82/25/1046358225.db2.gz GMDXFVKHFKIQPO-FDTGPBLFSA-N 2 0 334.507 4.118 20 0 EIADRP C[C@@H]([NH2+]CCc1cc(F)cc(F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508712201 1046370131 /nfs/dbraw/zinc/37/01/31/1046370131.db2.gz CHGFJHWTZUOCLR-VQIMIIECSA-N 2 0 344.449 4.008 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)cc1OCC ZINC000125985333 1046407365 /nfs/dbraw/zinc/40/73/65/1046407365.db2.gz VVTYGTIODRYDLR-ROUUACIJSA-N 2 0 348.531 4.255 20 0 EIADRP C[NH+]1C(C)(C)CC(Nc2cc(C[NH+]3CCCCC3)ccn2)CC1(C)C ZINC001170452508 1046523309 /nfs/dbraw/zinc/52/33/09/1046523309.db2.gz AGCHZUKZPKOIPI-UHFFFAOYSA-N 2 0 344.547 4.131 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@H]2CCCN(Cc3cccs3)C2)cc1 ZINC000126875989 1046576864 /nfs/dbraw/zinc/57/68/64/1046576864.db2.gz BGHQYWRUORUJCS-DLBZAZTESA-N 2 0 344.524 4.320 20 0 EIADRP COc1ccc2cc(C[N@@H+]3CCC[C@@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000536659492 1046606933 /nfs/dbraw/zinc/60/69/33/1046606933.db2.gz IHFCBYNRXBMBLV-OAQYLSRUSA-N 2 0 338.495 4.299 20 0 EIADRP c1ccc(C[C@@H]2CCC[C@@H]2[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459436209 1046645498 /nfs/dbraw/zinc/64/54/98/1046645498.db2.gz QESRFYDVWIHMEQ-UGKGYDQZSA-N 2 0 335.495 4.051 20 0 EIADRP Cc1cc([C@@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)C2CC2)ccc1F ZINC000459445965 1046679136 /nfs/dbraw/zinc/67/91/36/1046679136.db2.gz TVSFZBZYDCSETJ-NRFANRHFSA-N 2 0 339.458 4.239 20 0 EIADRP C[C@@H]1C[C@@H](NCc2cc(F)ccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000379624355 1046713769 /nfs/dbraw/zinc/71/37/69/1046713769.db2.gz JPDRXTPSILBZSN-BEFAXECRSA-N 2 0 330.422 4.108 20 0 EIADRP Cc1nccn1CCC[N@H+](CCc1cccc(F)c1)C1CCCC1 ZINC000536730377 1046727807 /nfs/dbraw/zinc/72/78/07/1046727807.db2.gz BTTIKDVYURVHGD-UHFFFAOYSA-N 2 0 329.463 4.208 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3ccccc3C2)CCN1Cc1ccccc1 ZINC000379647795 1046741638 /nfs/dbraw/zinc/74/16/38/1046741638.db2.gz LDHKQHFRDZSORX-SXSPYAJSSA-N 2 0 334.507 4.187 20 0 EIADRP Clc1ccc(CCCC[NH2+]C2CCN(c3cc[nH+]cc3)CC2)s1 ZINC000459524591 1046753986 /nfs/dbraw/zinc/75/39/86/1046753986.db2.gz MCKXMUMZYMVEKD-UHFFFAOYSA-N 2 0 349.931 4.378 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cc1 ZINC000536833504 1046809730 /nfs/dbraw/zinc/80/97/30/1046809730.db2.gz PTOCXSMJNMKQNP-QRVBRYPASA-N 2 0 332.532 4.145 20 0 EIADRP Cc1c2ccccc2oc1[C@H](C)[NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1 ZINC000536860646 1046828381 /nfs/dbraw/zinc/82/83/81/1046828381.db2.gz ZWJDLMMTJZEWTK-BQFCYCMXSA-N 2 0 344.499 4.281 20 0 EIADRP C[C@H](CCCc1cccnc1)[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1 ZINC000459642450 1046831341 /nfs/dbraw/zinc/83/13/41/1046831341.db2.gz BTDVTYIXKYFIQK-JQVVWYNYSA-N 2 0 343.559 4.426 20 0 EIADRP CC(C)[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(F)cn1 ZINC000497526210 1046841407 /nfs/dbraw/zinc/84/14/07/1046841407.db2.gz RMSNEBYZNXYUJR-NRFANRHFSA-N 2 0 341.474 4.303 20 0 EIADRP COc1ccc(C2CCC([NH2+]CC[C@H]3CCC[N@H+](C)C3)CC2)cc1 ZINC000459725079 1046865975 /nfs/dbraw/zinc/86/59/75/1046865975.db2.gz AYOLLYISDSTCGB-PGYGNJIDSA-N 2 0 330.516 4.043 20 0 EIADRP C[N@@H+]1CCC[C@@H](CC[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)C1 ZINC000459790963 1046891502 /nfs/dbraw/zinc/89/15/02/1046891502.db2.gz RECVULUJFYGGDU-AWEZNQCLSA-N 2 0 349.931 4.285 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)CC1 ZINC000497820980 1047104857 /nfs/dbraw/zinc/10/48/57/1047104857.db2.gz GPZOPFJQWWPWFQ-OAQYLSRUSA-N 2 0 330.491 4.473 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@H]2CCc3ccc(Cl)nc32)C1 ZINC000788538617 1047216997 /nfs/dbraw/zinc/21/69/97/1047216997.db2.gz HZVLETKVVVJAOJ-INMHGKMJSA-N 2 0 335.923 4.070 20 0 EIADRP C[C@@H]([NH2+]CCCCCCC[NH+]1CCCC1)c1cn2ccccc2n1 ZINC000788595673 1047244310 /nfs/dbraw/zinc/24/43/10/1047244310.db2.gz USDTUAULNZJGHD-GOSISDBHSA-N 2 0 328.504 4.031 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)C1 ZINC000129221526 1047335128 /nfs/dbraw/zinc/33/51/28/1047335128.db2.gz ZUGZYLZXYNWOIS-MSOLQXFVSA-N 2 0 340.433 4.493 20 0 EIADRP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000129754995 1047500750 /nfs/dbraw/zinc/50/07/50/1047500750.db2.gz ZVDGAYLDCXNRIA-XLIONFOSSA-N 2 0 340.511 4.287 20 0 EIADRP C[C@H]([NH2+][C@@H](c1ccncc1)C1CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000898322421 1047614151 /nfs/dbraw/zinc/61/41/51/1047614151.db2.gz KZRGPLZIMLCPAU-BULFRSBZSA-N 2 0 335.495 4.033 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cccc(C2CC2)c1 ZINC000550622184 1047777711 /nfs/dbraw/zinc/77/77/11/1047777711.db2.gz IWXZAMYJUYWRKS-QGZVFWFLSA-N 2 0 338.495 4.355 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cccc(C2CC2)c1 ZINC000550629447 1047782382 /nfs/dbraw/zinc/78/23/82/1047782382.db2.gz QVJGVMBURCECDX-KURKYZTESA-N 2 0 330.516 4.104 20 0 EIADRP C[C@H](C[NH2+][C@H]1CCN(C)[C@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000550665021 1047810240 /nfs/dbraw/zinc/81/02/40/1047810240.db2.gz CMRGHDSDGSEBPD-YWMUFLPLSA-N 2 0 344.449 4.493 20 0 EIADRP CCCC[NH+]1CCC([N@H+](C)[C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171058831 1047882034 /nfs/dbraw/zinc/88/20/34/1047882034.db2.gz LVMLFHUDLQKYRA-GOSISDBHSA-N 2 0 334.935 4.394 20 0 EIADRP C[N@@H+]1CCC[C@@H](CC[NH2+][C@H]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001171064630 1047923661 /nfs/dbraw/zinc/92/36/61/1047923661.db2.gz SFSZBVLJPHMJNX-BBRMVZONSA-N 2 0 341.326 4.172 20 0 EIADRP C[NH+](C)CCC(C)(C)[NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171066488 1047946814 /nfs/dbraw/zinc/94/68/14/1047946814.db2.gz OAEHFUWYYBXDFN-CQSZACIVSA-N 2 0 329.315 4.171 20 0 EIADRP [NH3+]CCCCCCC[NH2+][C@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171067188 1047961725 /nfs/dbraw/zinc/96/17/25/1047961725.db2.gz UDBXHJLQKIGBEJ-HNNXBMFYSA-N 2 0 329.315 4.350 20 0 EIADRP CN1CCC([N@H+](C)Cc2ccc3ccc(-c4ccccc4)nc3c2)CC1 ZINC001136943362 1047967918 /nfs/dbraw/zinc/96/79/18/1047967918.db2.gz DMIGDXQEYVXLSQ-UHFFFAOYSA-N 2 0 345.490 4.428 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](CC[C@H](O)c2ccccc2)CC1 ZINC000808734391 1048094287 /nfs/dbraw/zinc/09/42/87/1048094287.db2.gz VAPVNPFNPWHYNX-KNQAVFIVSA-N 2 0 344.543 4.087 20 0 EIADRP C[NH+](C)CC1CC[NH+](Cc2ccc(C(F)(F)F)c(Cl)c2)CC1 ZINC001143808383 1048202103 /nfs/dbraw/zinc/20/21/03/1048202103.db2.gz XZDNYXXCHRIEOF-UHFFFAOYSA-N 2 0 334.813 4.132 20 0 EIADRP C[NH+](C)CCCCC(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000556937903 1048257978 /nfs/dbraw/zinc/25/79/78/1048257978.db2.gz CBVMTXYHZKCQDV-UHFFFAOYSA-N 2 0 345.531 4.122 20 0 EIADRP CC(C)CSCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499194644 1048394781 /nfs/dbraw/zinc/39/47/81/1048394781.db2.gz SCPHGIWHVNKROO-ACDBMABISA-N 2 0 332.557 4.161 20 0 EIADRP CCc1cc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)cc(CC)c1O ZINC001144148188 1048458925 /nfs/dbraw/zinc/45/89/25/1048458925.db2.gz OGDIBDRPAHZHRU-UHFFFAOYSA-N 2 0 332.532 4.069 20 0 EIADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCc3cc(Cl)c(Cl)cc3C2)C1 ZINC001171149488 1048482004 /nfs/dbraw/zinc/48/20/04/1048482004.db2.gz WOBJQIPDRAGXTI-ARFHVFGLSA-N 2 0 341.326 4.313 20 0 EIADRP [NH3+]CCCCCCC[NH2+][C@@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171147744 1048482981 /nfs/dbraw/zinc/48/29/81/1048482981.db2.gz JWLZRQDHGOQAAS-OAHLLOKOSA-N 2 0 329.315 4.350 20 0 EIADRP Cc1cccc(-c2n[nH]cc2C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)c1 ZINC000809738172 1048510027 /nfs/dbraw/zinc/51/00/27/1048510027.db2.gz SHFBDUDNICXYPQ-UHFFFAOYSA-N 2 0 348.494 4.079 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)c(F)c1 ZINC000844907794 1048542722 /nfs/dbraw/zinc/54/27/22/1048542722.db2.gz NAYRXCLPGHNCCH-UHFFFAOYSA-N 2 0 346.755 4.246 20 0 EIADRP COc1c(C)cc([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)cc1Cl ZINC000844923121 1048549573 /nfs/dbraw/zinc/54/95/73/1048549573.db2.gz HAXJSGJBUMYTDN-GFCCVEGCSA-N 2 0 336.838 4.106 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1cc(Cl)c(N)c(Cl)c1 ZINC000815647267 1048570030 /nfs/dbraw/zinc/57/00/30/1048570030.db2.gz DQTMIUNNXXYEAN-ZDUSSCGKSA-N 2 0 344.330 4.492 20 0 EIADRP C[N@H+](CC1CC[NH+](C)CC1)[C@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171163041 1048600489 /nfs/dbraw/zinc/60/04/89/1048600489.db2.gz MFYPSUXROBIXCN-INIZCTEOSA-N 2 0 341.326 4.124 20 0 EIADRP Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3ccc([C@H]4CC[N@H+](C)C4)cc3)c2c1 ZINC001171167780 1048614809 /nfs/dbraw/zinc/61/48/09/1048614809.db2.gz MQQKKLQDVXNWPC-HKUYNNGSSA-N 2 0 347.506 4.248 20 0 EIADRP CCCCCC[C@@H](CC)[N@H+]1CCc2ncc(C[NH+]3CCCC3)n2CC1 ZINC001170598324 1048659963 /nfs/dbraw/zinc/65/99/63/1048659963.db2.gz GYHLANQZVWOCSW-LJQANCHMSA-N 2 0 346.563 4.086 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c2ccccc21 ZINC000817912506 1049060002 /nfs/dbraw/zinc/06/00/02/1049060002.db2.gz VHKANXZUNWIEED-BZDYGPBWSA-N 2 0 334.463 4.080 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccccc1OC(F)F ZINC000817949196 1049064821 /nfs/dbraw/zinc/06/48/21/1049064821.db2.gz NNUYNZZFIWRKTC-QGZVFWFLSA-N 2 0 334.410 4.030 20 0 EIADRP COc1ccc2cc([C@H](C)[NH2+]Cc3ccc(CC[NH3+])cc3)ccc2c1 ZINC000817946938 1049065020 /nfs/dbraw/zinc/06/50/20/1049065020.db2.gz IHOCENAFFAVKRR-INIZCTEOSA-N 2 0 334.463 4.200 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cc(F)c(Cl)cc1Cl ZINC000817947183 1049065269 /nfs/dbraw/zinc/06/52/69/1049065269.db2.gz MIZSYVQKVBDJQX-LLVKDONJSA-N 2 0 341.257 4.485 20 0 EIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cnn(-c2ccccc2)c1 ZINC000817982284 1049077705 /nfs/dbraw/zinc/07/77/05/1049077705.db2.gz QWRZERFNXDURNX-DYESRHJHSA-N 2 0 334.467 4.003 20 0 EIADRP C[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(SC(F)F)cc1 ZINC000817985560 1049078997 /nfs/dbraw/zinc/07/89/97/1049078997.db2.gz LZGZADYPRXRFBX-OCCSQVGLSA-N 2 0 326.456 4.327 20 0 EIADRP CC(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cccc(Cl)c2C1 ZINC001170916752 1049216777 /nfs/dbraw/zinc/21/67/77/1049216777.db2.gz PEJQYIPSDZAWRY-KZNAEPCWSA-N 2 0 334.935 4.425 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]C[C@H](O)c1cccc2ccccc21 ZINC000818959515 1049227116 /nfs/dbraw/zinc/22/71/16/1049227116.db2.gz NCSDLOIGDCRBRU-AVRDEDQJSA-N 2 0 340.511 4.117 20 0 EIADRP CCc1cc(N([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)cc[nH+]1 ZINC001170647443 1049314582 /nfs/dbraw/zinc/31/45/82/1049314582.db2.gz LVIRYHMZRVMORW-JFHVBQFUSA-N 2 0 335.495 4.276 20 0 EIADRP Fc1cc(F)c2c(c1)CC[C@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)C2 ZINC001170678389 1049502447 /nfs/dbraw/zinc/50/24/47/1049502447.db2.gz YHOGXBZUTLPUAX-SFHVURJKSA-N 2 0 348.481 4.209 20 0 EIADRP CCC(CC)[NH+]1CCC([NH2+][C@@H]2CCc3c(F)cc(F)cc3C2)CC1 ZINC001171352826 1049505732 /nfs/dbraw/zinc/50/57/32/1049505732.db2.gz BRRWRHQFBYFOGM-QGZVFWFLSA-N 2 0 336.470 4.065 20 0 EIADRP Fc1cc(F)c2c(c1)C[C@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CC2 ZINC001171353227 1049509062 /nfs/dbraw/zinc/50/90/62/1049509062.db2.gz FOJVKMLDZUMMSZ-GOSISDBHSA-N 2 0 348.481 4.209 20 0 EIADRP Oc1ccc2c(c1)[C@@H]([NH2+]C1CCC([NH+]3CCCCC3)CC1)CCC2 ZINC000812720544 1049548565 /nfs/dbraw/zinc/54/85/65/1049548565.db2.gz KGNAHYBHYXNDPB-NGICGMGXSA-N 2 0 328.500 4.156 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1OCC1CC1)c1cccc(C[NH+](C)C)c1 ZINC000820811761 1049554888 /nfs/dbraw/zinc/55/48/88/1049554888.db2.gz VWUHBQBJTXBKPG-QGZVFWFLSA-N 2 0 338.495 4.388 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1cccc(C[NH+](C)C)c1 ZINC000820823173 1049558713 /nfs/dbraw/zinc/55/87/13/1049558713.db2.gz LZRMGYLOEKIMBY-YLJYHZDGSA-N 2 0 330.516 4.281 20 0 EIADRP C[C@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1cccc(C[NH+](C)C)c1 ZINC000820840692 1049566363 /nfs/dbraw/zinc/56/63/63/1049566363.db2.gz ATPLEVUKKPRDEW-LIRRHRJNSA-N 2 0 328.431 4.062 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CCc4ccccc4OC3)CC2)C1 ZINC000511008215 1049619967 /nfs/dbraw/zinc/61/99/67/1049619967.db2.gz AGORKKOLRAOQTB-UIFIKXQLSA-N 2 0 342.527 4.013 20 0 EIADRP CCC(CC)[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2c(F)cccc2C1 ZINC001171414155 1049644602 /nfs/dbraw/zinc/64/46/02/1049644602.db2.gz NQKOXKYZILIEFM-WDSOQIARSA-N 2 0 332.507 4.444 20 0 EIADRP Fc1cccc2c1CC[C@H]([NH2+]CC1CC[NH+](CC3CCCC3)CC1)C2 ZINC001171411628 1049645134 /nfs/dbraw/zinc/64/51/34/1049645134.db2.gz KSZBYDDPVNGYGS-FQEVSTJZSA-N 2 0 344.518 4.175 20 0 EIADRP FC1(F)CCC[C@@H]([NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)C1 ZINC000716629316 1049702036 /nfs/dbraw/zinc/70/20/36/1049702036.db2.gz YFYJBWDGYJSGDB-RDGPPVDQSA-N 2 0 334.454 4.207 20 0 EIADRP Fc1cc(F)c2c(c1)CC[C@@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001170701564 1049736568 /nfs/dbraw/zinc/73/65/68/1049736568.db2.gz PQEJIBXULGSKRW-RTBURBONSA-N 2 0 348.481 4.163 20 0 EIADRP Fc1cc(F)c2c(c1)CC[C@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001170701562 1049737189 /nfs/dbraw/zinc/73/71/89/1049737189.db2.gz PQEJIBXULGSKRW-OALUTQOASA-N 2 0 348.481 4.163 20 0 EIADRP Fc1cc(F)c2c(c1)CC[C@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001170701561 1049737601 /nfs/dbraw/zinc/73/76/01/1049737601.db2.gz PQEJIBXULGSKRW-MOPGFXCFSA-N 2 0 348.481 4.163 20 0 EIADRP Cc1cccc2c1CC[C@H]([NH2+]C[C@H]1CCC[N@H+](Cc3ccccc3)C1)C2 ZINC001171551554 1049753913 /nfs/dbraw/zinc/75/39/13/1049753913.db2.gz QEMPQVNZFGECDU-GGAORHGYSA-N 2 0 348.534 4.354 20 0 EIADRP Cc1cccc2c1CC[C@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001171570848 1049758183 /nfs/dbraw/zinc/75/81/83/1049758183.db2.gz PAUANLCZQMZWKG-RTWAWAEBSA-N 2 0 326.528 4.193 20 0 EIADRP Cc1cccc2c1CC[C@@H]([NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C)C2 ZINC001171573119 1049760366 /nfs/dbraw/zinc/76/03/66/1049760366.db2.gz GNFQTFOEDBDFRO-PCCBWWKXSA-N 2 0 326.528 4.191 20 0 EIADRP COc1cccc(CC2([NH2+]C3CC(C)(C)[NH+](C)C(C)(C)C3)CCC2)c1 ZINC001171630592 1049761359 /nfs/dbraw/zinc/76/13/59/1049761359.db2.gz QTYMGRUOHUGKFQ-UHFFFAOYSA-N 2 0 344.543 4.401 20 0 EIADRP C[NH+]1C(C)(C)CC(N(CC[NH3+])c2cccc3ccccc32)CC1(C)C ZINC001171614237 1049765587 /nfs/dbraw/zinc/76/55/87/1049765587.db2.gz VPWXAKMXGXXILX-UHFFFAOYSA-N 2 0 339.527 4.256 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1OC ZINC001171619819 1049766862 /nfs/dbraw/zinc/76/68/62/1049766862.db2.gz RJVUYSHNLKYFHE-CQSZACIVSA-N 2 0 334.504 4.006 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CCc2ccccc2C(F)(F)F)CC1(C)C ZINC001171624278 1049768594 /nfs/dbraw/zinc/76/85/94/1049768594.db2.gz NOYBRJFLEUHUAA-UHFFFAOYSA-N 2 0 342.449 4.489 20 0 EIADRP COc1ccc(C2([NH2+]C3CC(C)(C)[NH+](C)C(C)(C)C3)CCC2)cc1 ZINC001171627376 1049769519 /nfs/dbraw/zinc/76/95/19/1049769519.db2.gz RIZPXPYWWAPMMT-UHFFFAOYSA-N 2 0 330.516 4.315 20 0 EIADRP COc1ccc2c(c1)C[N@H+](C1CC(C)(C)[NH+](C)C(C)(C)C1)CCC2 ZINC001171641683 1049778512 /nfs/dbraw/zinc/77/85/12/1049778512.db2.gz SZBRQGPZPFDDJM-UHFFFAOYSA-N 2 0 330.516 4.095 20 0 EIADRP C[C@@H](c1ccccc1)[NH+]1CCN(C2CC(C)(C)[NH+](C)C(C)(C)C2)CC1 ZINC001171639229 1049779622 /nfs/dbraw/zinc/77/96/22/1049779622.db2.gz AEHFPOUTWHWTAK-SFHVURJKSA-N 2 0 343.559 4.017 20 0 EIADRP C[NH+]1C(C)(C)CC([NH+]2CCC(Oc3cccc(F)c3)CC2)CC1(C)C ZINC001171637863 1049779709 /nfs/dbraw/zinc/77/97/09/1049779709.db2.gz QLHDQTYTWOSXHY-UHFFFAOYSA-N 2 0 348.506 4.320 20 0 EIADRP Cc1cccc(OC2CC[NH+](C3CC(C)(C)[NH+](C)C(C)(C)C3)CC2)c1 ZINC001171642258 1049779989 /nfs/dbraw/zinc/77/99/89/1049779989.db2.gz IBKBFPRWCWEHSB-UHFFFAOYSA-N 2 0 344.543 4.490 20 0 EIADRP Cc1cc2cc(C[NH3+])ccc2n1[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171727136 1049785104 /nfs/dbraw/zinc/78/51/04/1049785104.db2.gz QCDLNLPDTIOJRR-KKSFZXQISA-N 2 0 333.479 4.244 20 0 EIADRP C[C@H]([NH3+])c1cn([C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171740728 1049801539 /nfs/dbraw/zinc/80/15/39/1049801539.db2.gz LEFBZQQWOYYPFO-JENIJYKNSA-N 2 0 333.479 4.497 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCC[NH+]1CCCC1 ZINC001171958900 1049822148 /nfs/dbraw/zinc/82/21/48/1049822148.db2.gz LBIQYOOJHCVYRB-HNNXBMFYSA-N 2 0 328.422 4.102 20 0 EIADRP CC(C)[N@@H+]1CC[C@H]([NH2+][C@H](C)Cc2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC001171961721 1049825731 /nfs/dbraw/zinc/82/57/31/1049825731.db2.gz BGGPRKUOGFDREG-RKVPGOIHSA-N 2 0 342.449 4.345 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[N@@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001171966412 1049826454 /nfs/dbraw/zinc/82/64/54/1049826454.db2.gz VBEFQJBELLSBHQ-WBVHZDCISA-N 2 0 342.449 4.477 20 0 EIADRP CCCC[N@H+](CC)CCN[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171967844 1049828041 /nfs/dbraw/zinc/82/80/41/1049828041.db2.gz NOUADJDYHAGQCJ-NRFANRHFSA-N 2 0 345.575 4.141 20 0 EIADRP C[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001171966607 1049828339 /nfs/dbraw/zinc/82/83/39/1049828339.db2.gz WNWPVDUTYYFGRT-XOKHGSTOSA-N 2 0 328.422 4.099 20 0 EIADRP CC(C)[NH+](CCN[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)C(C)C ZINC001171969095 1049833884 /nfs/dbraw/zinc/83/38/84/1049833884.db2.gz TUKRJUZSORFGIB-OAQYLSRUSA-N 2 0 345.575 4.138 20 0 EIADRP CC1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC(F)(F)C1 ZINC001171970619 1049834428 /nfs/dbraw/zinc/83/44/28/1049834428.db2.gz DQRYNWZWIKRYBA-QGZVFWFLSA-N 2 0 336.470 4.455 20 0 EIADRP CC1(C)C[C@@H](n2nc(C[NH3+])c3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC001171973399 1049835907 /nfs/dbraw/zinc/83/59/07/1049835907.db2.gz YMRCMNORKMWCGW-SFHVURJKSA-N 2 0 348.494 4.111 20 0 EIADRP CCCC[NH+]1CCC([N@H+](C)[C@@H]2CCc3cc(F)cc(F)c3C2)CC1 ZINC001170717254 1049839000 /nfs/dbraw/zinc/83/90/00/1049839000.db2.gz URWWURVVBLBJFN-GOSISDBHSA-N 2 0 336.470 4.018 20 0 EIADRP Cc1cc2c(cn1)[C@H]([NH2+][C@H]1CC[N@H+](Cc3ccccc3)C(C)(C)C1)CC2 ZINC001171980593 1049839081 /nfs/dbraw/zinc/83/90/81/1049839081.db2.gz RTFVZJFWPPLRQZ-RBBKRZOGSA-N 2 0 349.522 4.410 20 0 EIADRP CC1(C)C[C@@H](Nc2cccc(CC[NH3+])c2)CC[N@@H+]1Cc1ccccc1 ZINC001171979058 1049839093 /nfs/dbraw/zinc/83/90/93/1049839093.db2.gz KVTTVQUTANDYLM-NRFANRHFSA-N 2 0 337.511 4.043 20 0 EIADRP CC(C)OC1CC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171980382 1049839245 /nfs/dbraw/zinc/83/92/45/1049839245.db2.gz DZYYRLCIRDPVHH-FQEVSTJZSA-N 2 0 344.543 4.319 20 0 EIADRP CC1(C)C[C@H]([NH2+]CC2CCSCC2)CC[N@@H+]1Cc1ccccc1 ZINC001171981224 1049839311 /nfs/dbraw/zinc/83/93/11/1049839311.db2.gz ZSNBOCLLDLQNOK-LJQANCHMSA-N 2 0 332.557 4.162 20 0 EIADRP CC1(C)C[C@@H]([NH+]2CC[C@H](c3cccnc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171985388 1049839849 /nfs/dbraw/zinc/83/98/49/1049839849.db2.gz WAWRLKIWNLBWIJ-VXKWHMMOSA-N 2 0 349.522 4.314 20 0 EIADRP C[NH2+]Cc1ccc(N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC001172072165 1049844021 /nfs/dbraw/zinc/84/40/21/1049844021.db2.gz HTMBRPPMARGUSW-NUNAXRQHSA-N 2 0 349.522 4.404 20 0 EIADRP Cc1ccnc(CC[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172073441 1049844076 /nfs/dbraw/zinc/84/40/76/1049844076.db2.gz QYQZTXKQRYITSZ-WBDAEOGXSA-N 2 0 349.522 4.108 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]CCCc2ccccn2)C3)cc1 ZINC001172074493 1049844330 /nfs/dbraw/zinc/84/43/30/1049844330.db2.gz VZZQPWWXDFVICF-NUNAXRQHSA-N 2 0 349.522 4.190 20 0 EIADRP CS[C@@H]1CCC[C@@H]([NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC000245738960 1049844681 /nfs/dbraw/zinc/84/46/81/1049844681.db2.gz RFUHKMZCLCDMOQ-YMQHIKHWSA-N 2 0 344.568 4.446 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CCc3c(Cl)cccc3C2)cc1 ZINC001171017804 1049846575 /nfs/dbraw/zinc/84/65/75/1049846575.db2.gz LKGBOHPKNHXGQJ-GOSISDBHSA-N 2 0 328.887 4.049 20 0 EIADRP CO[C@H]1CCC[C@@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172079703 1049846527 /nfs/dbraw/zinc/84/65/27/1049846527.db2.gz PNLAWCDBHLJPNS-YXIAPDDASA-N 2 0 342.527 4.119 20 0 EIADRP C[C@H](N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccn1 ZINC001172062340 1049850125 /nfs/dbraw/zinc/85/01/25/1049850125.db2.gz NELUWNOIFSTXJW-ZIBCJSCZSA-N 2 0 335.495 4.318 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC(c1ccccc1)c1ccccc1)C2 ZINC001172101361 1049850156 /nfs/dbraw/zinc/85/01/56/1049850156.db2.gz ZHQAVWTVTQJPKF-KOUNCHBCSA-N 2 0 334.507 4.423 20 0 EIADRP Cc1ncccc1CN[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172062005 1049850339 /nfs/dbraw/zinc/85/03/39/1049850339.db2.gz KQSLYPZDXVNEIY-KOUNCHBCSA-N 2 0 335.495 4.065 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+][C@H]1CCc3ccc(Br)cc31)C2 ZINC001172100725 1049850476 /nfs/dbraw/zinc/85/04/76/1049850476.db2.gz SAJLWFITLYEEDK-DFGXFYAUSA-N 2 0 349.316 4.041 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+]C2CCSCC2)C3)cc1 ZINC001172066168 1049850847 /nfs/dbraw/zinc/85/08/47/1049850847.db2.gz UMJWVUCPADZOCV-ACDBMABISA-N 2 0 330.541 4.057 20 0 EIADRP Cc1ccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)n1C ZINC001172063935 1049851705 /nfs/dbraw/zinc/85/17/05/1049851705.db2.gz FCVXAMZXCIUHEX-WKCHPHFGSA-N 2 0 337.511 4.009 20 0 EIADRP c1csc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172068445 1049853711 /nfs/dbraw/zinc/85/37/11/1049853711.db2.gz QUDDMHQPDZYSJR-LDLYASANSA-N 2 0 326.509 4.423 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)N2C)c1ccccc1C(F)(F)F ZINC001172109210 1049856964 /nfs/dbraw/zinc/85/69/64/1049856964.db2.gz IFDAJTRZXYREGR-ZQDZILKHSA-N 2 0 326.406 4.371 20 0 EIADRP Cc1ccc2c(C[C@H](C)[NH3+])cn([C@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4C)c2c1 ZINC001172113278 1049858014 /nfs/dbraw/zinc/85/80/14/1049858014.db2.gz BTLIXCVKTDMHAZ-GDAAHCPNSA-N 2 0 325.500 4.027 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1cccc(OC3CCCC3)c1)C2 ZINC001172117854 1049858299 /nfs/dbraw/zinc/85/82/99/1049858299.db2.gz NOQCVCUBCZNJOV-LDLYASANSA-N 2 0 328.500 4.113 20 0 EIADRP c1ccc2c(c1)C[C@@H]([NH2+]C1CC[NH+](C[C@@H]3CC=CCC3)CC1)CS2 ZINC001172194598 1049868404 /nfs/dbraw/zinc/86/84/04/1049868404.db2.gz VMPIFZKLXLKWKE-YLJYHZDGSA-N 2 0 342.552 4.114 20 0 EIADRP c1ccc2c(c1)C[C@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CS2 ZINC001172193924 1049868879 /nfs/dbraw/zinc/86/88/79/1049868879.db2.gz PLNLUEOTEJJYAD-FQEVSTJZSA-N 2 0 338.520 4.089 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CC2)[C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171030500 1049875434 /nfs/dbraw/zinc/87/54/34/1049875434.db2.gz MEGFNTRBVUJQJA-BZSNNMDCSA-N 2 0 332.919 4.179 20 0 EIADRP CC[C@H](C)OCC[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172315281 1049875907 /nfs/dbraw/zinc/87/59/07/1049875907.db2.gz BLJRQWGABSLJAU-WQIFRTTPSA-N 2 0 344.543 4.365 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172317326 1049876300 /nfs/dbraw/zinc/87/63/00/1049876300.db2.gz BLJRQWGABSLJAU-OOOLTRJPSA-N 2 0 344.543 4.365 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC001172322107 1049878062 /nfs/dbraw/zinc/87/80/62/1049878062.db2.gz RUIJTUXHWIEHBU-IRFCIJBXSA-N 2 0 332.532 4.082 20 0 EIADRP CC[C@H](C)OCC[C@@H](C)[NH+]1CCC2(CC[N@H+](Cc3ccoc3)C2)CC1 ZINC001172339789 1049888997 /nfs/dbraw/zinc/88/89/97/1049888997.db2.gz QQODUWZMEHHNIH-MOPGFXCFSA-N 2 0 348.531 4.161 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001172344326 1049890397 /nfs/dbraw/zinc/89/03/97/1049890397.db2.gz AOXQDIUGAREQQK-MPJJRAAHSA-N 2 0 344.543 4.034 20 0 EIADRP CC(C)OCC[C@@H](C)[N@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172444485 1049913201 /nfs/dbraw/zinc/91/32/01/1049913201.db2.gz LEXHEBVHWJASHY-NSISKUIASA-N 2 0 336.495 4.101 20 0 EIADRP CC(C)OCC[C@H](C)[N@@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001172453243 1049915475 /nfs/dbraw/zinc/91/54/75/1049915475.db2.gz FRPUHDBNGXOMTI-UNMCSNQZSA-N 2 0 344.543 4.178 20 0 EIADRP CC(C)OCC[C@H](C)[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001172459671 1049917616 /nfs/dbraw/zinc/91/76/16/1049917616.db2.gz KPSHRPILUNLAIX-KSEOMHKRSA-N 2 0 344.543 4.034 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@H]1CCC[N@H+](C)CC1 ZINC001172576994 1049931454 /nfs/dbraw/zinc/93/14/54/1049931454.db2.gz QLAKXGGTKDLWKQ-JSGCOSHPSA-N 2 0 330.850 4.013 20 0 EIADRP c1ccc([C@@H]2CC[C@@H]([NH2+]CC3CC[NH+](Cc4cccnc4)CC3)C2)cc1 ZINC001172558561 1049932499 /nfs/dbraw/zinc/93/24/99/1049932499.db2.gz VLGVPSAGBYHZPB-DHIUTWEWSA-N 2 0 349.522 4.220 20 0 EIADRP Clc1ccc2c(c1)C[C@@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001172716987 1049963568 /nfs/dbraw/zinc/96/35/68/1049963568.db2.gz CQOYCAKNRKWRDN-PMACEKPBSA-N 2 0 332.919 4.148 20 0 EIADRP CC(C)(C)C[NH+]1CCC(C[NH2+][C@H]2Cc3ccc(Cl)cc3C2)CC1 ZINC001172716767 1049963895 /nfs/dbraw/zinc/96/38/95/1049963895.db2.gz OOCLSCYDQYXAEA-IBGZPJMESA-N 2 0 334.935 4.155 20 0 EIADRP Clc1ccc2c(c1)C[C@@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)C2 ZINC001172717919 1049965069 /nfs/dbraw/zinc/96/50/69/1049965069.db2.gz UKWKRDSFVGELST-FQEVSTJZSA-N 2 0 332.919 4.051 20 0 EIADRP CC(C)N1CCOC[C@@]2(CCC[N@@H+](C3CCC4(CCCC4)CC3)C2)C1 ZINC001172727174 1049967378 /nfs/dbraw/zinc/96/73/78/1049967378.db2.gz UWMJYHYTYAGFGO-QFIPXVFZSA-N 2 0 348.575 4.312 20 0 EIADRP COc1cc[nH+]c(N(C2CC[NH2+]CC2)C2CCC3(CCCC3)CC2)c1 ZINC001172730434 1049969454 /nfs/dbraw/zinc/96/94/54/1049969454.db2.gz HMUURFLFVGEJLR-UHFFFAOYSA-N 2 0 343.515 4.152 20 0 EIADRP CC(C)OC(=O)CC[C@H](C)[NH2+]CCCCCCCCCCC[NH3+] ZINC001172746841 1049970245 /nfs/dbraw/zinc/97/02/45/1049970245.db2.gz UCHXBLZJMGAXDW-SFHVURJKSA-N 2 0 328.541 4.166 20 0 EIADRP CC(C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCN(Cc3ccccn3)C[C@H]2C)C1 ZINC000246940948 1050006332 /nfs/dbraw/zinc/00/63/32/1050006332.db2.gz HQWWCOATECSGQT-WERVVEIQSA-N 2 0 329.532 4.096 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000246936249 1050006667 /nfs/dbraw/zinc/00/66/67/1050006667.db2.gz GSXYETNNPACWMO-QKPAOTATSA-N 2 0 331.529 4.251 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)[C@H](C)c2nc3ccccc3s2)C1 ZINC000246968541 1050007419 /nfs/dbraw/zinc/00/74/19/1050007419.db2.gz JGIVLSNKGKSIEI-YESZJQIVSA-N 2 0 345.556 4.498 20 0 EIADRP C[C@@H]1CN(Cc2ccccn2)CC[C@H]1[NH2+]C[C@@H]1CCCc2ccccc21 ZINC000247974866 1050037997 /nfs/dbraw/zinc/03/79/97/1050037997.db2.gz KLZAKUVVBONECR-QMHWCDLVSA-N 2 0 349.522 4.002 20 0 EIADRP CSCCCCC[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000248575701 1050066013 /nfs/dbraw/zinc/06/60/13/1050066013.db2.gz SZBDANACFHFKGN-XUVXKRRUSA-N 2 0 332.557 4.020 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@H](C)c2ccc(C(F)(F)F)cc2)[C@H](C)C1 ZINC000249137880 1050093731 /nfs/dbraw/zinc/09/37/31/1050093731.db2.gz XENCLJLFTDPAAX-VBQJREDUSA-N 2 0 328.422 4.129 20 0 EIADRP CCC[N@H+]1C[C@@H]2C[NH+](C3CCC(Cc4ccccc4)CC3)C[C@@H]2C1 ZINC001172825532 1050165729 /nfs/dbraw/zinc/16/57/29/1050165729.db2.gz WXAKQMCGQOLUEA-KJMNDRGOSA-N 2 0 326.528 4.062 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([NH2+][C@H]1CCN(Cc3ccccc3)C[C@H]1C)CC2 ZINC001172837771 1050172844 /nfs/dbraw/zinc/17/28/44/1050172844.db2.gz MWUAHBKSJWLZRK-FOVJLYNBSA-N 2 0 348.534 4.353 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2cncc3ccccc32)C1 ZINC001177289663 1050177880 /nfs/dbraw/zinc/17/78/80/1050177880.db2.gz HLYQWRQWYHWYCN-ROUUACIJSA-N 2 0 325.500 4.083 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCCC(C)(C)C1 ZINC001177294136 1050178363 /nfs/dbraw/zinc/17/83/63/1050178363.db2.gz GLPNGCOVDLGVID-LJQANCHMSA-N 2 0 332.532 4.466 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([NH2+]C1CC[NH+](C[C@H]3CC=CCC3)CC1)CC2 ZINC001172840134 1050180269 /nfs/dbraw/zinc/18/02/69/1050180269.db2.gz ZRTDEOJAJVJMON-CVDCTZTESA-N 2 0 338.539 4.263 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC001172851999 1050190827 /nfs/dbraw/zinc/19/08/27/1050190827.db2.gz MWDOSMKMWVKZIY-AWEZNQCLSA-N 2 0 338.898 4.407 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)[NH2+]CCCC1CC[NH+](C)CC1 ZINC001172851370 1050191015 /nfs/dbraw/zinc/19/10/15/1050191015.db2.gz IIKYIESSZGRPJC-AWEZNQCLSA-N 2 0 326.887 4.122 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC001172862997 1050200882 /nfs/dbraw/zinc/20/08/82/1050200882.db2.gz KQZIERFTYVIPSJ-HNNXBMFYSA-N 2 0 326.887 4.122 20 0 EIADRP Fc1cccc(/C=C\C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC001177454818 1050211731 /nfs/dbraw/zinc/21/17/31/1050211731.db2.gz ZCFXSQUCPWZLIG-UITAMQMPSA-N 2 0 338.470 4.341 20 0 EIADRP C[C@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000090963482 1050217206 /nfs/dbraw/zinc/21/72/06/1050217206.db2.gz ZNBNKCSLDIFSJP-GJZGRUSLSA-N 2 0 348.437 4.317 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001172877653 1050218221 /nfs/dbraw/zinc/21/82/21/1050218221.db2.gz GPSITAQJDKMDFX-CQSZACIVSA-N 2 0 338.948 4.285 20 0 EIADRP C[NH+]1CCC(c2ccc(Nc3c[nH+]ccc3N3CCCC3)cc2)CC1 ZINC001212689619 1050230188 /nfs/dbraw/zinc/23/01/88/1050230188.db2.gz FCPKXYJNHAKGGX-UHFFFAOYSA-N 2 0 336.483 4.235 20 0 EIADRP CO[C@H]1CCC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)CC1 ZINC001177528799 1050240553 /nfs/dbraw/zinc/24/05/53/1050240553.db2.gz HSNAFYHONXEQSJ-VXKWHMMOSA-N 2 0 344.543 4.500 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)CCO1 ZINC001177566648 1050255282 /nfs/dbraw/zinc/25/52/82/1050255282.db2.gz YFUUGMVKDJSXQV-YADHBBJMSA-N 2 0 344.543 4.356 20 0 EIADRP c1cc(C[NH+]2CCCC2)ccc1C[NH2+]C1CCC2(CCOCC2)CC1 ZINC001173037743 1050269571 /nfs/dbraw/zinc/26/95/71/1050269571.db2.gz NGYPEMVUFMNYFW-UHFFFAOYSA-N 2 0 342.527 4.111 20 0 EIADRP CCCOC1CCC([N@H+](CC2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001173096200 1050288056 /nfs/dbraw/zinc/28/80/56/1050288056.db2.gz WTPRCLRWBPFEMX-GOHCJOFJSA-N 2 0 336.564 4.486 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2cccc(N3CCCCC3)c2)CC1 ZINC001173101647 1050303395 /nfs/dbraw/zinc/30/33/95/1050303395.db2.gz MQBMKUHJQWHQHU-UHFFFAOYSA-N 2 0 343.559 4.420 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](c2ccccc2)C2CCOCC2)CC1 ZINC001173104657 1050304864 /nfs/dbraw/zinc/30/48/64/1050304864.db2.gz TYGLHUBWCDRCKP-LZBANZJXSA-N 2 0 344.543 4.397 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](c2ccc(OC)cc2)C2CC2)CC1 ZINC001173104805 1050305909 /nfs/dbraw/zinc/30/59/09/1050305909.db2.gz WGKIPEMJFNMIEU-GRERDSQWSA-N 2 0 330.516 4.389 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCC(C(F)(F)F)C(F)(F)F)CC1 ZINC001173108436 1050306812 /nfs/dbraw/zinc/30/68/12/1050306812.db2.gz KOVUPRIEVCEAQD-UHFFFAOYSA-N 2 0 348.375 4.360 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CC2(Cc3ccc(F)cc3)CC2)CC1 ZINC001173106100 1050306999 /nfs/dbraw/zinc/30/69/99/1050306999.db2.gz HPQPMHZMPAQSTN-UHFFFAOYSA-N 2 0 332.507 4.391 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](c2cccc(OC)c2)C2CC2)CC1 ZINC001173110415 1050307475 /nfs/dbraw/zinc/30/74/75/1050307475.db2.gz NZBNBLHDOVAUIB-GZNCHQMQSA-N 2 0 330.516 4.389 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](C)c2cc(OC)cc(OC)c2)CC1 ZINC001173106648 1050307906 /nfs/dbraw/zinc/30/79/06/1050307906.db2.gz ATKUYLYSTRWMRG-ZLPCBKJTSA-N 2 0 334.504 4.007 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC(OCc3ccccc3)CC2)CC1 ZINC001173112560 1050309832 /nfs/dbraw/zinc/30/98/32/1050309832.db2.gz XMBKIUHWLSTQRF-UHFFFAOYSA-N 2 0 344.543 4.321 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCCc3ccc(OC)cc3C2)CC1 ZINC001173114201 1050310006 /nfs/dbraw/zinc/31/00/06/1050310006.db2.gz ZXASYGVVNBENBS-UHFFFAOYSA-N 2 0 330.516 4.096 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCN(c3cccc(C)c3C)CC2)CC1 ZINC001173114890 1050310392 /nfs/dbraw/zinc/31/03/92/1050310392.db2.gz VJUWGXJPOBPUSW-UHFFFAOYSA-N 2 0 343.559 4.078 20 0 EIADRP C(C1CCOCC1)[NH+]1CCC([NH2+]C2CCC3(CCCCC3)CC2)CC1 ZINC001173118863 1050315886 /nfs/dbraw/zinc/31/58/86/1050315886.db2.gz SOBDSBQIQUJHNB-UHFFFAOYSA-N 2 0 348.575 4.360 20 0 EIADRP CC(C)[NH+]1CCC(C[NH2+]C2CCC(Oc3ccccc3)CC2)CC1 ZINC001173197109 1050339996 /nfs/dbraw/zinc/33/99/96/1050339996.db2.gz BNPTZSYCKCOACX-UHFFFAOYSA-N 2 0 330.516 4.087 20 0 EIADRP CC[N@H+]1C[C@@H]2C[NH+]([C@@H](C)CC(c3ccccc3)c3ccccc3)C[C@@H]2C1 ZINC001173213747 1050373252 /nfs/dbraw/zinc/37/32/52/1050373252.db2.gz HONRGJXYNZYDOQ-AJSBUHFISA-N 2 0 348.534 4.481 20 0 EIADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2ccc(Cl)c(Br)c2)CC1 ZINC001206317556 1050383756 /nfs/dbraw/zinc/38/37/56/1050383756.db2.gz HGAJZGHKHAZGKE-HNNXBMFYSA-N 2 0 345.712 4.053 20 0 EIADRP CC[C@@H]1CC[C@@H]([N@H+](Cc2ccccc2OC)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173272789 1050392059 /nfs/dbraw/zinc/39/20/59/1050392059.db2.gz WWCPNVZHRMSPLC-VBSBHUPXSA-N 2 0 330.516 4.346 20 0 EIADRP CCSC[C@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC001173295225 1050399394 /nfs/dbraw/zinc/39/93/94/1050399394.db2.gz KCGWLKLGTUOGOG-HNNXBMFYSA-N 2 0 340.964 4.283 20 0 EIADRP [NH3+]C1(Cc2cccnc2)CC[NH+]([C@@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173346174 1050436667 /nfs/dbraw/zinc/43/66/67/1050436667.db2.gz ZQKRCIQZRPUJPQ-HXUWFJFHSA-N 2 0 341.543 4.311 20 0 EIADRP COc1cccc2c(C[NH2+]CC[C@H](C)[NH+]3CCCCC3)cccc12 ZINC001178464346 1050476530 /nfs/dbraw/zinc/47/65/30/1050476530.db2.gz XCXDMBWIPGHPJJ-KRWDZBQOSA-N 2 0 326.484 4.203 20 0 EIADRP C[C@@H]1C[N@H+](CCC[NH2+]Cc2ccc(-c3cccs3)cc2)CCCO1 ZINC001178473531 1050478321 /nfs/dbraw/zinc/47/83/21/1050478321.db2.gz SKMRVSJCRVTKSX-QGZVFWFLSA-N 2 0 344.524 4.006 20 0 EIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cccc(Cl)c1 ZINC000092856882 1050480878 /nfs/dbraw/zinc/48/08/78/1050480878.db2.gz SUTGTHFRTCFJIZ-HNNXBMFYSA-N 2 0 329.875 4.302 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@H+]1C[C@H]2[C@H](C1)CCCN2C ZINC001173551667 1050487803 /nfs/dbraw/zinc/48/78/03/1050487803.db2.gz UQGOASXYAXMGKB-XUWXXGDYSA-N 2 0 341.326 4.341 20 0 EIADRP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1ccc2scnc2c1 ZINC001178527703 1050491582 /nfs/dbraw/zinc/49/15/82/1050491582.db2.gz GNFNQOVQKWOUGW-UHFFFAOYSA-N 2 0 331.529 4.431 20 0 EIADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+]C2CCC3(CCc4ccccc43)CC2)C1 ZINC001173685384 1050538765 /nfs/dbraw/zinc/53/87/65/1050538765.db2.gz RUYBEULXGYOPCW-QHCGNWPDSA-N 2 0 326.528 4.276 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@H](C)c2ccccn2)ccc1OC ZINC000182194281 1050539213 /nfs/dbraw/zinc/53/92/13/1050539213.db2.gz DSVNDUSNPXTJJO-DLBZAZTESA-N 2 0 341.499 4.344 20 0 EIADRP COc1cccc2c(C[NH2+]CCCCC[NH+]3CCCC3)cccc12 ZINC001178811167 1050559668 /nfs/dbraw/zinc/55/96/68/1050559668.db2.gz QKEQAIDVQSYPQK-UHFFFAOYSA-N 2 0 326.484 4.204 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cccnc2)ccc1OC ZINC000182226348 1050563739 /nfs/dbraw/zinc/56/37/39/1050563739.db2.gz OKJCBFHDFAZUBY-SJORKVTESA-N 2 0 341.499 4.344 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@H](C)c2cccnc2)ccc1OC ZINC000182226481 1050563885 /nfs/dbraw/zinc/56/38/85/1050563885.db2.gz OKJCBFHDFAZUBY-IAGOWNOFSA-N 2 0 341.499 4.344 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1nc2c(s1)CCCC2 ZINC000093398378 1050585913 /nfs/dbraw/zinc/58/59/13/1050585913.db2.gz JBPJBGZVYADQJU-MRXNPFEDSA-N 2 0 335.561 4.185 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1nc2c(s1)CCCC2 ZINC000093398377 1050587822 /nfs/dbraw/zinc/58/78/22/1050587822.db2.gz JBPJBGZVYADQJU-INIZCTEOSA-N 2 0 335.561 4.185 20 0 EIADRP C[C@@H](CCc1ccccc1)C[NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC001179015469 1050611007 /nfs/dbraw/zinc/61/10/07/1050611007.db2.gz BFXNBSAUVWDFFI-PMOQBDJRSA-N 2 0 336.523 4.190 20 0 EIADRP CC(C)C[N@H+](C)CCC[NH2+]Cc1cc2nc(Cl)ccc2s1 ZINC001179082612 1050626831 /nfs/dbraw/zinc/62/68/31/1050626831.db2.gz ZTRXWSLIIPOYEV-UHFFFAOYSA-N 2 0 325.909 4.017 20 0 EIADRP CN(C)Cc1csc(C[NH2+][C@@H]2CCCC[C@H](c3ccccc3)C2)n1 ZINC001179607790 1050732138 /nfs/dbraw/zinc/73/21/38/1050732138.db2.gz JXZVVJYMOHPRSB-ZWKOTPCHSA-N 2 0 343.540 4.411 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccoc2)cc1C[NH+]1CCCCC1 ZINC000182555366 1050748458 /nfs/dbraw/zinc/74/84/58/1050748458.db2.gz ZSCGNJSQALYFEJ-MRXNPFEDSA-N 2 0 328.456 4.125 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2ccoc2)cc1C[NH+]1CCCCC1 ZINC000182555345 1050749702 /nfs/dbraw/zinc/74/97/02/1050749702.db2.gz ZSCGNJSQALYFEJ-INIZCTEOSA-N 2 0 328.456 4.125 20 0 EIADRP Cc1cc2cc(C[NH2+]C3CCN(c4cc[nH+]cc4)CC3)oc2cc1C ZINC001179789209 1050778926 /nfs/dbraw/zinc/77/89/26/1050778926.db2.gz OIWCQRHBVUNSDX-UHFFFAOYSA-N 2 0 335.451 4.203 20 0 EIADRP CCCCCCOc1cccc(C[NH2+][C@@H]2CC[C@H]3C[N@H+](C)C[C@H]32)c1 ZINC001179816792 1050786693 /nfs/dbraw/zinc/78/66/93/1050786693.db2.gz NTXGFHPXNHPHEP-CEWLAPEOSA-N 2 0 330.516 4.076 20 0 EIADRP FC(F)(F)CCC[N@@H+]1CC[C@@]2(C1)CCC[NH+](Cc1ccccc1)C2 ZINC001179864168 1050809743 /nfs/dbraw/zinc/80/97/43/1050809743.db2.gz UNNOHOGNSPZZFI-GOSISDBHSA-N 2 0 340.433 4.317 20 0 EIADRP c1ccc(-c2cccc(C[NH+]3CCC(C[NH+]4CCCC4)CC3)c2)nc1 ZINC000152678993 1050827869 /nfs/dbraw/zinc/82/78/69/1050827869.db2.gz ANLWZNNLTSWUDB-UHFFFAOYSA-N 2 0 335.495 4.056 20 0 EIADRP C[C@]1(C[N@@H+]2CC[C@H]3[C@H](CCC[NH+]3Cc3ccccc3)C2)CCCS1 ZINC001179918984 1050833990 /nfs/dbraw/zinc/83/39/90/1050833990.db2.gz GEQHTJJWHJCDFZ-QHAWAJNXSA-N 2 0 344.568 4.259 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](C[C@@H]2CCc3ccccc32)C1 ZINC001180030504 1050859440 /nfs/dbraw/zinc/85/94/40/1050859440.db2.gz NRWHHXKGZPBBNS-SBHAEUEKSA-N 2 0 326.528 4.303 20 0 EIADRP CCC[NH+]1CCC([N@H+](C)Cc2ccccc2CC(F)(F)F)CC1 ZINC001180161757 1050906752 /nfs/dbraw/zinc/90/67/52/1050906752.db2.gz PAZIZGIMVNASLG-UHFFFAOYSA-N 2 0 328.422 4.098 20 0 EIADRP Cc1cc(C)cc(CC[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC001180350254 1050965120 /nfs/dbraw/zinc/96/51/20/1050965120.db2.gz WYNODVIKEGDCLT-OFNKIYASSA-N 2 0 336.523 4.346 20 0 EIADRP CC[NH+]1CCC(C[N@H+]2CC=C(c3c(C)[nH]c4ccccc43)CC2)CC1 ZINC001180378850 1050974151 /nfs/dbraw/zinc/97/41/51/1050974151.db2.gz JXETTWVQPQVUOC-UHFFFAOYSA-N 2 0 337.511 4.297 20 0 EIADRP Cc1cc(Nc2cccc3c2C[N@H+](C)C[C@H]3c2ccccc2)cc[nH+]1 ZINC001174656996 1051129383 /nfs/dbraw/zinc/12/93/83/1051129383.db2.gz YKAMZAMXGIXLNO-FQEVSTJZSA-N 2 0 329.447 4.133 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000775378987 1051171102 /nfs/dbraw/zinc/17/11/02/1051171102.db2.gz OTMRNVPXJFQJPN-GUYCJALGSA-N 2 0 340.483 4.310 20 0 EIADRP C[C@H](C[NH2+]C[C@H]1CCC[N@@H+]1C1CCCCC1)c1cc(F)cc(F)c1 ZINC001181276059 1051196344 /nfs/dbraw/zinc/19/63/44/1051196344.db2.gz IKTYXRWDARYOQY-FOIQADDNSA-N 2 0 336.470 4.455 20 0 EIADRP C[C@H](CCOCc1ccccc1)[NH2+]C[C@@H]1CCC[N@@H+]1C1CCCCC1 ZINC001181276818 1051196618 /nfs/dbraw/zinc/19/66/18/1051196618.db2.gz RQKBHDJMIWVGDA-KNQAVFIVSA-N 2 0 344.543 4.369 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc(F)c(OC)c2)c1 ZINC000153596882 1051201768 /nfs/dbraw/zinc/20/17/68/1051201768.db2.gz YNECNRLQPPUNHT-HNNXBMFYSA-N 2 0 330.447 4.137 20 0 EIADRP C[C@H](CSCCF)[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC001181454785 1051228530 /nfs/dbraw/zinc/22/85/30/1051228530.db2.gz GPYDAHLSTUCCTL-QGZVFWFLSA-N 2 0 338.536 4.099 20 0 EIADRP CC[C@@H](C)[C@H](C[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)OC ZINC001181458727 1051230853 /nfs/dbraw/zinc/23/08/53/1051230853.db2.gz ZEBCWCWZTVDILK-NQIIRXRSSA-N 2 0 332.532 4.069 20 0 EIADRP COc1ccccc1CCC[N@@H+]1CCC[C@@H](C[NH+]2CCC(C)CC2)C1 ZINC001190652080 1051245066 /nfs/dbraw/zinc/24/50/66/1051245066.db2.gz VPDOHUCAEBVNTD-HXUWFJFHSA-N 2 0 344.543 4.072 20 0 EIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(C)cc1OC ZINC001181487003 1051246495 /nfs/dbraw/zinc/24/64/95/1051246495.db2.gz OMOCMJSEVBDGMV-UHFFFAOYSA-N 2 0 326.484 4.087 20 0 EIADRP CC[C@H]([NH2+][C@H](C)c1ccc(OC)c(C[NH+](CC)CC)c1)[C@H]1CCCO1 ZINC000775417828 1051292210 /nfs/dbraw/zinc/29/22/10/1051292210.db2.gz XNBJVSHTZQJSQQ-LKUPVBHCSA-N 2 0 348.531 4.145 20 0 EIADRP CCCC[N@H+](CCc1cccc(C)n1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001174983227 1051304531 /nfs/dbraw/zinc/30/45/31/1051304531.db2.gz FWXUTXMFEDFGMB-UHFFFAOYSA-N 2 0 331.548 4.344 20 0 EIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(OC)c(Cl)c1 ZINC001175062403 1051314582 /nfs/dbraw/zinc/31/45/82/1051314582.db2.gz PBOBRFBGYJSDFM-UHFFFAOYSA-N 2 0 346.902 4.432 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@H](C)c2ccc[nH]2)ccc1OC ZINC000775425335 1051317366 /nfs/dbraw/zinc/31/73/66/1051317366.db2.gz XTDBTCFPNWNQAY-JKSUJKDBSA-N 2 0 329.488 4.277 20 0 EIADRP C[NH+]1CCC(C)(C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C)CC1 ZINC001181995267 1051366552 /nfs/dbraw/zinc/36/65/52/1051366552.db2.gz WVXTYCQHRBZVLI-UHFFFAOYSA-N 2 0 342.508 4.304 20 0 EIADRP CC[NH+]1CCC([NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)CC1 ZINC000620857488 1051373487 /nfs/dbraw/zinc/37/34/87/1051373487.db2.gz IAFPNOMFYSDVTP-UHFFFAOYSA-N 2 0 347.506 4.264 20 0 EIADRP CO[C@H](C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)CC(C)C ZINC001182020671 1051383309 /nfs/dbraw/zinc/38/33/09/1051383309.db2.gz MCDUZBXUXMKYDG-KBRMVUAJSA-N 2 0 344.543 4.223 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(OC)c(COC)c1 ZINC000268727345 1051385547 /nfs/dbraw/zinc/38/55/47/1051385547.db2.gz KJFQISVVQSIZHC-SJORKVTESA-N 2 0 336.520 4.003 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ccc(OC)c(COC)c1 ZINC000268727339 1051386311 /nfs/dbraw/zinc/38/63/11/1051386311.db2.gz KJFQISVVQSIZHC-DLBZAZTESA-N 2 0 336.520 4.003 20 0 EIADRP CCCOc1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000310872748 1051442685 /nfs/dbraw/zinc/44/26/85/1051442685.db2.gz GDZBVCWGXQJSPF-NRFANRHFSA-N 2 0 338.495 4.087 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](CCOC2CCCCC2)CC1 ZINC001191551561 1051485790 /nfs/dbraw/zinc/48/57/90/1051485790.db2.gz RADWJIYNAWKWTJ-LJQANCHMSA-N 2 0 336.564 4.312 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](C[C@H]2CCCC(C)(C)O2)CC1 ZINC001191549313 1051486616 /nfs/dbraw/zinc/48/66/16/1051486616.db2.gz AVAYVDYVVYEWAD-AZUAARDMSA-N 2 0 336.564 4.311 20 0 EIADRP C[N@@H+]1C[C@@H](C[NH2+][C@H]2CC[C@](C)(c3ccccc3)C2)[C@H](c2ccccc2)C1 ZINC001182542188 1051635907 /nfs/dbraw/zinc/63/59/07/1051635907.db2.gz CKLFNZKYPJBNHJ-KAMZKSLDSA-N 2 0 348.534 4.432 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cnc2ccsc2c1 ZINC000157942299 1051687756 /nfs/dbraw/zinc/68/77/56/1051687756.db2.gz VBHCNGHWZKVUEC-HOTGVXAUSA-N 2 0 331.529 4.459 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]C[C@@H]3CCC[N@H+](C)C3)cs2)cs1 ZINC000158172722 1051721680 /nfs/dbraw/zinc/72/16/80/1051721680.db2.gz QRAPHEGZORWBNI-JSGCOSHPSA-N 2 0 335.542 4.172 20 0 EIADRP C[N@H+](CCCC[NH+]1CCCCC1)Cc1cc(Cl)nc(Cl)c1 ZINC001175690521 1051731571 /nfs/dbraw/zinc/73/15/71/1051731571.db2.gz ZBQZNSIWQQGOPV-UHFFFAOYSA-N 2 0 330.303 4.086 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cncc(Cl)c2)CC1)CC(C)C ZINC001192489315 1051756864 /nfs/dbraw/zinc/75/68/64/1051756864.db2.gz DFKBTNLWJPOJCL-UHFFFAOYSA-N 2 0 337.939 4.315 20 0 EIADRP C[C@@H](CC[NH2+]CC1(c2ccccc2)CC[NH+](C)CC1)c1ccccc1 ZINC001183355495 1051826332 /nfs/dbraw/zinc/82/63/32/1051826332.db2.gz RBQFDTFNVSOUFX-FQEVSTJZSA-N 2 0 336.523 4.433 20 0 EIADRP C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1[NH2+]C[C@H]1CCCC(C)(C)O1 ZINC001193092254 1051874974 /nfs/dbraw/zinc/87/49/74/1051874974.db2.gz CHHHBLITYURQBB-QWFCFKBJSA-N 2 0 344.543 4.080 20 0 EIADRP C[N@@H+]1C[C@@H]2CC[C@H]([NH2+][C@H](CCc3ccccc3)Cc3ccccc3)[C@H]2C1 ZINC001184389486 1052002563 /nfs/dbraw/zinc/00/25/63/1052002563.db2.gz XKFWUXZHWNYIKD-KIHHCIJBSA-N 2 0 348.534 4.160 20 0 EIADRP CCC[C@]1(COC)CCC[N@@H+]1Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001193872399 1052022371 /nfs/dbraw/zinc/02/23/71/1052022371.db2.gz NEFJWJSOJMWSDT-JOCHJYFZSA-N 2 0 344.543 4.454 20 0 EIADRP COc1ccc2cc([C@@H](C)[NH2+]CCCCn3ccnc3C)ccc2c1 ZINC000164701725 1052037688 /nfs/dbraw/zinc/03/76/88/1052037688.db2.gz CFTSDEZQNFPNPE-MRXNPFEDSA-N 2 0 337.467 4.484 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)cc1 ZINC000171129650 1052395957 /nfs/dbraw/zinc/39/59/57/1052395957.db2.gz AFDLJHXXJCNXNO-GOSISDBHSA-N 2 0 326.484 4.176 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2CCSc3ccc(F)cc32)cc1 ZINC000171131701 1052396662 /nfs/dbraw/zinc/39/66/62/1052396662.db2.gz IWZOVIXEPLRRPQ-SFHVURJKSA-N 2 0 330.472 4.214 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000339068805 1052552439 /nfs/dbraw/zinc/55/24/39/1052552439.db2.gz QJXPYHUQLBFOPO-SFHLNBCPSA-N 2 0 330.516 4.008 20 0 EIADRP Cc1sc(CC[NH2+][C@@H]2CC[N@@H+](C)C(C)(C)C2)nc1-c1ccccc1 ZINC000623446406 1052657613 /nfs/dbraw/zinc/65/76/13/1052657613.db2.gz BGGPEXPZSRPRSD-QGZVFWFLSA-N 2 0 343.540 4.123 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc3c(c2)OCO3)c1 ZINC000177980024 1052696085 /nfs/dbraw/zinc/69/60/85/1052696085.db2.gz KGJXWVVDGOVGKK-MRXNPFEDSA-N 2 0 340.467 4.106 20 0 EIADRP C[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000178087271 1052698119 /nfs/dbraw/zinc/69/81/19/1052698119.db2.gz FTPJJTSEJRMVEO-BTYIYWSLSA-N 2 0 342.458 4.104 20 0 EIADRP C[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(F)cc1C(F)(F)F ZINC000623887882 1052833540 /nfs/dbraw/zinc/83/35/40/1052833540.db2.gz QFGZAUXIQNADDH-LBPRGKRZSA-N 2 0 332.385 4.227 20 0 EIADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccc(F)cc1C(F)(F)F ZINC000623999525 1052850125 /nfs/dbraw/zinc/85/01/25/1052850125.db2.gz SXFVBWIXIZANPC-OLZOCXBDSA-N 2 0 332.385 4.227 20 0 EIADRP CO[C@@H](C)C[N@@H+]1CCCCC[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001194940900 1053189559 /nfs/dbraw/zinc/18/95/59/1053189559.db2.gz CZCUHPVLRNEPBN-UGKGYDQZSA-N 2 0 344.543 4.178 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc2c(c1)CCCO2 ZINC000850436292 1053211902 /nfs/dbraw/zinc/21/19/02/1053211902.db2.gz TUCJHSBLUMMQSA-HNNXBMFYSA-N 2 0 342.458 4.063 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000383365053 1053330250 /nfs/dbraw/zinc/33/02/50/1053330250.db2.gz UXUUVOAWPQDXLT-NQIIRXRSSA-N 2 0 326.459 4.389 20 0 EIADRP CSc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000383677406 1053374020 /nfs/dbraw/zinc/37/40/20/1053374020.db2.gz NSCKIMJFFTYGOC-PXNSSMCTSA-N 2 0 340.536 4.409 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1cnn(-c2ccccc2)c1 ZINC000764965143 1053402320 /nfs/dbraw/zinc/40/23/20/1053402320.db2.gz URPKBSGTXBHZTN-RTBURBONSA-N 2 0 340.515 4.178 20 0 EIADRP CCOc1cccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000794829646 1053441676 /nfs/dbraw/zinc/44/16/76/1053441676.db2.gz VOZNHRGEJZUUDX-ICSRJNTNSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](C)c1cccc(F)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000765358985 1053514537 /nfs/dbraw/zinc/51/45/37/1053514537.db2.gz JLFRFOQWVDDVNN-IAGOWNOFSA-N 2 0 344.474 4.220 20 0 EIADRP CCOc1cccc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000385805305 1053551155 /nfs/dbraw/zinc/55/11/55/1053551155.db2.gz NHLNJVUOKPDENL-GHTZIAJQSA-N 2 0 338.495 4.086 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](CC2CCCCC2)CC1)c1ccc2c(c1)COC2 ZINC000765453991 1053557927 /nfs/dbraw/zinc/55/79/27/1053557927.db2.gz VUQSLZVTWRPBOP-KRWDZBQOSA-N 2 0 342.527 4.412 20 0 EIADRP COc1ccc2c(NC[C@@H](c3ccsc3)[NH+](C)C)cc[nH+]c2c1 ZINC000765465281 1053559561 /nfs/dbraw/zinc/55/95/61/1053559561.db2.gz QNHJGMBWWQDTLD-SFHVURJKSA-N 2 0 327.453 4.020 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+]Cc2cc3cc(Cl)cnc3o2)CC1 ZINC000865717145 1053579555 /nfs/dbraw/zinc/57/95/55/1053579555.db2.gz QLBXMBZAAXSYPZ-UHFFFAOYSA-N 2 0 335.879 4.081 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccc(CC(F)(F)F)cc2)CC1 ZINC000865764641 1053588286 /nfs/dbraw/zinc/58/82/86/1053588286.db2.gz JMTALFDFTBKIFF-UHFFFAOYSA-N 2 0 328.422 4.144 20 0 EIADRP C[C@@H](CCc1cncc2ccccc21)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000866368857 1053707013 /nfs/dbraw/zinc/70/70/13/1053707013.db2.gz FEQKURPPEVUXQO-KRWDZBQOSA-N 2 0 325.500 4.020 20 0 EIADRP CC(C)[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ccc2[nH]c(=O)oc2c1 ZINC000866515863 1053764343 /nfs/dbraw/zinc/76/43/43/1053764343.db2.gz KJHDFRWWKUVVMG-VDUSKEEQSA-N 2 0 345.487 4.083 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@@H](C[C@@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000866518420 1053765392 /nfs/dbraw/zinc/76/53/92/1053765392.db2.gz ZLERTOVTBGAHBK-QGZBPCDMSA-N 2 0 348.506 4.146 20 0 EIADRP C[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1cc(-c2ccccc2)nn1C ZINC000866517844 1053765865 /nfs/dbraw/zinc/76/58/65/1053765865.db2.gz OXXWNBSXGNUACD-AFJQURTJSA-N 2 0 340.515 4.001 20 0 EIADRP C[C@H]([NH2+][C@H]1CCc2ccccc2C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386546139 1053773300 /nfs/dbraw/zinc/77/33/00/1053773300.db2.gz SFZXELNJKSBGRT-TZYHBYERSA-N 2 0 334.507 4.044 20 0 EIADRP CC(F)(F)C(C)(C)C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000866543974 1053778698 /nfs/dbraw/zinc/77/86/98/1053778698.db2.gz CHJZQISPFGRNGJ-BCDXTJNWSA-N 2 0 336.470 4.453 20 0 EIADRP CC1CC[NH+](CC[C@H]2CCC[N@@H+]2C[C@@H]2CCCCC2(F)F)CC1 ZINC001196934747 1053803920 /nfs/dbraw/zinc/80/39/20/1053803920.db2.gz CGTGAMPUFTWTLY-ZWKOTPCHSA-N 2 0 328.491 4.398 20 0 EIADRP CC1CC[NH+](CC[C@@H]2CCC[N@@H+]2C[C@@H]2CCCCC2(F)F)CC1 ZINC001196934746 1053804825 /nfs/dbraw/zinc/80/48/25/1053804825.db2.gz CGTGAMPUFTWTLY-ROUUACIJSA-N 2 0 328.491 4.398 20 0 EIADRP C[N@@H+]1CC[C@H]2CN(CCCCc3ccc(Cl)c(Cl)c3)CC[C@H]21 ZINC001197031944 1053828268 /nfs/dbraw/zinc/82/82/68/1053828268.db2.gz NFLNZDJNOSRVLI-MAUKXSAKSA-N 2 0 341.326 4.342 20 0 EIADRP C[C@@]1(C2CCCCC2)CC[N@@H+]1Cc1ccc(CN2CCOCC2)cc1 ZINC001197239251 1053858540 /nfs/dbraw/zinc/85/85/40/1053858540.db2.gz MZYBMVQPGADPEY-QFIPXVFZSA-N 2 0 342.527 4.064 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCO[C@@H](C(C)(C)C)C3)CC2)CC1 ZINC000872050700 1054360967 /nfs/dbraw/zinc/36/09/67/1054360967.db2.gz CEGGSSKSQAENAS-CQJJOKNBSA-N 2 0 336.564 4.213 20 0 EIADRP C[C@@H](C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)Cc1ccc(C(C)(C)C)cc1 ZINC001199197848 1054362437 /nfs/dbraw/zinc/36/24/37/1054362437.db2.gz KIQHFATWCUYHLE-MJGOQNOKSA-N 2 0 328.544 4.237 20 0 EIADRP Fc1cc(C[NH2+]CCCN2CCc3ccccc3C2)ccc1C(F)F ZINC001199238487 1054369643 /nfs/dbraw/zinc/36/96/43/1054369643.db2.gz QJPFBQLMPOTXNB-UHFFFAOYSA-N 2 0 348.412 4.301 20 0 EIADRP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)CC1 ZINC001199265542 1054376673 /nfs/dbraw/zinc/37/66/73/1054376673.db2.gz BJYQTINGSNXSEQ-VLCRHTCISA-N 2 0 344.543 4.356 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cnc2c(F)cccc2c1 ZINC001199336604 1054386094 /nfs/dbraw/zinc/38/60/94/1054386094.db2.gz SPYIPINMRUAGEI-MRXNPFEDSA-N 2 0 329.463 4.118 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)C1 ZINC001199344129 1054388012 /nfs/dbraw/zinc/38/80/12/1054388012.db2.gz FWHNGVHMZMHIBR-GOSISDBHSA-N 2 0 344.543 4.392 20 0 EIADRP C[C@H]([NH2+]Cc1cccc2ncccc12)c1ccc(OCC[NH+](C)C)cc1 ZINC000872124267 1054404603 /nfs/dbraw/zinc/40/46/03/1054404603.db2.gz IHLZANIUPKHYMG-KRWDZBQOSA-N 2 0 349.478 4.026 20 0 EIADRP CCC1(C[NH2+]Cc2ccnc(F)c2)CC[NH+](Cc2ccccc2)CC1 ZINC000858153466 1054427022 /nfs/dbraw/zinc/42/70/22/1054427022.db2.gz NCLDMULJMCCAOP-UHFFFAOYSA-N 2 0 341.474 4.003 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2coc(-c3ccc(Cl)cc3)n2)CC1 ZINC000056523816 1054471382 /nfs/dbraw/zinc/47/13/82/1054471382.db2.gz GYJHPDQNQCJGAK-UHFFFAOYSA-N 2 0 347.890 4.159 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(-c2nc3ccccc3s2)o1)C1CC[NH2+]CC1 ZINC000873222164 1054508757 /nfs/dbraw/zinc/50/87/57/1054508757.db2.gz CVKSLTAKKLATBW-ZDUSSCGKSA-N 2 0 341.480 4.034 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+]Cc2cn(C(F)F)c3ccccc23)CC1 ZINC000858537244 1054508954 /nfs/dbraw/zinc/50/89/54/1054508954.db2.gz SSNSPNQUVCWESP-UHFFFAOYSA-N 2 0 335.442 4.389 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)ccc1SC(F)F ZINC000873240106 1054511634 /nfs/dbraw/zinc/51/16/34/1054511634.db2.gz JVGNYOJKTQEITG-OBJOEFQTSA-N 2 0 344.471 4.178 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]C[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000873259462 1054517145 /nfs/dbraw/zinc/51/71/45/1054517145.db2.gz FJIOKOPDBSNMCE-LFVTVUPYSA-N 2 0 341.524 4.300 20 0 EIADRP CCOc1cccc2cc([C@H](C)[NH2+]C[C@H]3C[C@H]4CC[C@@H](C3)[NH2+]4)oc21 ZINC000873265118 1054518284 /nfs/dbraw/zinc/51/82/84/1054518284.db2.gz TZNLMDXOYFRAMB-DIECFANBSA-N 2 0 328.456 4.013 20 0 EIADRP CN(Cc1ncc(-c2ccccc2)o1)Cc1ccc(C[NH+](C)C)cc1 ZINC000859212807 1054644106 /nfs/dbraw/zinc/64/41/06/1054644106.db2.gz AIMOSEUCMIFEJR-UHFFFAOYSA-N 2 0 335.451 4.035 20 0 EIADRP C[NH+](C)Cc1ccc(NC2=C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)cc1 ZINC001201475569 1054829208 /nfs/dbraw/zinc/82/92/08/1054829208.db2.gz WJIGUKPSPOSJCG-PKTZIBPZSA-N 2 0 347.506 4.481 20 0 EIADRP CCC[C@H](C)C[NH+]1CCC2(C[C@@H]([N@H+](C)Cc3ccccc3)CO2)CC1 ZINC001201544394 1054838265 /nfs/dbraw/zinc/83/82/65/1054838265.db2.gz PNPPYTVQIIHOSQ-PZJWPPBQSA-N 2 0 344.543 4.178 20 0 EIADRP CCC[C@H](C)C[NH+]1CCC2(C[C@H]([N@H+](C)Cc3ccccc3)CO2)CC1 ZINC001201544393 1054838313 /nfs/dbraw/zinc/83/83/13/1054838313.db2.gz PNPPYTVQIIHOSQ-FPOVZHCZSA-N 2 0 344.543 4.178 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2cnn(-c3ccccc3)c2)c1 ZINC000765774533 1054903109 /nfs/dbraw/zinc/90/31/09/1054903109.db2.gz DVXGFPHUSDYIQV-SFHVURJKSA-N 2 0 348.494 4.175 20 0 EIADRP CCO[P@@](C)(=O)CC[C@H](C)[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000877075634 1055013295 /nfs/dbraw/zinc/01/32/95/1055013295.db2.gz DGWCOEIUYMHAEC-IJZBHVGQSA-N 2 0 344.480 4.096 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2CCCCS2)CC1 ZINC000671760238 1055044957 /nfs/dbraw/zinc/04/49/57/1055044957.db2.gz MHQUVAODBFZCTQ-SOAGJPPSSA-N 2 0 332.557 4.305 20 0 EIADRP Cc1cccc2[nH]c(C[NH2+]C[C@@]3(C)CC[N@H+](Cc4ccccc4)C3)cc21 ZINC001202220116 1055092877 /nfs/dbraw/zinc/09/28/77/1055092877.db2.gz MPMOIWXWVIETCR-HSZRJFAPSA-N 2 0 347.506 4.478 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc(-n3ccnc3)cc2)c1 ZINC000126736630 1055129316 /nfs/dbraw/zinc/12/93/16/1055129316.db2.gz FFHWWNDCXJYMBY-UHFFFAOYSA-N 2 0 348.494 4.002 20 0 EIADRP FC(F)(F)CCC[N@@H+]1CC[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001202444049 1055176272 /nfs/dbraw/zinc/17/62/72/1055176272.db2.gz COAPXRUNKSPPMH-QZTJIDSGSA-N 2 0 340.433 4.173 20 0 EIADRP FC(F)n1cc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)c2ccccc21 ZINC000863547741 1055226169 /nfs/dbraw/zinc/22/61/69/1055226169.db2.gz RTPONCALGPQUEE-OKZBNKHCSA-N 2 0 347.453 4.437 20 0 EIADRP FC(F)n1cc(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCC[NH2+]2)c2ccccc21 ZINC000863548088 1055228148 /nfs/dbraw/zinc/22/81/48/1055228148.db2.gz USDQNPYWSMIJRP-GVDBMIGSSA-N 2 0 333.426 4.047 20 0 EIADRP Cc1nc2c(s1)[C@H]([NH2+]CCCCCCC[NH+]1CCCC1)CCC2 ZINC000765777752 1055273935 /nfs/dbraw/zinc/27/39/35/1055273935.db2.gz XTPHZDVUPVWXKG-QGZVFWFLSA-N 2 0 335.561 4.465 20 0 EIADRP C(C1CCCCC1)[NH+]1CCC([NH2+][C@H]2CCOC3(CCCC3)C2)CC1 ZINC000127281825 1055376935 /nfs/dbraw/zinc/37/69/35/1055376935.db2.gz RKBZECUIZPKJOW-FQEVSTJZSA-N 2 0 334.548 4.113 20 0 EIADRP Cc1ccc([C@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)C2CC2)cc1 ZINC000091287595 1055543744 /nfs/dbraw/zinc/54/37/44/1055543744.db2.gz HYTDZJJAUSITFP-QFIPXVFZSA-N 2 0 338.495 4.176 20 0 EIADRP C[C@@H](Cc1ccccn1)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000655834871 1055703849 /nfs/dbraw/zinc/70/38/49/1055703849.db2.gz SDAZVOQWCISRHT-KRWDZBQOSA-N 2 0 331.548 4.281 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)C1CCC(C(F)(F)F)CC1 ZINC000475220693 1056296335 /nfs/dbraw/zinc/29/63/35/1056296335.db2.gz QJDCZERQKXQGRN-FHERZECASA-N 2 0 334.470 4.455 20 0 EIADRP S=c1ccn(C[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)c2ccccc12 ZINC000742169643 1058527989 /nfs/dbraw/zinc/52/79/89/1058527989.db2.gz FHXFYZAWNQJYBT-KRWDZBQOSA-N 2 0 341.524 4.136 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cn2ccc(=S)c3ccccc32)CC1 ZINC000766383560 1060316032 /nfs/dbraw/zinc/31/60/32/1060316032.db2.gz WHMMWRDRXBUUHT-UHFFFAOYSA-N 2 0 343.540 4.382 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1(c3ccc(Br)cc3)CCC1)C2 ZINC001169092141 1060647865 /nfs/dbraw/zinc/64/78/65/1060647865.db2.gz YKHIEHGREMMBFO-OSYLJGHBSA-N 2 0 349.316 4.043 20 0 EIADRP Cc1ccc2c(c1)c(C1CC[NH2+]CC1)cn2[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001169152678 1060670802 /nfs/dbraw/zinc/67/08/02/1060670802.db2.gz DFTOVYDWPSHTDL-REPLKXPHSA-N 2 0 337.511 4.214 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CC[C@H](c3ccc(OC(C)(C)C)cc3)C1)C2 ZINC001169160427 1060673243 /nfs/dbraw/zinc/67/32/43/1060673243.db2.gz FBUZOQODHKRDRY-VNTMZGSJSA-N 2 0 342.527 4.278 20 0 EIADRP CC(C)[PH+](CC[NH2+][C@@H]1CCCN(C(=O)c2ccccc2)C1)C(C)C ZINC001169752612 1060931575 /nfs/dbraw/zinc/93/15/75/1060931575.db2.gz VNCYDZVDFOMVIC-LJQANCHMSA-N 2 0 348.471 4.180 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cccc3cccnc32)C1 ZINC000078704630 217106189 /nfs/dbraw/zinc/10/61/89/217106189.db2.gz BRTAYIONMNVZOM-RTBURBONSA-N 2 0 337.511 4.321 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2c(F)cccc2F)CCCC1 ZINC000532219075 1032098305 /nfs/dbraw/zinc/09/83/05/1032098305.db2.gz KVGJJKXGTVTGDY-VKJFTORMSA-N 2 0 336.470 4.095 20 0 EIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000532226266 1032107028 /nfs/dbraw/zinc/10/70/28/1032107028.db2.gz RQZGUQQWKHFPKP-RBUKOAKNSA-N 2 0 328.525 4.272 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+]C2CC(c3ccccc3Cl)C2)cc1 ZINC000509670541 1032272608 /nfs/dbraw/zinc/27/26/08/1032272608.db2.gz KMKGEHMDOMYUBS-UHFFFAOYSA-N 2 0 328.887 4.437 20 0 EIADRP Cc1csc([C@@H](C)N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC000245707375 1032405308 /nfs/dbraw/zinc/40/53/08/1032405308.db2.gz MQXXGXRFTKJVJF-OWYHZJEWSA-N 2 0 341.524 4.298 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)C1CC(F)(F)C1 ZINC000529543742 1032433553 /nfs/dbraw/zinc/43/35/53/1032433553.db2.gz NDWNDUSWBSNAGA-XYJFISCASA-N 2 0 336.470 4.311 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(Cl)c(N)c(Cl)c2)C1 ZINC000760161694 1032484359 /nfs/dbraw/zinc/48/43/59/1032484359.db2.gz ZDVFOMBJNWWUQH-QWHCGFSZSA-N 2 0 344.330 4.347 20 0 EIADRP C[C@H]1C[NH+](CCCC[NH2+]Cc2ccc(C(C)(C)C)s2)C[C@H](C)O1 ZINC000533200162 1032544276 /nfs/dbraw/zinc/54/42/76/1032544276.db2.gz MSLORNNIHLLARD-HOTGVXAUSA-N 2 0 338.561 4.025 20 0 EIADRP Cc1nccn1CCCC[N@@H+](C)[C@H](C)c1nc2ccccc2s1 ZINC000179266921 1032556885 /nfs/dbraw/zinc/55/68/85/1032556885.db2.gz IAGFELJMGSGEEU-CQSZACIVSA-N 2 0 328.485 4.274 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccccc1F ZINC000180330741 1032602699 /nfs/dbraw/zinc/60/26/99/1032602699.db2.gz BTTHGCSMTREDEB-IBGZPJMESA-N 2 0 330.447 4.007 20 0 EIADRP COc1cc(-c2ccccc2)ccc1C[NH2+]C[C@H](C)Cn1ccnc1C ZINC000512431538 1032752657 /nfs/dbraw/zinc/75/26/57/1032752657.db2.gz FRRFSOJGORFCNI-KRWDZBQOSA-N 2 0 349.478 4.293 20 0 EIADRP CC[N@H+](C)C[C@@H]1CCN(Cc2c(OC(C)C)ccc3ccccc32)C1 ZINC000533469884 1032787550 /nfs/dbraw/zinc/78/75/50/1032787550.db2.gz MPIVYTSXCKPHGO-SFHVURJKSA-N 2 0 340.511 4.401 20 0 EIADRP CC[N@H+](Cc1ccc(-c2nc([C@H]([NH3+])CC(C)C)no2)cc1)C(C)C ZINC000339394861 1018836010 /nfs/dbraw/zinc/83/60/10/1018836010.db2.gz PLDABSMVLYNPDR-QGZVFWFLSA-N 2 0 330.476 4.013 20 0 EIADRP CSC1(C[NH2+][C@H](C)c2ccc(-c3ccccc3)o2)CC[NH+](C)CC1 ZINC000579780005 1018895693 /nfs/dbraw/zinc/89/56/93/1018895693.db2.gz YCLLHHWZBOMKMA-MRXNPFEDSA-N 2 0 344.524 4.425 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccc(SCC(F)(F)F)cc1 ZINC000925875237 1032796518 /nfs/dbraw/zinc/79/65/18/1032796518.db2.gz DDSAWTBCXUMOGA-SCRDCRAPSA-N 2 0 332.435 4.119 20 0 EIADRP CC(C)Oc1ccc([C@H](C)[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1Cl ZINC000643548348 1018926567 /nfs/dbraw/zinc/92/65/67/1018926567.db2.gz OCPYRTWUTJQFRO-HOCLYGCPSA-N 2 0 336.907 4.453 20 0 EIADRP CCOc1cccc2cc([C@@H](C)N[C@H]3CC[NH2+]C4(CCC4)C3)oc21 ZINC000643547886 1018930034 /nfs/dbraw/zinc/93/00/34/1018930034.db2.gz KGTZSWXJQMKMJK-ZBFHGGJFSA-N 2 0 328.456 4.157 20 0 EIADRP COc1ccc(-c2ccccc2)cc1CN1CCC[C@@H]([NH+](C)C)CC1 ZINC000432792863 1032812513 /nfs/dbraw/zinc/81/25/13/1032812513.db2.gz MYXWFJYZZIPHFQ-OAQYLSRUSA-N 2 0 338.495 4.278 20 0 EIADRP C[NH+](C)[C@@H]1CCC[N@H+](Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000432796465 1032818999 /nfs/dbraw/zinc/81/89/99/1032818999.db2.gz AMUDMZYRSALFLB-QGZVFWFLSA-N 2 0 332.488 4.470 20 0 EIADRP C([C@H]1CCOC1)[NH+]1CCC([NH2+]C2CCC(C3CCCCC3)CC2)CC1 ZINC000683472580 1020849568 /nfs/dbraw/zinc/84/95/68/1020849568.db2.gz RKBHSYXJKIWLBL-KMFTYDHNSA-N 2 0 348.575 4.216 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CS1 ZINC000655714694 1020912458 /nfs/dbraw/zinc/91/24/58/1020912458.db2.gz AMQNEZATMXAVIC-VQIMIIECSA-N 2 0 344.524 4.285 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)C1 ZINC000655804962 1020972306 /nfs/dbraw/zinc/97/23/06/1020972306.db2.gz HFBZSFJTQQHNLC-HYSWKAIVSA-N 2 0 327.299 4.374 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655806115 1020976261 /nfs/dbraw/zinc/97/62/61/1020976261.db2.gz PKFRQSJMWFXTAR-QILLFSRXSA-N 2 0 343.540 4.418 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000655805908 1020976412 /nfs/dbraw/zinc/97/64/12/1020976412.db2.gz URURYZRGZULPRK-VUCTXSBTSA-N 2 0 326.406 4.086 20 0 EIADRP c1ccc([C@H](C[C@H]2CCOC2)[NH2+]CCCCC[NH+]2CCCC2)cc1 ZINC000340479255 1021100960 /nfs/dbraw/zinc/10/09/60/1021100960.db2.gz LMFRNFMEDCPRGK-CTNGQTDRSA-N 2 0 330.516 4.010 20 0 EIADRP Cc1ccccc1[C@@H](CC(F)(F)F)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000683693640 1021104911 /nfs/dbraw/zinc/10/49/11/1021104911.db2.gz JMCXFBHOWNUIRW-RHSMWYFYSA-N 2 0 328.422 4.308 20 0 EIADRP CC1CC[NH+](CCC[C@@H]([NH2+][C@H]2CCCOC2)c2ccc(F)cc2)CC1 ZINC000340502095 1021156207 /nfs/dbraw/zinc/15/62/07/1021156207.db2.gz WRTYVDHZJVGGSB-LEWJYISDSA-N 2 0 348.506 4.148 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3c(O)cccc32)c1 ZINC000340519547 1021188091 /nfs/dbraw/zinc/18/80/91/1021188091.db2.gz MPXVEPCQBHKTHE-OAQYLSRUSA-N 2 0 338.495 4.400 20 0 EIADRP COc1cc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)ccc1OCC(C)C ZINC000892509665 1021310283 /nfs/dbraw/zinc/31/02/83/1021310283.db2.gz AEHSIOMRCUGANN-BPIHKTFHSA-N 2 0 346.515 4.006 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000472468661 1021389925 /nfs/dbraw/zinc/38/99/25/1021389925.db2.gz UFXMFZNGXWYSNS-GDBMZVCRSA-N 2 0 340.433 4.430 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc2c(c1)CCO2 ZINC000177728471 1021619075 /nfs/dbraw/zinc/61/90/75/1021619075.db2.gz HMSJIOFRSSIJQH-KRWDZBQOSA-N 2 0 336.479 4.068 20 0 EIADRP COc1ccc2oc([C@@H](C)[NH2+]CC[C@@H]3CCC[N@H+](C)C3)c(C)c2c1 ZINC000414169284 1022018911 /nfs/dbraw/zinc/01/89/11/1022018911.db2.gz BAVQPIYAIUVMGJ-CVEARBPZSA-N 2 0 330.472 4.132 20 0 EIADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@H](c2cc3ccccc3o2)c2cccnc2)C1 ZINC000414170383 1022021042 /nfs/dbraw/zinc/02/10/42/1022021042.db2.gz BYYWSLMPMFOGJZ-VGSWGCGISA-N 2 0 349.478 4.239 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000414182581 1022055152 /nfs/dbraw/zinc/05/51/52/1022055152.db2.gz MWVJOXUYTMBSTE-ROUUACIJSA-N 2 0 339.483 4.256 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccc(F)c(F)c1 ZINC000171126291 1022073394 /nfs/dbraw/zinc/07/33/94/1022073394.db2.gz YOVYXWQNXUUGAF-HNNXBMFYSA-N 2 0 348.437 4.146 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1csc(-c2ccccc2F)n1 ZINC000414193963 1022088687 /nfs/dbraw/zinc/08/86/87/1022088687.db2.gz UCIIGDPNIDCMKY-LSDHHAIUSA-N 2 0 347.503 4.332 20 0 EIADRP CCOc1cccc2cc([C@@H](C)[NH2+]CC[C@H]3CCC[N@H+](C)C3)oc21 ZINC000414199448 1022106187 /nfs/dbraw/zinc/10/61/87/1022106187.db2.gz XBBOVPBWQIZPGU-HZPDHXFCSA-N 2 0 330.472 4.214 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](CCCOc2ccc(F)cc2)CC1 ZINC000613491445 1022158009 /nfs/dbraw/zinc/15/80/09/1022158009.db2.gz SBHNLSQDPNVSJX-UHFFFAOYSA-N 2 0 336.495 4.039 20 0 EIADRP c1c[nH]c([C@H]([NH2+]CCCCCCC[NH+]2CCCC2)c2ccccc2)n1 ZINC000275916572 1022196474 /nfs/dbraw/zinc/19/64/74/1022196474.db2.gz VIUIRVFKQZBZHB-HXUWFJFHSA-N 2 0 340.515 4.135 20 0 EIADRP c1ccc(CC2(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)CCCCC2)cc1 ZINC000471592359 1022200923 /nfs/dbraw/zinc/20/09/23/1022200923.db2.gz DJPQTPURGMURLR-LEWJYISDSA-N 2 0 326.528 4.396 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc(C[N@H+]3CCC[C@H](C)C3)cc2)cnc1F ZINC000892574869 1022275348 /nfs/dbraw/zinc/27/53/48/1022275348.db2.gz OTAJSXGKRIWZPV-INIZCTEOSA-N 2 0 341.474 4.051 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cc(-c3ccc(F)cc3)no2)CC1 ZINC000047973150 1022308962 /nfs/dbraw/zinc/30/89/62/1022308962.db2.gz SJWCEZLZHSHHAN-UHFFFAOYSA-N 2 0 345.462 4.035 20 0 EIADRP CO[C@@](C)([C@H](C)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)C1CC1 ZINC000414249798 1022311048 /nfs/dbraw/zinc/31/10/48/1022311048.db2.gz XINUBNHKNBESPJ-WGJNNHPISA-N 2 0 344.543 4.223 20 0 EIADRP FC1(F)CC[C@H]([NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@@H]32)C1 ZINC000651300802 1022400751 /nfs/dbraw/zinc/40/07/51/1022400751.db2.gz GENWZPIAOBJHOG-MANSERQUSA-N 2 0 334.454 4.207 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCOC3(CCCC3)C2)CC1 ZINC000127346696 1022666284 /nfs/dbraw/zinc/66/62/84/1022666284.db2.gz CNGIIIIRNUJOFB-MISYRCLQSA-N 2 0 334.548 4.111 20 0 EIADRP Cc1cc(C[NH+]2CCC(CC[NH+](C)C)CC2)cc(C)c1OC(F)F ZINC000511507674 1022684239 /nfs/dbraw/zinc/68/42/39/1022684239.db2.gz QTBGXGBPUAOISS-UHFFFAOYSA-N 2 0 340.458 4.069 20 0 EIADRP Cc1c(F)cccc1-c1ccc(C[N@H+]2CCCC23CC[NH+](C)CC3)o1 ZINC000472597087 1022739753 /nfs/dbraw/zinc/73/97/53/1022739753.db2.gz JJOPIVZHKLJPRY-UHFFFAOYSA-N 2 0 342.458 4.454 20 0 EIADRP C[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[N@H+](C)CCC[NH3+] ZINC000317109980 1022790448 /nfs/dbraw/zinc/79/04/48/1022790448.db2.gz CVWPZRVLZFVCNC-VIFPVBQESA-N 2 0 328.300 4.066 20 0 EIADRP C[N@H+](Cc1ccc(-c2ccccc2)s1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000581004341 1022793773 /nfs/dbraw/zinc/79/37/73/1022793773.db2.gz DKGDKIKZFOVCIR-JWTNVVGKSA-N 2 0 326.509 4.472 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](C)[C@@H]1c1ccccc1)c1ccc(Cl)nc1 ZINC000378513143 1022853406 /nfs/dbraw/zinc/85/34/06/1022853406.db2.gz AGOMEDHCRQTWOU-POZUXBRTSA-N 2 0 329.875 4.079 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cc(C3CC3)no2)CC1 ZINC000660006658 1022853590 /nfs/dbraw/zinc/85/35/90/1022853590.db2.gz RAMZUYLLDVTOFV-MRXNPFEDSA-N 2 0 331.504 4.029 20 0 EIADRP CC[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000545459275 1022854908 /nfs/dbraw/zinc/85/49/08/1022854908.db2.gz MRQLMIBKDXHVOI-ZFWWWQNUSA-N 2 0 332.410 4.009 20 0 EIADRP CSC1(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)CCC1 ZINC000581162714 1022860361 /nfs/dbraw/zinc/86/03/61/1022860361.db2.gz ANTFHTUVIQPQCG-UHFFFAOYSA-N 2 0 344.568 4.260 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(Cl)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000382069714 1022870030 /nfs/dbraw/zinc/87/00/30/1022870030.db2.gz RWYAIVIHTITHSO-APWZRJJASA-N 2 0 328.887 4.340 20 0 EIADRP C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548154386 1022871781 /nfs/dbraw/zinc/87/17/81/1022871781.db2.gz NZNDNIVPHMBIEU-HSQYWUDLSA-N 2 0 335.495 4.033 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+][C@H]1CCSc2c(F)cccc21)c1ccccc1 ZINC000423495663 1022923904 /nfs/dbraw/zinc/92/39/04/1022923904.db2.gz CKEUZKPUJXUXIN-MSOLQXFVSA-N 2 0 330.472 4.432 20 0 EIADRP CCn1cc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)cn1 ZINC000156181365 1023092013 /nfs/dbraw/zinc/09/20/13/1023092013.db2.gz HVBCAFDYUAKRLT-ROUUACIJSA-N 2 0 340.515 4.128 20 0 EIADRP C[C@H]([NH2+]CCCOC1CCCCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548162959 1023097242 /nfs/dbraw/zinc/09/72/42/1023097242.db2.gz GGJHBQXIDWBDBC-FPOVZHCZSA-N 2 0 344.543 4.226 20 0 EIADRP C[C@@H]([NH2+]CCCOC1CCCCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548162958 1023097885 /nfs/dbraw/zinc/09/78/85/1023097885.db2.gz GGJHBQXIDWBDBC-CTNGQTDRSA-N 2 0 344.543 4.226 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1OC(F)F)c1cccc(C[NH+](C)C)c1 ZINC000924591801 1023127583 /nfs/dbraw/zinc/12/75/83/1023127583.db2.gz KKVXFQRHWPSEAX-CQSZACIVSA-N 2 0 334.410 4.200 20 0 EIADRP C[C@H](NC1CC([NH+]2CCCCC2)C1)c1cccc(-c2ccncc2)c1 ZINC000376595326 1023151359 /nfs/dbraw/zinc/15/13/59/1023151359.db2.gz MMNICNXREUKKAQ-YTXWROIDSA-N 2 0 335.495 4.416 20 0 EIADRP C[C@]1(C[NH2+]Cc2cnc3ccccc3c2)CC[N@H+](Cc2ccccc2)C1 ZINC000311774214 1023256586 /nfs/dbraw/zinc/25/65/86/1023256586.db2.gz JUORDUDQWAULLH-HSZRJFAPSA-N 2 0 345.490 4.237 20 0 EIADRP C[C@@H]([NH2+][C@H](Cc1ccccc1)c1cccs1)C1CC[NH+](C)CC1 ZINC000090015779 1023263089 /nfs/dbraw/zinc/26/30/89/1023263089.db2.gz SWZVLKGEOMJOQA-VQIMIIECSA-N 2 0 328.525 4.352 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417338814 1023271783 /nfs/dbraw/zinc/27/17/83/1023271783.db2.gz ZFWHXMSZUDDDLK-FRYIKTPZSA-N 2 0 340.536 4.352 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417338810 1023272038 /nfs/dbraw/zinc/27/20/38/1023272038.db2.gz ZFWHXMSZUDDDLK-BTHPGYMESA-N 2 0 340.536 4.352 20 0 EIADRP C[C@@H]([NH2+]CCc1nc(C2CCCCC2)cs1)C1CC[NH+](C)CC1 ZINC000090046556 1023290629 /nfs/dbraw/zinc/29/06/29/1023290629.db2.gz QSPJTERGTPJRHR-OAHLLOKOSA-N 2 0 335.561 4.053 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccc(OCc2ccccc2F)cc1 ZINC000415013310 1023388881 /nfs/dbraw/zinc/38/88/81/1023388881.db2.gz KLTWZHIXHRNSHK-MRXNPFEDSA-N 2 0 330.447 4.012 20 0 EIADRP COc1cccc(SCC[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC000660257463 1023396842 /nfs/dbraw/zinc/39/68/42/1023396842.db2.gz TZZSCRKNKKBFNG-IAGOWNOFSA-N 2 0 348.556 4.030 20 0 EIADRP CSc1ccccc1C[C@@H](C)[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415050066 1023407924 /nfs/dbraw/zinc/40/79/24/1023407924.db2.gz IFQDREHFLKXPNV-APWZRJJASA-N 2 0 328.525 4.409 20 0 EIADRP CSc1ccccc1C[C@H](C)[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000415050070 1023408442 /nfs/dbraw/zinc/40/84/42/1023408442.db2.gz IFQDREHFLKXPNV-QFBILLFUSA-N 2 0 328.525 4.409 20 0 EIADRP COc1ccc(C[C@H](C)C[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1F ZINC000415057565 1023410526 /nfs/dbraw/zinc/41/05/26/1023410526.db2.gz RQUQIJZXASCAKQ-OXJNMPFZSA-N 2 0 344.474 4.083 20 0 EIADRP Cc1nc2ccc(C[NH2+][C@H](CCC[NH3+])c3ccccc3)cc2s1 ZINC000415054458 1023411310 /nfs/dbraw/zinc/41/13/10/1023411310.db2.gz NMJNZLOHXWESGJ-QGZVFWFLSA-N 2 0 325.481 4.175 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccccc1Br)c1ccccc1 ZINC000415061473 1023413916 /nfs/dbraw/zinc/41/39/16/1023413916.db2.gz YEWMEZMJKWGKPX-QGZVFWFLSA-N 2 0 333.273 4.019 20 0 EIADRP CCO[C@H]1C[C@@H]([N@H+](C)Cc2cccc(C[NH+]3CCCCC3)c2)C1(C)C ZINC001167473937 1023425514 /nfs/dbraw/zinc/42/55/14/1023425514.db2.gz NOZIBWOICQMNIT-RTWAWAEBSA-N 2 0 344.543 4.308 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc2c(c1)CCC2 ZINC000656683464 1023430752 /nfs/dbraw/zinc/43/07/52/1023430752.db2.gz LVJUVNMRJUBZAW-SFHVURJKSA-N 2 0 349.522 4.133 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cccc(Cl)c1 ZINC000656683545 1023439255 /nfs/dbraw/zinc/43/92/55/1023439255.db2.gz NDAYWABDTBGLJF-INIZCTEOSA-N 2 0 343.902 4.298 20 0 EIADRP Cc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1C ZINC000341260209 1023468551 /nfs/dbraw/zinc/46/85/51/1023468551.db2.gz DIHLMNSXSANSPA-UHFFFAOYSA-N 2 0 338.495 4.066 20 0 EIADRP CCC1(C[NH2+][C@H]2C[C@@H](C)O[C@@H](C)C2)CC[NH+](Cc2ccccc2)CC1 ZINC000581647794 1023485745 /nfs/dbraw/zinc/48/57/45/1023485745.db2.gz OVWFUWYOJXQUHA-KXTWHKPSSA-N 2 0 344.543 4.224 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C[C@@H]1C ZINC000341271663 1023486537 /nfs/dbraw/zinc/48/65/37/1023486537.db2.gz ONFUDJDZTKXOEE-ZIFCJYIRSA-N 2 0 330.516 4.074 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1OCC ZINC000500077954 1023487457 /nfs/dbraw/zinc/48/74/57/1023487457.db2.gz BGFCANRRNSUHCE-HNNXBMFYSA-N 2 0 348.531 4.444 20 0 EIADRP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)C1 ZINC000684378553 1023585696 /nfs/dbraw/zinc/58/56/96/1023585696.db2.gz MJOCKHSHCOBULE-LEWJYISDSA-N 2 0 330.516 4.110 20 0 EIADRP CO[C@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)C1 ZINC000684378555 1023586147 /nfs/dbraw/zinc/58/61/47/1023586147.db2.gz MJOCKHSHCOBULE-RTWAWAEBSA-N 2 0 330.516 4.110 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1ccc(Cl)cc1F ZINC000398038056 1023659064 /nfs/dbraw/zinc/65/90/64/1023659064.db2.gz QQPCJQZBGFWZKF-MGPUTAFESA-N 2 0 346.877 4.479 20 0 EIADRP COc1cccc([C@@H](C)[NH2+]C2CCN(Cc3ccsc3)CC2)c1 ZINC000364373194 1023690635 /nfs/dbraw/zinc/69/06/35/1023690635.db2.gz GCCXWFVACDCQNZ-OAHLLOKOSA-N 2 0 330.497 4.072 20 0 EIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1N[C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000390625720 1023736039 /nfs/dbraw/zinc/73/60/39/1023736039.db2.gz HXFSLUXDESUTEZ-VSKRKVRLSA-N 2 0 349.522 4.022 20 0 EIADRP Cn1cncc1CC[NH2+][C@@H](CCCc1ccccc1)c1ccccc1 ZINC000471763868 1023818220 /nfs/dbraw/zinc/81/82/20/1023818220.db2.gz XTXFGUUBAVCISG-QFIPXVFZSA-N 2 0 333.479 4.316 20 0 EIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2CCCC23CCOCC3)c1 ZINC000500426718 1023822359 /nfs/dbraw/zinc/82/23/59/1023822359.db2.gz ITMIUWOKQLZIQQ-OAQYLSRUSA-N 2 0 342.527 4.111 20 0 EIADRP CC[C@H](CC(F)F)C[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(C)s2)C1 ZINC000660496231 1023868727 /nfs/dbraw/zinc/86/87/27/1023868727.db2.gz FSTHSQXEIAAZCJ-HZPDHXFCSA-N 2 0 344.515 4.492 20 0 EIADRP CC(C)c1nc(C[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)c2ccccn21 ZINC000651621579 1024045620 /nfs/dbraw/zinc/04/56/20/1024045620.db2.gz WPFBXQNFABFRBI-UHFFFAOYSA-N 2 0 342.531 4.010 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+]Cc2cccc3ccsc32)cc1 ZINC000651862924 1024118090 /nfs/dbraw/zinc/11/80/90/1024118090.db2.gz NLKNVBPAGJYSCA-UHFFFAOYSA-N 2 0 340.492 4.132 20 0 EIADRP c1c2cnccc2oc1C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000651669742 1024128034 /nfs/dbraw/zinc/12/80/34/1024128034.db2.gz GUYZHKRMMOPEQQ-UHFFFAOYSA-N 2 0 335.451 4.104 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc(Br)c(C)c1 ZINC000091467222 1024270884 /nfs/dbraw/zinc/27/08/84/1024270884.db2.gz OTCFGZIYYMAOKT-HNNXBMFYSA-N 2 0 341.337 4.358 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000510735625 1024371989 /nfs/dbraw/zinc/37/19/89/1024371989.db2.gz ONUHUSMTAVQWHW-JLSDUUJJSA-N 2 0 340.433 4.243 20 0 EIADRP Cc1cc(OCCC[C@H](C)[NH2+][C@H]2CCN(C)[C@H](C)C2)ccc1Cl ZINC000510738272 1024380109 /nfs/dbraw/zinc/38/01/09/1024380109.db2.gz VGMPBVKTDJRKKI-BBWFWOEESA-N 2 0 338.923 4.268 20 0 EIADRP CCSc1cccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC000473138878 1024381730 /nfs/dbraw/zinc/38/17/30/1024381730.db2.gz HGCCRADDZDMVMT-YLJYHZDGSA-N 2 0 330.541 4.247 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1C[C@@H](C)C[C@H]1c1ccccc1 ZINC000348835694 1024723206 /nfs/dbraw/zinc/72/32/06/1024723206.db2.gz AVRCSSOZFISROU-KKSFZXQISA-N 2 0 332.451 4.159 20 0 EIADRP COC1CCC(CC[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000548485646 1024838214 /nfs/dbraw/zinc/83/82/14/1024838214.db2.gz ASZZJZHNAJOVFY-UMDHHFKGSA-N 2 0 344.543 4.082 20 0 EIADRP CC(C)(C)[C@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc(F)cc1 ZINC000662281010 1025026215 /nfs/dbraw/zinc/02/62/15/1025026215.db2.gz HFXGIYOSWXMQFC-HXUWFJFHSA-N 2 0 326.459 4.348 20 0 EIADRP c1ccc(C[N@H+]2CCC[C@H](C[NH2+][C@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000684611409 1025056131 /nfs/dbraw/zinc/05/61/31/1025056131.db2.gz GLMNPPYBBXFDNC-OFNKIYASSA-N 2 0 349.522 4.425 20 0 EIADRP CCc1cc(OC)ccc1C[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000500445957 1025363775 /nfs/dbraw/zinc/36/37/75/1025363775.db2.gz JFPUAMWVUVKSME-UHFFFAOYSA-N 2 0 330.516 4.002 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@H](Oc2cccc(OC)c2)C1 ZINC001167824727 1025586987 /nfs/dbraw/zinc/58/69/87/1025586987.db2.gz FZDOOYYTJGQFCV-NQIIRXRSSA-N 2 0 348.531 4.049 20 0 EIADRP COc1cccc(CCC[N@@H+]2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000303939293 1025589646 /nfs/dbraw/zinc/58/96/46/1025589646.db2.gz SIYIDRPZKPZNRG-OAQYLSRUSA-N 2 0 344.543 4.072 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(Oc2ccc(F)cc2)CC1 ZINC001167825207 1025597414 /nfs/dbraw/zinc/59/74/14/1025597414.db2.gz HKIMDLVZUTZJDP-QGZVFWFLSA-N 2 0 336.495 4.179 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(Oc2ccc(F)cc2)CC1 ZINC001167825206 1025599983 /nfs/dbraw/zinc/59/99/83/1025599983.db2.gz HKIMDLVZUTZJDP-KRWDZBQOSA-N 2 0 336.495 4.179 20 0 EIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000156751069 1025602271 /nfs/dbraw/zinc/60/22/71/1025602271.db2.gz KONLRZOCZDDPFA-IRXDYDNUSA-N 2 0 330.516 4.184 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC2(CC(OCC3CC3)C2)CC1 ZINC001167826650 1025622483 /nfs/dbraw/zinc/62/24/83/1025622483.db2.gz PMXYRDDAWLUQBO-SFHVURJKSA-N 2 0 336.564 4.168 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@H+]1C[C@H]2[C@@H](C1)CCC[C@@H]2OCC1CC1 ZINC001167827666 1025668635 /nfs/dbraw/zinc/66/86/35/1025668635.db2.gz UNZHZGIPXRADAH-NRDMVMEKSA-N 2 0 336.564 4.024 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(c2ccc(OC)cc2)CC1 ZINC001167827923 1025675349 /nfs/dbraw/zinc/67/53/49/1025675349.db2.gz ZMUBFNJVHHXYJL-SFHVURJKSA-N 2 0 332.532 4.385 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(n2cnc3ccccc32)CC1 ZINC001167833963 1025808287 /nfs/dbraw/zinc/80/82/87/1025808287.db2.gz GPBDWENBPMGJJQ-GOSISDBHSA-N 2 0 342.531 4.184 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC2(CC(=O)c3ccccc32)CC1 ZINC001167835858 1025839299 /nfs/dbraw/zinc/83/92/99/1025839299.db2.gz USYGBDJFDSODEV-GOSISDBHSA-N 2 0 342.527 4.117 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCN([C@H](C)c2ccc(F)cc2)CC1 ZINC001167835857 1025840385 /nfs/dbraw/zinc/84/03/85/1025840385.db2.gz URHYHUJXAIJPTP-RTBURBONSA-N 2 0 349.538 4.015 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]CC[C@@H]3C[NH2+]C[C@H]3C)cs2)cs1 ZINC000925802182 1025843515 /nfs/dbraw/zinc/84/35/15/1025843515.db2.gz YSXAGSALKAVBKS-YRGRVCCFSA-N 2 0 335.542 4.076 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(Sc2ccncc2)CC1 ZINC001167838108 1025850144 /nfs/dbraw/zinc/85/01/44/1025850144.db2.gz QGOGTUDXXMGQBQ-KRWDZBQOSA-N 2 0 335.561 4.149 20 0 EIADRP C[C@H]1C[N@H+](CCC[NH2+][C@H](c2ccccc2)C2CCCC2)CCCO1 ZINC000432404666 1025870610 /nfs/dbraw/zinc/87/06/10/1025870610.db2.gz FFCPEKVNRQKPJN-GHTZIAJQSA-N 2 0 330.516 4.008 20 0 EIADRP CC(C)[C@@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(Cl)cc1 ZINC000432412235 1025883204 /nfs/dbraw/zinc/88/32/04/1025883204.db2.gz FSAQSRXSGVXEEL-VQIMIIECSA-N 2 0 338.923 4.128 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCN(C2CC2)[C@H](c2ccccc2)C1)c1ccncc1 ZINC000638718847 1026034140 /nfs/dbraw/zinc/03/41/40/1026034140.db2.gz MMLXTZDIKYUINP-ZNLUXHQJSA-N 2 0 335.495 4.143 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCc3ccc(F)cc32)c1 ZINC000344181392 1026099954 /nfs/dbraw/zinc/09/99/54/1026099954.db2.gz ZJFRTRFIFWEDLM-OAQYLSRUSA-N 2 0 326.459 4.445 20 0 EIADRP CC1CC[NH+](CCC[C@H]([NH2+]C[C@@H]2CCCO2)c2ccc(F)cc2)CC1 ZINC000344182327 1026104601 /nfs/dbraw/zinc/10/46/01/1026104601.db2.gz HBEQBOARFGLJLE-SFTDATJTSA-N 2 0 348.506 4.148 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cc3ccncc3s2)c1 ZINC000657333084 1026138815 /nfs/dbraw/zinc/13/88/15/1026138815.db2.gz YRDYLXAVHOTYET-UHFFFAOYSA-N 2 0 339.508 4.426 20 0 EIADRP Fc1ccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CCC2)cc1 ZINC001167974371 1026173872 /nfs/dbraw/zinc/17/38/72/1026173872.db2.gz YFYCUUBXCJOAPZ-IHWFROFDSA-N 2 0 328.475 4.200 20 0 EIADRP Cc1cncc(C[NH+]2CCC3(CCC[N@@H+](C4CCCC4)C3)CC2)c1 ZINC001279573392 1026278400 /nfs/dbraw/zinc/27/84/00/1026278400.db2.gz CBGUSAXXDREBSG-UHFFFAOYSA-N 2 0 327.516 4.011 20 0 EIADRP CC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CCC(F)(F)CC1 ZINC001167978531 1026344977 /nfs/dbraw/zinc/34/49/77/1026344977.db2.gz OKYHUPGZRFUIPS-ALOPSCKCSA-N 2 0 326.475 4.197 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccccc2OCC2CC2)CC1 ZINC000506880882 1026483640 /nfs/dbraw/zinc/48/36/40/1026483640.db2.gz BKHXPYUZJHFQIL-UHFFFAOYSA-N 2 0 330.516 4.029 20 0 EIADRP C[NH+](C)CC1CC[NH+](Cc2ccc(-c3ccccc3Cl)o2)CC1 ZINC000506943778 1026529476 /nfs/dbraw/zinc/52/94/76/1026529476.db2.gz QXRZSNVUKKNSDD-UHFFFAOYSA-N 2 0 332.875 4.374 20 0 EIADRP COCc1csc(C[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC000657416072 1026569871 /nfs/dbraw/zinc/56/98/71/1026569871.db2.gz PMHZIWPKFFUQHZ-UHFFFAOYSA-N 2 0 336.545 4.027 20 0 EIADRP Cc1ccc2cc(C[NH2+][C@H](C)[C@H]3CCC[N@@H+](C4CCC4)C3)[nH]c2c1 ZINC000657429839 1026641056 /nfs/dbraw/zinc/64/10/56/1026641056.db2.gz LMEDEXIBHHNPJC-AEFFLSMTSA-N 2 0 325.500 4.219 20 0 EIADRP Cc1ccc2cc(C[NH2+][C@H](C)[C@@H]3CCC[N@@H+](C4CCC4)C3)[nH]c2c1 ZINC000657429843 1026641198 /nfs/dbraw/zinc/64/11/98/1026641198.db2.gz LMEDEXIBHHNPJC-SJLPKXTDSA-N 2 0 325.500 4.219 20 0 EIADRP CSC1(C[NH2+][C@H](C)c2ccc(C(F)(F)F)cc2)CC[NH+](C)CC1 ZINC000582517282 1026745742 /nfs/dbraw/zinc/74/57/42/1026745742.db2.gz UYPYKISWXBCDJJ-CYBMUJFWSA-N 2 0 346.462 4.183 20 0 EIADRP CC(C)[NH+]1CCC([N@H+](C)CCCOc2cccc3ccccc32)CC1 ZINC000507362353 1026765969 /nfs/dbraw/zinc/76/59/69/1026765969.db2.gz QVHOZDZHASZPIN-UHFFFAOYSA-N 2 0 340.511 4.413 20 0 EIADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000507400939 1026787125 /nfs/dbraw/zinc/78/71/25/1026787125.db2.gz KJOIHCYTFCGKCN-CQSZACIVSA-N 2 0 344.421 4.010 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]CC2(C)CC[NH+](C)CC2)cc1F ZINC000507446437 1026797697 /nfs/dbraw/zinc/79/76/97/1026797697.db2.gz UFOVWFZMYBATAM-HKUYNNGSSA-N 2 0 348.506 4.182 20 0 EIADRP C[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(SCC(F)F)cc1 ZINC000507476220 1026808812 /nfs/dbraw/zinc/80/88/12/1026808812.db2.gz JJDBWBOZMLZAKP-CQSZACIVSA-N 2 0 342.499 4.426 20 0 EIADRP CCOc1ccc([C@@H](CC)[NH2+]C2CCN(CC)CC2)cc1OCC ZINC000159316298 1026810137 /nfs/dbraw/zinc/81/01/37/1026810137.db2.gz VNHBORYJYUWWDN-GOSISDBHSA-N 2 0 334.504 4.009 20 0 EIADRP CCc1cccnc1[C@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000507497247 1026811321 /nfs/dbraw/zinc/81/13/21/1026811321.db2.gz RGKICKCOZBNIOA-SFHVURJKSA-N 2 0 337.511 4.207 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH2+]C(C)(C)CCC[NH+](C)C)cc1 ZINC000657482465 1026839139 /nfs/dbraw/zinc/83/91/39/1026839139.db2.gz XSIJKHFSCVVPFD-UHFFFAOYSA-N 2 0 331.529 4.329 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+][C@H]3CCCc4cccnc43)CC2)c1 ZINC000684955982 1026892815 /nfs/dbraw/zinc/89/28/15/1026892815.db2.gz UWNAFWOJYIVLQC-IBGZPJMESA-N 2 0 341.524 4.022 20 0 EIADRP CC1CC[NH+](Cc2cccc(C[NH2+][C@H]3CCCc4cccnc43)c2)CC1 ZINC000684956086 1026892833 /nfs/dbraw/zinc/89/28/33/1026892833.db2.gz YZGBFFFZWJQVQD-QFIPXVFZSA-N 2 0 349.522 4.481 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+][C@H]2CCCc3cccnc32)C[N@@H+]1Cc1ccccc1 ZINC000684960970 1026899613 /nfs/dbraw/zinc/89/96/13/1026899613.db2.gz VVQREQUABORPIE-CBQOVEMMSA-N 2 0 349.522 4.349 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)cc1 ZINC000519707717 1026965770 /nfs/dbraw/zinc/96/57/70/1026965770.db2.gz GCRBTZWIIHMIQS-GOSISDBHSA-N 2 0 349.503 4.436 20 0 EIADRP CSCCCC[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000925093160 1027028759 /nfs/dbraw/zinc/02/87/59/1027028759.db2.gz AVAQMOSKYCOETB-IHWFROFDSA-N 2 0 332.557 4.305 20 0 EIADRP C[C@H]([NH2+]CCC[NH+]1CCCCC1)[C@H](C)c1nc2ccccc2s1 ZINC000474477164 1027111111 /nfs/dbraw/zinc/11/11/11/1027111111.db2.gz QSWVSIHXSXNXPD-HOTGVXAUSA-N 2 0 331.529 4.254 20 0 EIADRP C[C@@H](c1nc2ccccc2s1)[C@H](C)[NH2+]CCC[NH+]1CCCCC1 ZINC000474477163 1027111370 /nfs/dbraw/zinc/11/13/70/1027111370.db2.gz QSWVSIHXSXNXPD-CVEARBPZSA-N 2 0 331.529 4.254 20 0 EIADRP FC(F)c1ccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000657613983 1027302712 /nfs/dbraw/zinc/30/27/12/1027302712.db2.gz ZXHPTYJQMXMRKA-UHFFFAOYSA-N 2 0 345.437 4.021 20 0 EIADRP Cc1cc(NC[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)cc[nH+]1 ZINC000302504985 1027322258 /nfs/dbraw/zinc/32/22/58/1027322258.db2.gz WBRVNHILBAMCQG-RDTXWAMCSA-N 2 0 333.838 4.287 20 0 EIADRP CC1(C)CC([NH3+])CC(C)(C)N1c1ccc(SC2CC[NH2+]CC2)cc1 ZINC001167626757 1027489313 /nfs/dbraw/zinc/48/93/13/1027489313.db2.gz SIHDXWSHSSPXRA-UHFFFAOYSA-N 2 0 347.572 4.015 20 0 EIADRP Clc1ccc(CCC[N@@H+]2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)cc1 ZINC000441410718 1027527010 /nfs/dbraw/zinc/52/70/10/1027527010.db2.gz LTMXLAKPEYUKPX-FXAWDEMLSA-N 2 0 332.919 4.221 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1 ZINC000474812437 1027534041 /nfs/dbraw/zinc/53/40/41/1027534041.db2.gz DLGLOJSPEFFUFJ-CVEARBPZSA-N 2 0 344.474 4.178 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1c[nH]c2cc(F)ccc21 ZINC000120826390 1027590827 /nfs/dbraw/zinc/59/08/27/1027590827.db2.gz NIGQTMFJEVWDGI-CYBMUJFWSA-N 2 0 343.421 4.359 20 0 EIADRP C[C@@H]([NH2+][C@@H](CC(F)(F)F)c1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC000090969070 1027637871 /nfs/dbraw/zinc/63/78/71/1027637871.db2.gz JFRPPHGBXUNQKX-WBMJQRKESA-N 2 0 332.385 4.139 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1OC ZINC000152465775 1027661748 /nfs/dbraw/zinc/66/17/48/1027661748.db2.gz LGEWIZXJLJYNJQ-SJORKVTESA-N 2 0 346.515 4.009 20 0 EIADRP C[N@H+]1CC=C(C[NH2+]CCCCc2ccc(Cl)c(Cl)c2)CC1 ZINC000474881953 1027729006 /nfs/dbraw/zinc/72/90/06/1027729006.db2.gz SPMRLWHJRGUKQI-UHFFFAOYSA-N 2 0 327.299 4.168 20 0 EIADRP CC(C)[C@@H](C[NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000474881473 1027729066 /nfs/dbraw/zinc/72/90/66/1027729066.db2.gz RNVHAYUHFPOBBL-JOCHJYFZSA-N 2 0 337.511 4.327 20 0 EIADRP Fc1cccc([C@H]2CC[N@@H+](C3C[C@H]4CC[C@@H](C3)[NH+]4CC3CC3)C2)c1 ZINC001167995011 1027736587 /nfs/dbraw/zinc/73/65/87/1027736587.db2.gz TYMFMBCQCZUTSG-YBVXAUJNSA-N 2 0 328.475 4.020 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1 ZINC000474892989 1027747750 /nfs/dbraw/zinc/74/77/50/1027747750.db2.gz VXWLFKQJZKSFSH-SJORKVTESA-N 2 0 326.484 4.039 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1cncs1 ZINC000121642794 1027797051 /nfs/dbraw/zinc/79/70/51/1027797051.db2.gz DEMKXWAVXUXTST-MRXNPFEDSA-N 2 0 329.513 4.370 20 0 EIADRP CCCc1nc(C)c(C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)o1 ZINC000428366736 1027803484 /nfs/dbraw/zinc/80/34/84/1027803484.db2.gz ZABQIFAWVPZULD-KRWDZBQOSA-N 2 0 347.547 4.412 20 0 EIADRP c1ccc(C[NH+]2CCC[C@@H]3C[N@H+](CCCc4cccnc4)CC[C@H]32)cc1 ZINC001167646332 1027827506 /nfs/dbraw/zinc/82/75/06/1027827506.db2.gz AUFPPRKHFPYAQU-DHIUTWEWSA-N 2 0 349.522 4.001 20 0 EIADRP Fc1cccc([C@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)c1 ZINC001167996133 1027847185 /nfs/dbraw/zinc/84/71/85/1027847185.db2.gz XEGOZEJYUMDGKC-JGUMPVPUSA-N 2 0 328.475 4.368 20 0 EIADRP CC(C)[N@@H+]1CC[C@H](C[NH2+][C@@H](C)CCc2cccc(C(F)(F)F)c2)C1 ZINC000583052205 1027904242 /nfs/dbraw/zinc/90/42/42/1027904242.db2.gz XZOKBYUPMBPEDD-DOTOQJQBSA-N 2 0 342.449 4.346 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)CCc2cccc(C(F)(F)F)c2)C1 ZINC000583052207 1027904855 /nfs/dbraw/zinc/90/48/55/1027904855.db2.gz XZOKBYUPMBPEDD-RDJZCZTQSA-N 2 0 342.449 4.346 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000548786381 1027930906 /nfs/dbraw/zinc/93/09/06/1027930906.db2.gz UQZZIFGAYMJBOR-MRXNPFEDSA-N 2 0 344.449 4.028 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)cc1Cl ZINC000522546633 1028006819 /nfs/dbraw/zinc/00/68/19/1028006819.db2.gz XDWMPKPMAMJBFI-SUMWQHHRSA-N 2 0 326.912 4.366 20 0 EIADRP Cc1cccc2nc(C3CC[NH+](CC[C@H]4CCCC[N@H+]4C)CC3)oc21 ZINC000444780293 1028045013 /nfs/dbraw/zinc/04/50/13/1028045013.db2.gz FSVBBTLLUBEHLF-GOSISDBHSA-N 2 0 341.499 4.190 20 0 EIADRP CCCCc1oc2ccccc2c1C[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000324148538 1028161939 /nfs/dbraw/zinc/16/19/39/1028161939.db2.gz AXPCNKZXIZKNJI-INIZCTEOSA-N 2 0 326.484 4.349 20 0 EIADRP Cc1cccc([C@@H](O)C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)c1 ZINC001167660089 1028268336 /nfs/dbraw/zinc/26/83/36/1028268336.db2.gz ZFKIRFZPWGYURR-KNQAVFIVSA-N 2 0 344.543 4.005 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]([C@H](C)c1ccccc1)C1CC1 ZINC000346128066 1028268165 /nfs/dbraw/zinc/26/81/65/1028268165.db2.gz DGINYJTXRZDXKX-QGZVFWFLSA-N 2 0 332.451 4.301 20 0 EIADRP Cc1nc(CC[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cs1 ZINC000280931311 1028283943 /nfs/dbraw/zinc/28/39/43/1028283943.db2.gz HDUOGZCRSTUDOF-UHFFFAOYSA-N 2 0 343.540 4.027 20 0 EIADRP CC[C@H](C)[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)Cc1ccccc1 ZINC000346152054 1028286249 /nfs/dbraw/zinc/28/62/49/1028286249.db2.gz OMOXVTFVFXUVPH-KRWDZBQOSA-N 2 0 334.467 4.376 20 0 EIADRP Cc1ccc(C[N@H+](Cc2cn(-c3cc[nH+]cc3)nc2C)C(C)C)s1 ZINC000346186911 1028293503 /nfs/dbraw/zinc/29/35/03/1028293503.db2.gz WJCJJGLXYGWORD-UHFFFAOYSA-N 2 0 340.496 4.356 20 0 EIADRP Cc1nccn1CC[N@@H+]1CCc2ccccc2[C@@H]1Cc1ccccc1 ZINC000346179711 1028306697 /nfs/dbraw/zinc/30/66/97/1028306697.db2.gz JKRZTCFEIIQCHU-QFIPXVFZSA-N 2 0 331.463 4.034 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@H]1CCc1ccccc1 ZINC000346178266 1028309383 /nfs/dbraw/zinc/30/93/83/1028309383.db2.gz OWNGADWMAPIENQ-OAQYLSRUSA-N 2 0 346.478 4.173 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+]Cc1ccc(OC(F)(F)F)cc1)C(C)(C)C ZINC000523864751 1028435044 /nfs/dbraw/zinc/43/50/44/1028435044.db2.gz ZNGKYKZFBJOMQC-HNNXBMFYSA-N 2 0 332.410 4.041 20 0 EIADRP Cc1nc(F)ccc1C[NH2+]Cc1ccc(C[N@H+]2CCCC[C@H]2C)cc1 ZINC000278285148 1028820494 /nfs/dbraw/zinc/82/04/94/1028820494.db2.gz BFSSEEUKWSVAEW-MRXNPFEDSA-N 2 0 341.474 4.193 20 0 EIADRP C(=C\C[N@@H+]1CCC[C@H]1c1cccnc1)\C[NH+]1CCC[C@@H]1c1cccnc1 ZINC000346978602 1028831676 /nfs/dbraw/zinc/83/16/76/1028831676.db2.gz UEZABGVONGZQNQ-LJLUTMTPSA-N 2 0 348.494 4.007 20 0 EIADRP CC(C)O[C@H](C[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1 ZINC000428325948 1028884079 /nfs/dbraw/zinc/88/40/79/1028884079.db2.gz OMVAWMLDOVTIHS-CZTZKLFOSA-N 2 0 344.543 4.395 20 0 EIADRP CCCOC1CC[NH+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168051003 1028994288 /nfs/dbraw/zinc/99/42/88/1028994288.db2.gz FEVVBHOUUVETDB-OALUTQOASA-N 2 0 344.543 4.319 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@H](Cc2ccccc2Cl)c2ccsc2)CC1 ZINC000650747935 1029092802 /nfs/dbraw/zinc/09/28/02/1029092802.db2.gz KTVKQPICITVAAZ-QGZVFWFLSA-N 2 0 334.916 4.404 20 0 EIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]CCCn1ccnc1 ZINC000151131432 1029141188 /nfs/dbraw/zinc/14/11/88/1029141188.db2.gz JIHSUXGPHNCCPC-QWHCGFSZSA-N 2 0 342.270 4.026 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@@H](c3ccncc3)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168053358 1029160947 /nfs/dbraw/zinc/16/09/47/1029160947.db2.gz OCGOLJUOUGSCFN-IYRWYFENSA-N 2 0 349.522 4.313 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000650757013 1029198819 /nfs/dbraw/zinc/19/88/19/1029198819.db2.gz MJDRILAWZKMMRE-VBNZEHGJSA-N 2 0 334.916 4.403 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H]1CCSc2ccc(Cl)cc21 ZINC000650758446 1029213450 /nfs/dbraw/zinc/21/34/50/1029213450.db2.gz PWPNZJYQDYCNGE-KRWDZBQOSA-N 2 0 332.900 4.386 20 0 EIADRP CCOc1ccc(Cl)cc1[C@@H](C)[NH2+]Cc1ccccc1C[NH2+]C ZINC000650758057 1029217462 /nfs/dbraw/zinc/21/74/62/1029217462.db2.gz HSMSZPQJYFQZHT-CQSZACIVSA-N 2 0 332.875 4.309 20 0 EIADRP CCC1(C[NH2+][C@@H](C)c2cc(C)on2)CC[NH+](Cc2ccccc2)CC1 ZINC000562082086 1029223297 /nfs/dbraw/zinc/22/32/97/1029223297.db2.gz ZCNLEZBXIXGNTG-SFHVURJKSA-N 2 0 341.499 4.326 20 0 EIADRP Cc1ccc(-c2nc(C[NH2+]CC3CC[NH+](C4CC4)CC3)cs2)cc1 ZINC000278463898 1029284747 /nfs/dbraw/zinc/28/47/47/1029284747.db2.gz FSTATFNPTONDOH-UHFFFAOYSA-N 2 0 341.524 4.083 20 0 EIADRP Cc1nc(F)ccc1C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000278511160 1029397182 /nfs/dbraw/zinc/39/71/82/1029397182.db2.gz OVXYMSINSBTYDQ-UHFFFAOYSA-N 2 0 341.474 4.195 20 0 EIADRP COC1CCC(C)(C[NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)CC1 ZINC000475211950 1029443086 /nfs/dbraw/zinc/44/30/86/1029443086.db2.gz CPAWARYNNYWMPT-FNOBOGDDSA-N 2 0 336.564 4.214 20 0 EIADRP C[C@H](C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000475225690 1029448589 /nfs/dbraw/zinc/44/85/89/1029448589.db2.gz UKSZVOXBXAGXMW-MJGOQNOKSA-N 2 0 326.459 4.041 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)[C@H](C)c1nc2ccccc2s1 ZINC000475219546 1029452704 /nfs/dbraw/zinc/45/27/04/1029452704.db2.gz JQHFRWXYUAWFTH-JKSUJKDBSA-N 2 0 345.556 4.500 20 0 EIADRP C[C@@H]1CC([N@@H+]2CC[C@H](C(F)(F)F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168061385 1029539918 /nfs/dbraw/zinc/53/99/18/1029539918.db2.gz IFESMEYCIUAQKE-INMHGKMJSA-N 2 0 340.433 4.312 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@@H]21)CC(F)F ZINC000647320053 1029547520 /nfs/dbraw/zinc/54/75/20/1029547520.db2.gz SZACUPKOSZXREN-JCHJZTRSSA-N 2 0 336.470 4.311 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH2+]C2CC(N3CCC(C(F)(F)F)CC3)C2)[C@@H]1C ZINC000475352772 1029565320 /nfs/dbraw/zinc/56/53/20/1029565320.db2.gz JAPIRBXHSGZGFP-HYOCIYNVSA-N 2 0 332.454 4.206 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1cc2cnccc2o1 ZINC000657824647 1029583587 /nfs/dbraw/zinc/58/35/87/1029583587.db2.gz SBDGUXBBBJYWHE-MRXNPFEDSA-N 2 0 335.451 4.274 20 0 EIADRP C[C@H]([NH+](C)Cc1cncc(C[N@@H+](C)[C@@H](C)C2(C)CC2)c1)C1(C)CC1 ZINC000584094450 1029612554 /nfs/dbraw/zinc/61/25/54/1029612554.db2.gz PTPUIXZKJKSSLE-IRXDYDNUSA-N 2 0 329.532 4.322 20 0 EIADRP Clc1ccc([C@@H]2CCC[C@H]2[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000446887699 1029633932 /nfs/dbraw/zinc/63/39/32/1029633932.db2.gz XIRYYRJFKMFDON-VQTJNVASSA-N 2 0 332.919 4.440 20 0 EIADRP COc1ccc2cc([C@@H](C)[NH2+]CC3CC[NH+](C4CC4)CC3)ccc2c1 ZINC000447024887 1029666934 /nfs/dbraw/zinc/66/69/34/1029666934.db2.gz ATJLAPGPBYENNF-MRXNPFEDSA-N 2 0 338.495 4.373 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000708510420 1029743676 /nfs/dbraw/zinc/74/36/76/1029743676.db2.gz JXVSRBSVBCUHFN-OXQOHEQNSA-N 2 0 344.449 4.482 20 0 EIADRP C[N@@H+]1CC[C@H](C[NH2+]Cc2ccc3occc3c2)[C@@H]1c1cccs1 ZINC000375751892 1029865303 /nfs/dbraw/zinc/86/53/03/1029865303.db2.gz YBYZZMBGUXNQDJ-VQIMIIECSA-N 2 0 326.465 4.277 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1cccnc1Cl ZINC000090775350 1029869146 /nfs/dbraw/zinc/86/91/46/1029869146.db2.gz NGPSEJAPHDRHSE-GTPINHCMSA-N 2 0 335.923 4.429 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1ccc(F)cn1 ZINC000092742989 1029937109 /nfs/dbraw/zinc/93/71/09/1029937109.db2.gz OOCHXOPASLXORV-QGZVFWFLSA-N 2 0 341.474 4.448 20 0 EIADRP Fc1ccc(C[C@@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2ccccc2)cc1 ZINC000447536259 1030142757 /nfs/dbraw/zinc/14/27/57/1030142757.db2.gz LZPUEEIWBHOTNO-XMSQKQJNSA-N 2 0 338.470 4.183 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)c2ccccc12 ZINC000447562519 1030172129 /nfs/dbraw/zinc/17/21/29/1030172129.db2.gz CZZNQFRMQJGDJB-INIZCTEOSA-N 2 0 338.495 4.373 20 0 EIADRP Fc1cccc(Oc2ccc(C[NH2+]C[C@H]3CC[N@@H+](C4CC4)C3)cc2)c1 ZINC000443970353 1030226476 /nfs/dbraw/zinc/22/64/76/1030226476.db2.gz UFLAXWQQCNEMMD-QGZVFWFLSA-N 2 0 340.442 4.192 20 0 EIADRP C[C@@H]([NH2+]CCc1ccc(F)c(F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000527041845 1030421607 /nfs/dbraw/zinc/42/16/07/1030421607.db2.gz BSTWTEHIJUHSFI-APWZRJJASA-N 2 0 344.449 4.008 20 0 EIADRP C[C@H]([NH2+]CCCc1ccccc1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000530477268 1030447631 /nfs/dbraw/zinc/44/76/31/1030447631.db2.gz XBPRETQYAMNESR-GHTZIAJQSA-N 2 0 340.486 4.259 20 0 EIADRP COC[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cccc(Cl)c1 ZINC000685645164 1030614224 /nfs/dbraw/zinc/61/42/24/1030614224.db2.gz KLIOHYXLUTZTLB-APWZRJJASA-N 2 0 338.923 4.129 20 0 EIADRP C[C@@H]1C[C@@H]([N@H+](C)CCCOc2cccc3ccccc32)CCN1C ZINC000530666368 1030620480 /nfs/dbraw/zinc/62/04/80/1030620480.db2.gz UVVGMLFIWSWFHE-MJGOQNOKSA-N 2 0 326.484 4.023 20 0 EIADRP CCOC1CCC([NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000657933749 1030629350 /nfs/dbraw/zinc/62/93/50/1030629350.db2.gz VFCDYNUWTHIUGV-UREXAPBRSA-N 2 0 344.543 4.224 20 0 EIADRP CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000527349642 1030640229 /nfs/dbraw/zinc/64/02/29/1030640229.db2.gz PVYVVBGCFVMPMX-SZMVWBNQSA-N 2 0 342.449 4.464 20 0 EIADRP CC(C)[C@H](CC(F)(F)F)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000527349640 1030642338 /nfs/dbraw/zinc/64/23/38/1030642338.db2.gz PVYVVBGCFVMPMX-NJAFHUGGSA-N 2 0 342.449 4.464 20 0 EIADRP C[C@@H](CC1CCOCC1)[NH2+]C[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000685665255 1030664517 /nfs/dbraw/zinc/66/45/17/1030664517.db2.gz ZWTBYODIVNWVFH-SIKLNZKXSA-N 2 0 344.543 4.084 20 0 EIADRP c1cn(-c2ccc(C[N@@H+]3CCCCC[C@@H]3c3ccncc3)cc2)cn1 ZINC000101544806 1030712993 /nfs/dbraw/zinc/71/29/93/1030712993.db2.gz VMVICNVHJWVSNM-OAQYLSRUSA-N 2 0 332.451 4.385 20 0 EIADRP C[C@@H]([NH2+]CCc1cncn1C)c1ccc(O[C@H](C)c2ccccc2)cc1 ZINC000657982949 1030740538 /nfs/dbraw/zinc/74/05/38/1030740538.db2.gz PCPDHLYGPYKHJB-QZTJIDSGSA-N 2 0 349.478 4.453 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(C(F)F)nc1 ZINC000657999295 1030768940 /nfs/dbraw/zinc/76/89/40/1030768940.db2.gz TXCYQKJMBFALSV-RDJZCZTQSA-N 2 0 345.437 4.192 20 0 EIADRP CCOC1CCC([NH2+]C[C@H]2CCCC[N@H+](Cc3ccccc3)C2)CC1 ZINC000658018539 1030782721 /nfs/dbraw/zinc/78/27/21/1030782721.db2.gz ITZABOUJHDBJML-ITAUSPCMSA-N 2 0 344.543 4.226 20 0 EIADRP O=C(c1ccc(Cl)cc1)C1CCN(CCC[NH+]2CCCCC2)CC1 ZINC000193477667 1030796841 /nfs/dbraw/zinc/79/68/41/1030796841.db2.gz PUAFOZBUFMXOMJ-UHFFFAOYSA-N 2 0 348.918 4.111 20 0 EIADRP C[C@@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000658048370 1030806021 /nfs/dbraw/zinc/80/60/21/1030806021.db2.gz VYRJVXUQHMMWDO-FPMFFAJLSA-N 2 0 348.840 4.220 20 0 EIADRP CCC[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccccc1 ZINC000658068517 1030816314 /nfs/dbraw/zinc/81/63/14/1030816314.db2.gz FOYZLAKTLWANHT-OAQYLSRUSA-N 2 0 330.516 4.008 20 0 EIADRP CC(C)Oc1cc(Cl)c(C[NH2+]CC2=CC[N@H+](C)CC2)cc1Cl ZINC000527683678 1030823016 /nfs/dbraw/zinc/82/30/16/1030823016.db2.gz OAMRWRYNHBDMME-UHFFFAOYSA-N 2 0 343.298 4.132 20 0 EIADRP CC(C)[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccc1 ZINC000658164180 1030861083 /nfs/dbraw/zinc/86/10/83/1030861083.db2.gz CCSBDZRZDRYKNW-QFIPXVFZSA-N 2 0 337.511 4.281 20 0 EIADRP CC(C)c1cccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)c1 ZINC000527872490 1030889860 /nfs/dbraw/zinc/88/98/60/1030889860.db2.gz LZHADIGHMWAEKD-HSQYWUDLSA-N 2 0 344.543 4.229 20 0 EIADRP Cc1cccc([C@H]([NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3O)CC2)C(C)C)c1 ZINC000527874634 1030889899 /nfs/dbraw/zinc/88/98/99/1030889899.db2.gz XIKGNLLSGSCFIK-BHIFYINESA-N 2 0 344.543 4.050 20 0 EIADRP Cc1c[nH+]ccc1N([C@@H](C)Cc1ccc(Cl)cc1)C1CC[NH2+]CC1 ZINC001168191047 1030930633 /nfs/dbraw/zinc/93/06/33/1030930633.db2.gz FBSBLSSYDQSMKB-INIZCTEOSA-N 2 0 343.902 4.233 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2ccc(C)cc2C)cc1 ZINC000061051757 1030963879 /nfs/dbraw/zinc/96/38/79/1030963879.db2.gz TVJXUECLGKWJOQ-UHFFFAOYSA-N 2 0 340.511 4.314 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cncs1 ZINC000658319531 1030977494 /nfs/dbraw/zinc/97/74/94/1030977494.db2.gz FYEQZJAXPOQXRL-FUHWJXTLSA-N 2 0 341.524 4.096 20 0 EIADRP Cc1cncc([C@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)CC23CCC3)c1 ZINC000658320182 1030978977 /nfs/dbraw/zinc/97/89/77/1030978977.db2.gz PLRQHZYWPSYAOD-SIKLNZKXSA-N 2 0 349.522 4.343 20 0 EIADRP C[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000527964483 1031007260 /nfs/dbraw/zinc/00/72/60/1031007260.db2.gz KSCRHKLTRJXPFS-HARLFGEKSA-N 2 0 349.522 4.423 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCSc2ccc(Cl)cc2)[C@@H](C)C1 ZINC001167686157 1031028436 /nfs/dbraw/zinc/02/84/36/1031028436.db2.gz OICXACFCFZZISX-YOEHRIQHSA-N 2 0 326.937 4.094 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CCc2c[nH]c3ccccc23)CC1 ZINC000532441707 1031069362 /nfs/dbraw/zinc/06/93/62/1031069362.db2.gz CJZVIYWCAXKUPU-VGSWGCGISA-N 2 0 339.527 4.343 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](CC)CC1)c1cccc(Br)c1 ZINC000044517802 1031112577 /nfs/dbraw/zinc/11/25/77/1031112577.db2.gz UKGUKDYLFKQKFC-KRWDZBQOSA-N 2 0 339.321 4.222 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCCOc1ccc(Cl)cc1Cl ZINC000532464687 1031124385 /nfs/dbraw/zinc/12/43/85/1031124385.db2.gz ZIBFIHXMECYVNM-IOASZLSFSA-N 2 0 345.314 4.081 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2c(C)nn(C(C)C)c2C)cc1 ZINC000892460806 1031146139 /nfs/dbraw/zinc/14/61/39/1031146139.db2.gz UBASAVQNQGYWSW-UHFFFAOYSA-N 2 0 342.531 4.212 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCSCc1cccc2ccccc21 ZINC000532477059 1031204661 /nfs/dbraw/zinc/20/46/61/1031204661.db2.gz MPKQUSUOBDUGEJ-LZJOCLMNSA-N 2 0 342.552 4.391 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccccc1OCc1ccccc1 ZINC000532507299 1031229921 /nfs/dbraw/zinc/22/99/21/1031229921.db2.gz RGQQYFDMWJSTCR-QUCCMNQESA-N 2 0 338.495 4.258 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccnn1C1CCCC1 ZINC000449068521 1031419963 /nfs/dbraw/zinc/41/99/63/1031419963.db2.gz SWGKBTJLUHSMLI-UHFFFAOYSA-N 2 0 340.515 4.130 20 0 EIADRP CC(C)[NH+]1CCC(NC2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CC1 ZINC000449069128 1031420783 /nfs/dbraw/zinc/42/07/83/1031420783.db2.gz WGFLWNCTCFEBNV-UHFFFAOYSA-N 2 0 337.596 4.128 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)[C@@H](C)O1 ZINC000449074885 1031429332 /nfs/dbraw/zinc/42/93/32/1031429332.db2.gz LPAWPAPXKDYULF-YVHKJVDXSA-N 2 0 338.495 4.071 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]Cc1csc(C)c1 ZINC000449082017 1031437774 /nfs/dbraw/zinc/43/77/74/1031437774.db2.gz JQVBNRRLMHSLFO-UHFFFAOYSA-N 2 0 332.513 4.067 20 0 EIADRP Clc1ccc(C[C@@H]2CCC[C@@H]2[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000449090467 1031449177 /nfs/dbraw/zinc/44/91/77/1031449177.db2.gz NDBVQOMVJODAMD-LEAZDLGRSA-N 2 0 332.919 4.268 20 0 EIADRP Clc1ccc([C@H]2CC[C@@H]([NH2+]C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC000449091538 1031452908 /nfs/dbraw/zinc/45/29/08/1031452908.db2.gz QDBRNJJEHHPFMW-FXAWDEMLSA-N 2 0 332.919 4.440 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CCc3ccccc32)cc1 ZINC000531682620 1031473573 /nfs/dbraw/zinc/47/35/73/1031473573.db2.gz CACPGNURIVCCSQ-QFIPXVFZSA-N 2 0 338.495 4.184 20 0 EIADRP COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccc(-n2ccnc2)c(F)c1 ZINC000531696522 1031477913 /nfs/dbraw/zinc/47/79/13/1031477913.db2.gz KQAMAWHASNUBKZ-HNNXBMFYSA-N 2 0 339.414 4.179 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCCC(F)(F)F)CC1 ZINC000449169510 1031490189 /nfs/dbraw/zinc/49/01/89/1031490189.db2.gz OPFNZRJCKAMRGQ-HNNXBMFYSA-N 2 0 328.422 4.014 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)c1ccc(OC)cc1 ZINC000123933014 1031495996 /nfs/dbraw/zinc/49/59/96/1031495996.db2.gz FBYOOBUWLXNYMH-OAQYLSRUSA-N 2 0 326.484 4.388 20 0 EIADRP CCC[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)C1CCCC1 ZINC000449177865 1031517105 /nfs/dbraw/zinc/51/71/05/1031517105.db2.gz RACORIWICBHMCS-QFIPXVFZSA-N 2 0 344.543 4.092 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc2c(c1)OCCCO2 ZINC000531718289 1031517528 /nfs/dbraw/zinc/51/75/28/1031517528.db2.gz YCOWLHUHOUIXKB-GOSISDBHSA-N 2 0 346.515 4.155 20 0 EIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+]C(C2CC2)C2CC2)CC1 ZINC000531719377 1031520921 /nfs/dbraw/zinc/52/09/21/1031520921.db2.gz CZBIDGQALGEHGN-UHFFFAOYSA-N 2 0 332.919 4.330 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)c2sccc21 ZINC000453061646 1031551738 /nfs/dbraw/zinc/55/17/38/1031551738.db2.gz LEHIGAGFPFVRLD-DNVCBOLYSA-N 2 0 344.524 4.417 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCc1c(Cl)cccc1Cl ZINC000422730140 1031583901 /nfs/dbraw/zinc/58/39/01/1031583901.db2.gz DKMKBCAKYWDSNC-NSHDSACASA-N 2 0 338.282 4.049 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@H]2CCO[C@@H](C3CC3)C2)CC1 ZINC000449247438 1031584464 /nfs/dbraw/zinc/58/44/64/1031584464.db2.gz GFEXEYBFHUKCII-RBUKOAKNSA-N 2 0 336.564 4.213 20 0 EIADRP C[C@@H](NCCC[N@@H+]1CCCC[C@H]1C)c1ncc(-c2ccccc2)n1C ZINC000453093398 1031584588 /nfs/dbraw/zinc/58/45/88/1031584588.db2.gz RCJUIOYTVFWRDU-QZTJIDSGSA-N 2 0 340.515 4.002 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]Cc2cccc3cc[nH]c32)CC1 ZINC000449271687 1031587653 /nfs/dbraw/zinc/58/76/53/1031587653.db2.gz UHNOZDJVIDZZLP-GOSISDBHSA-N 2 0 347.506 4.353 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccsc1 ZINC000453107350 1031598584 /nfs/dbraw/zinc/59/85/84/1031598584.db2.gz ISRYOSHMSKEHOX-FQEVSTJZSA-N 2 0 344.524 4.464 20 0 EIADRP C[C@H](CCCc1cccnc1)[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000453193671 1031704408 /nfs/dbraw/zinc/70/44/08/1031704408.db2.gz GKZLQYYKLZPGLB-WSTZPKSXSA-N 2 0 329.532 4.035 20 0 EIADRP C[C@H](CCCc1cccnc1)[NH2+][C@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000453193668 1031704448 /nfs/dbraw/zinc/70/44/48/1031704448.db2.gz GKZLQYYKLZPGLB-GGPKGHCWSA-N 2 0 329.532 4.035 20 0 EIADRP Cc1ncsc1CC[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449466569 1031785543 /nfs/dbraw/zinc/78/55/43/1031785543.db2.gz HMUOJCFVMQTBJG-UHFFFAOYSA-N 2 0 337.577 4.263 20 0 EIADRP CC(C)[C@@H]1C[C@H](C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3C)CC2)CCO1 ZINC000449495661 1031802822 /nfs/dbraw/zinc/80/28/22/1031802822.db2.gz OVXXVEOFDORXDN-UKAVVXHISA-N 2 0 336.564 4.070 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](C)c1ccc(F)cc1)c1ccc(OCC[NH+](C)C)cc1 ZINC000531958347 1031877351 /nfs/dbraw/zinc/87/73/51/1031877351.db2.gz NVBMEVIGRXDVQU-IAGOWNOFSA-N 2 0 344.474 4.220 20 0 EIADRP C[C@H]([C@H]1CC[N@H+](Cc2ccccc2)C1)[NH+]1CCC[C@@]2(CCSC2)C1 ZINC000453356541 1031885693 /nfs/dbraw/zinc/88/56/93/1031885693.db2.gz KWGXOJFLWIXNKH-HLAWJBBLSA-N 2 0 344.568 4.116 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([N@@H+]2CCC[C@]3(CCOC3)C2)CC1 ZINC000453384692 1031895232 /nfs/dbraw/zinc/89/52/32/1031895232.db2.gz TYKQGDOUNFDYDD-NRFANRHFSA-N 2 0 336.564 4.168 20 0 EIADRP C[N@H+](CCCC[NH2+][C@H]1CCc2ccc(OC(F)(F)F)cc21)C1CC1 ZINC000453398538 1031933539 /nfs/dbraw/zinc/93/35/39/1031933539.db2.gz KPGFTBPYBCLKHB-KRWDZBQOSA-N 2 0 342.405 4.037 20 0 EIADRP Cc1nc(-c2cccnc2)sc1[C@@H](C)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453406499 1031941446 /nfs/dbraw/zinc/94/14/46/1031941446.db2.gz RFDWTTUUSNCGDP-CQSZACIVSA-N 2 0 344.528 4.039 20 0 EIADRP CC[C@H]1CCC[C@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000531994588 1031961324 /nfs/dbraw/zinc/96/13/24/1031961324.db2.gz BDBLDWSQQHSIIN-RBBKRZOGSA-N 2 0 344.543 4.226 20 0 EIADRP Cc1ccc(-c2ncc(C[NH2+]CCCC[N@@H+](C)C3CC3)s2)cc1 ZINC000453594324 1032019235 /nfs/dbraw/zinc/01/92/35/1032019235.db2.gz HZCBZOKFNDSYIH-UHFFFAOYSA-N 2 0 329.513 4.083 20 0 EIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]Cc1cccc2[nH]ccc21 ZINC000532120802 1032052334 /nfs/dbraw/zinc/05/23/34/1032052334.db2.gz LIVLJYIEKMWQTL-ROUUACIJSA-N 2 0 347.506 4.414 20 0 EIADRP Cc1ccc(C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)c(C)n1 ZINC000433175080 1033984663 /nfs/dbraw/zinc/98/46/63/1033984663.db2.gz MTSVGWZPLCZHHQ-UHFFFAOYSA-N 2 0 349.522 4.187 20 0 EIADRP Cc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)cc1F ZINC000397545817 1034239825 /nfs/dbraw/zinc/23/98/25/1034239825.db2.gz OESOOEPWENCOHM-UHFFFAOYSA-N 2 0 326.459 4.136 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]Cc2cc3ccccc3[nH]2)CC[N@@H+]1Cc1ccccc1 ZINC000513053792 1034371699 /nfs/dbraw/zinc/37/16/99/1034371699.db2.gz YIPUERXUFQKWHR-PXNSSMCTSA-N 2 0 333.479 4.311 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000333347529 1034816826 /nfs/dbraw/zinc/81/68/26/1034816826.db2.gz ZPKMZMYIDKMKLB-OWCLPIDISA-N 2 0 327.497 4.047 20 0 EIADRP FC(F)(F)c1cccc(Cl)c1C[N@@H+]1CCCC2(CC[NH2+]CC2)C1 ZINC001204734942 1034823158 /nfs/dbraw/zinc/82/31/58/1034823158.db2.gz GJMSSXCBHQCNLO-UHFFFAOYSA-N 2 0 346.824 4.324 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC000509921699 1034850722 /nfs/dbraw/zinc/85/07/22/1034850722.db2.gz BBCLHUXFOWCZPX-IZBXUMLASA-N 2 0 344.543 4.481 20 0 EIADRP Cc1ccc([C@H]2OCCC[C@H]2[NH2+]C2CC[NH+](C(C)(C)C)CC2)cc1 ZINC000513341442 1034888773 /nfs/dbraw/zinc/88/87/73/1034888773.db2.gz VFNUQEBZCUELAX-WOJBJXKFSA-N 2 0 330.516 4.068 20 0 EIADRP COc1ccsc1C[NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000513495369 1034986597 /nfs/dbraw/zinc/98/65/97/1034986597.db2.gz OWKUOZIHKDCVIU-AEFFLSMTSA-N 2 0 344.524 4.147 20 0 EIADRP CCC(CC)[C@@H]([NH2+]CCCN1CC[NH+](C(C)C)CC1)c1ccccc1 ZINC000501008007 1035343596 /nfs/dbraw/zinc/34/35/96/1035343596.db2.gz OUOILPPHOBXNQC-JOCHJYFZSA-N 2 0 345.575 4.170 20 0 EIADRP CC(C)[NH2+]C1CCN(C[C@@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000501009508 1035344476 /nfs/dbraw/zinc/34/44/76/1035344476.db2.gz CEOPUZAKQQOTBG-CQSZACIVSA-N 2 0 328.422 4.271 20 0 EIADRP C[N@H+](CCc1ccccc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501063584 1035365936 /nfs/dbraw/zinc/36/59/36/1035365936.db2.gz QGXGKDLLOYJGRD-UHFFFAOYSA-N 2 0 343.902 4.126 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[N@H+](C)CC[C@H]2CC[NH2+]C2)cc1 ZINC000420294554 1035492457 /nfs/dbraw/zinc/49/24/57/1035492457.db2.gz BBEGUNNBGNMCFG-ZWKOTPCHSA-N 2 0 338.495 4.355 20 0 EIADRP Cc1nc([C@@H](C)[NH+]2CCC([C@@H](C)[NH3+])CC2)oc1-c1ccc(Cl)cc1 ZINC000420281968 1035497187 /nfs/dbraw/zinc/49/71/87/1035497187.db2.gz AUTLEKLMWYDFRQ-TZMCWYRMSA-N 2 0 347.890 4.424 20 0 EIADRP Cc1nc([C@H](C)[NH+]2CCC([C@@H](C)[NH3+])CC2)oc1-c1ccc(Cl)cc1 ZINC000420281967 1035498260 /nfs/dbraw/zinc/49/82/60/1035498260.db2.gz AUTLEKLMWYDFRQ-OCCSQVGLSA-N 2 0 347.890 4.424 20 0 EIADRP C[NH2+]CC1CC[NH+]([C@@H](C)c2nc(C)c(-c3ccc(Cl)cc3)o2)CC1 ZINC000420298416 1035502814 /nfs/dbraw/zinc/50/28/14/1035502814.db2.gz SBPQOZWLNGNUQY-AWEZNQCLSA-N 2 0 347.890 4.296 20 0 EIADRP C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](CC[C@@H]1CC[NH2+]C1)C1CC1 ZINC000420299089 1035503035 /nfs/dbraw/zinc/50/30/35/1035503035.db2.gz GGBHINVZIOAIMJ-KBPBESRZSA-N 2 0 326.406 4.230 20 0 EIADRP CC(C)n1c2ccccc2nc1[C@@H]1CCC[N@@H+]1CC[C@H]1CCC[NH2+]C1 ZINC000420307245 1035505862 /nfs/dbraw/zinc/50/58/62/1035505862.db2.gz BILYTKVVPVAZCR-XLIONFOSSA-N 2 0 340.515 4.144 20 0 EIADRP CC[C@H](c1ccc(Cl)cc1)[NH+]1CCC([C@H]2OCCC[C@H]2[NH3+])CC1 ZINC000420374524 1035544010 /nfs/dbraw/zinc/54/40/10/1035544010.db2.gz HLEMUUBLFXBLHT-GUDVDZBRSA-N 2 0 336.907 4.009 20 0 EIADRP FC(F)(F)c1cccc([C@H]([NH2+]CCC2CC[NH2+]CC2)C2CC2)c1 ZINC000420397983 1035566736 /nfs/dbraw/zinc/56/67/36/1035566736.db2.gz GQWJHCRFORTPGC-QGZVFWFLSA-N 2 0 326.406 4.136 20 0 EIADRP Cc1ncncc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000574890428 1035573465 /nfs/dbraw/zinc/57/34/65/1035573465.db2.gz YYAGMMWPZPDGIV-KRWDZBQOSA-N 2 0 338.499 4.012 20 0 EIADRP Cc1ccc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c2ccccc12 ZINC000414488775 1035912497 /nfs/dbraw/zinc/91/24/97/1035912497.db2.gz XCLVRIONMYAMBT-UHFFFAOYSA-N 2 0 331.463 4.302 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@H]3CCCC(F)(F)C3)CC2)C1 ZINC000502368813 1036140436 /nfs/dbraw/zinc/14/04/36/1036140436.db2.gz GNBRFZKDVXZTAP-SOLBZPMBSA-N 2 0 328.491 4.445 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000669614719 1036254312 /nfs/dbraw/zinc/25/43/12/1036254312.db2.gz JIOUIVXMJVFUMP-KYJSFNMBSA-N 2 0 340.433 4.273 20 0 EIADRP C/C(=C/c1ccccc1)C[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000588177623 1036284251 /nfs/dbraw/zinc/28/42/51/1036284251.db2.gz LFWZCDBUJZOIJS-ZZEZOPTASA-N 2 0 334.507 4.387 20 0 EIADRP COc1ccccc1/C=C/C[NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000588177759 1036284308 /nfs/dbraw/zinc/28/43/08/1036284308.db2.gz FPBIHGYKSGUNJN-NYSSQEGZSA-N 2 0 330.516 4.056 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCCC(F)(F)C1)c1ccc(OCC[NH+](C)C)cc1 ZINC000502593152 1036387004 /nfs/dbraw/zinc/38/70/04/1036387004.db2.gz SBWKFVNKBMACOG-HOTGVXAUSA-N 2 0 340.458 4.103 20 0 EIADRP Cc1cnccc1C[NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000572106298 1036431178 /nfs/dbraw/zinc/43/11/78/1036431178.db2.gz QRBZNHZJFFDNCE-QZTJIDSGSA-N 2 0 337.511 4.158 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)oc1C ZINC000502699806 1036526876 /nfs/dbraw/zinc/52/68/76/1036526876.db2.gz SXIBJEAXROFGKU-QGZVFWFLSA-N 2 0 326.484 4.459 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1cnn(C2CCCC2)c1 ZINC000502720346 1036560396 /nfs/dbraw/zinc/56/03/96/1036560396.db2.gz BEVYRYITZNLGBE-GOSISDBHSA-N 2 0 332.536 4.305 20 0 EIADRP Clc1ccc([C@H](C[NH2+]C2CC[NH+](CC3CC3)CC2)C2CC2)cc1 ZINC001168370969 1036711393 /nfs/dbraw/zinc/71/13/93/1036711393.db2.gz JDQQIDFYOMRORT-HXUWFJFHSA-N 2 0 332.919 4.298 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)CC3 ZINC000486479292 1036728203 /nfs/dbraw/zinc/72/82/03/1036728203.db2.gz UMLUSGZEGGXIKO-LJQANCHMSA-N 2 0 347.506 4.185 20 0 EIADRP C[C@@H]1CN(C)CC[C@H]1[N@H+](C)Cc1ccc(-c2cccc(F)c2)s1 ZINC000572526521 1036786887 /nfs/dbraw/zinc/78/68/87/1036786887.db2.gz HHOKKCMPDOCUNR-RDTXWAMCSA-N 2 0 332.488 4.326 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2ccncc2Cl)c1 ZINC000421818760 1036805202 /nfs/dbraw/zinc/80/52/02/1036805202.db2.gz CIJKMLXPQSLUGC-OAHLLOKOSA-N 2 0 331.891 4.428 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2cc3ccc(F)cc3[nH]2)C1 ZINC000486689701 1036817130 /nfs/dbraw/zinc/81/71/30/1036817130.db2.gz PGAPNTYSZYXKNU-HOTGVXAUSA-N 2 0 331.479 4.155 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccccc1OC(F)(F)F ZINC000421890185 1036835764 /nfs/dbraw/zinc/83/57/64/1036835764.db2.gz XWVCDVMLXRMBFU-IYXRBSQSSA-N 2 0 330.394 4.109 20 0 EIADRP Cc1cc([C@H](C)[NH2+]C2CCC([NH+](C)C)CC2)sc1Br ZINC000421890091 1036835890 /nfs/dbraw/zinc/83/58/90/1036835890.db2.gz XSCVMQYCXCKOKN-HIFPTAJRSA-N 2 0 345.350 4.342 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1CCN(Cc3ccccn3)C[C@H]1C)CCC2 ZINC000489803410 1036859899 /nfs/dbraw/zinc/85/98/99/1036859899.db2.gz UZEODCRMBCACGD-LEOXJPRUSA-N 2 0 349.522 4.268 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCN(Cc3ccccn3)C[C@H]1C)CCC2 ZINC000489803416 1036860555 /nfs/dbraw/zinc/86/05/55/1036860555.db2.gz UZEODCRMBCACGD-YSZBQJHXSA-N 2 0 349.522 4.268 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc(OC(F)(F)F)cc1 ZINC000589836068 1036880303 /nfs/dbraw/zinc/88/03/03/1036880303.db2.gz FUQNOVJSRXLHHD-HNNXBMFYSA-N 2 0 344.421 4.329 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+]C[C@@H]3C[C@@H]3c3ccccc3)CC2)c1 ZINC000503035707 1036882846 /nfs/dbraw/zinc/88/28/46/1036882846.db2.gz PDNHCJVNFVQKCZ-PZJWPPBQSA-N 2 0 340.536 4.353 20 0 EIADRP Cc1cccnc1[C@H]1CCC[C@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)C1 ZINC000467304073 1037232551 /nfs/dbraw/zinc/23/25/51/1037232551.db2.gz BLDHUPDKXFMSMF-SFTDATJTSA-N 2 0 337.511 4.268 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1C ZINC000272796098 1037300329 /nfs/dbraw/zinc/30/03/29/1037300329.db2.gz AAHKTFTVWNABEC-OAHLLOKOSA-N 2 0 330.447 4.055 20 0 EIADRP CC(C)(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CCc2cc(F)ccc2C1 ZINC001168417413 1037354328 /nfs/dbraw/zinc/35/43/28/1037354328.db2.gz PLMHUOKVEAGBSI-UFYCRDLUSA-N 2 0 332.507 4.301 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+]Cc1ccc(F)c(Br)c1)C(C)(C)C ZINC000604770686 1037512874 /nfs/dbraw/zinc/51/28/74/1037512874.db2.gz BCWFWHLFTYEJKJ-HNNXBMFYSA-N 2 0 345.300 4.044 20 0 EIADRP C[NH+]1CCC(CC[NH2+]Cc2ccc(-c3ccccc3F)s2)CC1 ZINC000591709175 1037556523 /nfs/dbraw/zinc/55/65/23/1037556523.db2.gz VJBFCHLLYCKNAR-UHFFFAOYSA-N 2 0 332.488 4.376 20 0 EIADRP CC[N@H+](Cc1cnc(C2CC2)s1)Cc1ccc(C[NH+](C)C)cc1 ZINC000573725327 1037678819 /nfs/dbraw/zinc/67/88/19/1037678819.db2.gz KUBALRDSCZKHAP-UHFFFAOYSA-N 2 0 329.513 4.104 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC(C)(C)c1ccccc1Cl ZINC000422719291 1037813240 /nfs/dbraw/zinc/81/32/40/1037813240.db2.gz YJCUYEVEZSSYSU-CYBMUJFWSA-N 2 0 331.891 4.131 20 0 EIADRP C[N@H+](Cc1ccccc1C[NH2+]C1CCC(C[NH3+])CC1)C1CCCCC1 ZINC000422727456 1037819234 /nfs/dbraw/zinc/81/92/34/1037819234.db2.gz CNEJUDZKQBGHLC-UHFFFAOYSA-N 3 0 343.559 4.058 20 0 EIADRP CC1CC[NH+](Cc2cccc(CN[C@@H]3C[C@H]([NH3+])c4ccccc43)c2)CC1 ZINC000422745045 1037822708 /nfs/dbraw/zinc/82/27/08/1037822708.db2.gz ULQQAESAYUWCMU-XZOQPEGZSA-N 2 0 349.522 4.153 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(Cl)cc1 ZINC000422745356 1037823130 /nfs/dbraw/zinc/82/31/30/1037823130.db2.gz MDZNLDSIVONFDC-BOUXLOLZSA-N 2 0 342.870 4.247 20 0 EIADRP C[C@@H]([NH2+]CC1(c2cccc(C(F)(F)F)c2)CCCCC1)C1C[NH2+]C1 ZINC000422778724 1037833221 /nfs/dbraw/zinc/83/32/21/1037833221.db2.gz DWNVKWFCUGZZDD-CQSZACIVSA-N 2 0 340.433 4.105 20 0 EIADRP Cc1nc(-c2ccc([C@@H](C)[NH2+]C3CCC(C[NH3+])CC3)cc2)cs1 ZINC000422801863 1037836229 /nfs/dbraw/zinc/83/62/29/1037836229.db2.gz GJJMEQVDWBZKKG-MJJDPTRDSA-N 2 0 329.513 4.287 20 0 EIADRP C[C@H](CC[NH2+][C@@H]1CC[NH2+]CC[C@@H]1C)c1cccc(C(F)(F)F)c1 ZINC000422806064 1037838257 /nfs/dbraw/zinc/83/82/57/1037838257.db2.gz HRUKHBJAHFHFCI-JKIFEVAISA-N 2 0 328.422 4.177 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(Cl)s1 ZINC000422807363 1037838797 /nfs/dbraw/zinc/83/87/97/1037838797.db2.gz MMMJLSILKPCPHR-XAYKYTGQSA-N 2 0 348.899 4.308 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1ccc(Br)cc1 ZINC000422789891 1037840541 /nfs/dbraw/zinc/84/05/41/1037840541.db2.gz XCZAVJYORMPLGE-RYUDHWBXSA-N 2 0 348.288 4.023 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000422823924 1037841863 /nfs/dbraw/zinc/84/18/63/1037841863.db2.gz FLTMMKYTDNSMDH-MHJFOBGBSA-N 2 0 330.422 4.108 20 0 EIADRP COc1ccc(-c2csc(C[NH2+]C3CCC(C[NH3+])CC3)c2)cc1 ZINC000422818464 1037845109 /nfs/dbraw/zinc/84/51/09/1037845109.db2.gz GGTIZCCBUKPLEB-UHFFFAOYSA-N 2 0 330.497 4.031 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000422866236 1037848641 /nfs/dbraw/zinc/84/86/41/1037848641.db2.gz PWSANVQUJRYODH-SJORKVTESA-N 2 0 339.483 4.107 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC1(c2ccc(F)cc2)CCCC1 ZINC000422880186 1037852075 /nfs/dbraw/zinc/85/20/75/1037852075.db2.gz NLUVGYPPCYRUQR-HNNXBMFYSA-N 2 0 341.474 4.150 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC1(c2ccc(F)cc2)CCCC1 ZINC000422880187 1037853011 /nfs/dbraw/zinc/85/30/11/1037853011.db2.gz NLUVGYPPCYRUQR-OAHLLOKOSA-N 2 0 341.474 4.150 20 0 EIADRP CC[NH+](CC)[C@H](CN[C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)c1ccsc1 ZINC000422868784 1037856520 /nfs/dbraw/zinc/85/65/20/1037856520.db2.gz WAUGUVVCDYFZMO-MTQWCTHYSA-N 2 0 349.588 4.031 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000311123369 1037858754 /nfs/dbraw/zinc/85/87/54/1037858754.db2.gz HPZJHEKDDHEXNG-AVRDEDQJSA-N 2 0 338.495 4.258 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC(C)(C)Cc1cccc(Cl)c1 ZINC000422873020 1037858924 /nfs/dbraw/zinc/85/89/24/1037858924.db2.gz JMTQVYCOZYWRMK-AWEZNQCLSA-N 2 0 345.918 4.422 20 0 EIADRP CC(C)[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc(C(F)(F)F)c1 ZINC000422899991 1037861922 /nfs/dbraw/zinc/86/19/22/1037861922.db2.gz IQBUBJJXHWBGTG-WFVVYAPDSA-N 2 0 326.406 4.275 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H](C)[C@H]1CCC[NH2+]C1 ZINC000422908730 1037864079 /nfs/dbraw/zinc/86/40/79/1037864079.db2.gz DSLWZXCLVYZEKB-IPYPFGDCSA-N 2 0 347.503 4.296 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C1CCC([NH3+])CC1 ZINC000422910387 1037865357 /nfs/dbraw/zinc/86/53/57/1037865357.db2.gz HZMQLXBKTYBOII-XGNXJENSSA-N 2 0 333.476 4.178 20 0 EIADRP c1ccc(SC2(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)CC2)cc1 ZINC000422910674 1037866497 /nfs/dbraw/zinc/86/64/97/1037866497.db2.gz RGTGEYDEPNSMEX-GBESFXJTSA-N 2 0 330.541 4.212 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422912823 1037866637 /nfs/dbraw/zinc/86/66/37/1037866637.db2.gz OFRSFHSWIRTWQM-YXQSOJMXSA-N 2 0 345.487 4.191 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)ccc1F ZINC000422921447 1037868474 /nfs/dbraw/zinc/86/84/74/1037868474.db2.gz PUVDPGSUIITNAQ-ZRCAFCQKSA-N 2 0 340.442 4.041 20 0 EIADRP COc1ccc([C@@H]([NH2+][C@H](C)CCC[NH3+])c2ccccc2Cl)cc1 ZINC000422927730 1037870260 /nfs/dbraw/zinc/87/02/60/1037870260.db2.gz ZYRCUBPYYWVYDP-AUUYWEPGSA-N 2 0 332.875 4.155 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1ccccc1C(F)(F)F ZINC000422927717 1037871478 /nfs/dbraw/zinc/87/14/78/1037871478.db2.gz ZWVDKYXTLJJKSZ-AAEUAGOBSA-N 2 0 337.389 4.279 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C1(c2ccc(Cl)cc2)CCC1 ZINC000422936052 1037873527 /nfs/dbraw/zinc/87/35/27/1037873527.db2.gz HUMVEEVVFAHHLX-CQSZACIVSA-N 2 0 329.875 4.232 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000422940967 1037874960 /nfs/dbraw/zinc/87/49/60/1037874960.db2.gz ULCPFYQNDVTPHL-ZQIUZPCESA-N 2 0 329.513 4.157 20 0 EIADRP Cc1sc(C[NH2+]C2CCC(C[NH3+])CC2)nc1-c1ccc(Cl)cc1 ZINC000422949187 1037884613 /nfs/dbraw/zinc/88/46/13/1037884613.db2.gz UJTOQOLGCFHEQK-UHFFFAOYSA-N 2 0 349.931 4.379 20 0 EIADRP COc1ccccc1SC[C@H](C)C[NH2+][C@@H]1C[C@@H]([NH3+])c2ccccc21 ZINC000422947685 1037885694 /nfs/dbraw/zinc/88/56/94/1037885694.db2.gz QWTFEVIMJFDJTD-ZTFGCOKTSA-N 2 0 342.508 4.158 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]C[C@@H](C)Sc1ccc(Br)cc1 ZINC000422957084 1037889400 /nfs/dbraw/zinc/88/94/00/1037889400.db2.gz MLESWLMNSIINMP-CHWSQXEVSA-N 2 0 345.350 4.037 20 0 EIADRP CCC(C)(C)c1ccc(C[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)cc1 ZINC000423001888 1037896976 /nfs/dbraw/zinc/89/69/76/1037896976.db2.gz ITSWDRABASBDKH-OAHLLOKOSA-N 2 0 325.500 4.387 20 0 EIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000423006235 1037899418 /nfs/dbraw/zinc/89/94/18/1037899418.db2.gz USEAIOWJEKYFRU-ZFMNYDKASA-N 2 0 330.516 4.055 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C[C@@H]1CCC(C)(C)c2ccccc21 ZINC000423010954 1037899536 /nfs/dbraw/zinc/89/95/36/1037899536.db2.gz AKOCLTYNVPBLKT-RDJZCZTQSA-N 2 0 337.511 4.355 20 0 EIADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]CCc1csc(-c2ccc(Cl)cc2)n1 ZINC000423012773 1037901232 /nfs/dbraw/zinc/90/12/32/1037901232.db2.gz LJDMIZUHWJYEFN-WMLDXEAASA-N 2 0 349.931 4.113 20 0 EIADRP Fc1ccc(C2=CC[C@H]([NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)CC2)cc1 ZINC000423049434 1037908610 /nfs/dbraw/zinc/90/86/10/1037908610.db2.gz XNVQRKFGLPWYTQ-JSXRDJHFSA-N 2 0 328.475 4.272 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000423063295 1037930570 /nfs/dbraw/zinc/93/05/70/1037930570.db2.gz OPBKZGOSZIAIAN-GXFFZTMASA-N 2 0 342.327 4.416 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1Cl ZINC000423069865 1037935188 /nfs/dbraw/zinc/93/51/88/1037935188.db2.gz FENXJWULJPDBFY-DJKXOVBDSA-N 2 0 342.870 4.247 20 0 EIADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000423096960 1037953571 /nfs/dbraw/zinc/95/35/71/1037953571.db2.gz QDTZSZYOXGDCBO-SRABZTEZSA-N 2 0 326.406 4.059 20 0 EIADRP C[C@H]1CC[NH2+]CC[C@@H]1[NH2+][C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1 ZINC000423095005 1037954881 /nfs/dbraw/zinc/95/48/81/1037954881.db2.gz DATCRFHAJUVVQS-MJFSBKNWSA-N 2 0 327.299 4.217 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+]C[C@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000423123782 1037966228 /nfs/dbraw/zinc/96/62/28/1037966228.db2.gz FGQXWCFSMYHNJC-UZLBHIALSA-N 2 0 346.902 4.315 20 0 EIADRP C[C@H]([NH2+]CCc1cccc2[nH]ccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000503903621 1037975439 /nfs/dbraw/zinc/97/54/39/1037975439.db2.gz RDJZNOIOIUYCQB-RXVVDRJESA-N 2 0 347.506 4.211 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](c1ccc(F)c(Cl)c1)C1CC1 ZINC000423152420 1038002795 /nfs/dbraw/zinc/00/27/95/1038002795.db2.gz DZJKQPQIASUSLD-CWTRNNRKSA-N 2 0 347.865 4.443 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+][C@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423132904 1038010324 /nfs/dbraw/zinc/01/03/24/1038010324.db2.gz PSHKXABLJGFXBU-FUPPJEDESA-N 2 0 348.490 4.218 20 0 EIADRP Cc1cc(F)ccc1-c1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)o1 ZINC000503948799 1038017135 /nfs/dbraw/zinc/01/71/35/1038017135.db2.gz WSXPBUGHFXINLC-UHFFFAOYSA-N 2 0 330.447 4.216 20 0 EIADRP Cc1c(F)cccc1-c1ccc(C[NH2+]CC2(C)CC[NH+](C)CC2)o1 ZINC000503945115 1038033855 /nfs/dbraw/zinc/03/38/55/1038033855.db2.gz LXTJPTAUELUDPT-UHFFFAOYSA-N 2 0 330.447 4.216 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+]C[C@@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423209653 1038038659 /nfs/dbraw/zinc/03/86/59/1038038659.db2.gz JBSIBYPKCVVPDS-WBVHZDCISA-N 2 0 341.524 4.085 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@H]([NH2+]C[C@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423209650 1038039273 /nfs/dbraw/zinc/03/92/73/1038039273.db2.gz JBSIBYPKCVVPDS-DOTOQJQBSA-N 2 0 341.524 4.085 20 0 EIADRP C[C@@H]([NH2+]CC1([NH3+])CCCCCC1)[C@H](C)c1nc2ccccc2s1 ZINC000423200053 1038048441 /nfs/dbraw/zinc/04/84/41/1038048441.db2.gz LNUVJOQKRRCOJX-LSDHHAIUSA-N 2 0 331.529 4.430 20 0 EIADRP C[C@H]([NH2+]Cc1oc2ccc(Cl)cc2c1-c1ccccc1)C1C[NH2+]C1 ZINC000423195074 1038049701 /nfs/dbraw/zinc/04/97/01/1038049701.db2.gz XLSLYIXNOSKTER-ZDUSSCGKSA-N 2 0 340.854 4.451 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccsc1 ZINC000423214527 1038056750 /nfs/dbraw/zinc/05/67/50/1038056750.db2.gz PBOWCSSJHVZKLA-KBXCAEBGSA-N 2 0 334.916 4.275 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(SCC(F)F)cc1)[C@@H]1CCC[NH2+]C1 ZINC000423214931 1038061524 /nfs/dbraw/zinc/06/15/24/1038061524.db2.gz MBCLGANOCUZQQF-GZBFAFLISA-N 2 0 328.472 4.083 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccc2ccccc2c1OC(F)F ZINC000423222151 1038065953 /nfs/dbraw/zinc/06/59/53/1038065953.db2.gz ZWSHUUMUWYKKDN-LRVUVFPRSA-N 2 0 334.410 4.362 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000423220286 1038066664 /nfs/dbraw/zinc/06/66/64/1038066664.db2.gz VHOIPKPBMHLPIC-LMWSTFAQSA-N 2 0 332.435 4.262 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000423233111 1038069009 /nfs/dbraw/zinc/06/90/09/1038069009.db2.gz NYNMIJJKHGXTDK-YJNKEBTESA-N 2 0 326.406 4.201 20 0 EIADRP Fc1cc(F)cc(C[N@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)c1 ZINC000414724796 1038071392 /nfs/dbraw/zinc/07/13/92/1038071392.db2.gz SZSVJKLYMUQWMA-GOSISDBHSA-N 2 0 348.462 4.171 20 0 EIADRP Fc1ccc([C@@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2ccc(Cl)cc2)cc1 ZINC000423247924 1038079033 /nfs/dbraw/zinc/07/90/33/1038079033.db2.gz MFCPOLOIOWTMRF-KUHUBIRLSA-N 2 0 332.850 4.158 20 0 EIADRP Fc1ccc([C@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2ccc(Cl)cc2)cc1 ZINC000423247923 1038079102 /nfs/dbraw/zinc/07/91/02/1038079102.db2.gz MFCPOLOIOWTMRF-IFXJQAMLSA-N 2 0 332.850 4.158 20 0 EIADRP c1ccc(-c2nc3c(s2)[C@@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)CCC3)cc1 ZINC000423256478 1038084046 /nfs/dbraw/zinc/08/40/46/1038084046.db2.gz FGIMGAWRSIZOSB-RDJZCZTQSA-N 2 0 341.524 4.167 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCCOc3cc(Cl)ccc32)cc1 ZINC000423288931 1038090820 /nfs/dbraw/zinc/09/08/20/1038090820.db2.gz AAUDJRCGKOJMEP-SCLBCKFNSA-N 2 0 330.859 4.363 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2ccccc2OC(F)(F)F)cc1 ZINC000423292198 1038094642 /nfs/dbraw/zinc/09/46/42/1038094642.db2.gz LYMZQYLXUJBWKD-CHWSQXEVSA-N 2 0 338.373 4.456 20 0 EIADRP CCOc1ccc([C@@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1OCC ZINC000423291939 1038095396 /nfs/dbraw/zinc/09/53/96/1038095396.db2.gz KQCPOTCHIVOTSD-HZPDHXFCSA-N 2 0 342.483 4.355 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCCOc3ccc(Cl)cc32)cc1 ZINC000423291258 1038097079 /nfs/dbraw/zinc/09/70/79/1038097079.db2.gz HNJXBVDDVOFYND-FZKQIMNGSA-N 2 0 330.859 4.363 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1cccc(Br)c1 ZINC000423294576 1038118418 /nfs/dbraw/zinc/11/84/18/1038118418.db2.gz UWYXFQVUWVNAKV-QWHCGFSZSA-N 2 0 333.273 4.320 20 0 EIADRP Cc1ccccc1COc1ccc([C@H](C)[NH2+]CC2=CC[NH2+]CC2)cc1 ZINC000423346726 1038138201 /nfs/dbraw/zinc/13/82/01/1038138201.db2.gz PNCFSGFMFMAJHL-SFHVURJKSA-N 2 0 336.479 4.144 20 0 EIADRP CSC1(C[NH2+][C@H](c2cccnc2)C2CCCCC2)CC[NH+](C)CC1 ZINC000593710147 1038138454 /nfs/dbraw/zinc/13/84/54/1038138454.db2.gz CGXTVHMBGMCAPN-IBGZPJMESA-N 2 0 347.572 4.120 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000423330350 1038139809 /nfs/dbraw/zinc/13/98/09/1038139809.db2.gz NPOILIUALLIMHE-MGPUTAFESA-N 2 0 343.540 4.467 20 0 EIADRP CCOc1cccc2cc([C@H](C)[NH2+]Cc3ccc4c(c3)C[NH2+]C4)oc21 ZINC000423367538 1038183049 /nfs/dbraw/zinc/18/30/49/1038183049.db2.gz CQLASYXOFQDGAQ-AWEZNQCLSA-N 2 0 336.435 4.286 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(OC(F)F)cc1 ZINC000423365214 1038187445 /nfs/dbraw/zinc/18/74/45/1038187445.db2.gz WGZAAPSXERNRNY-SFHVURJKSA-N 2 0 332.394 4.132 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(OC(F)(F)F)cc1 ZINC000423376813 1038205360 /nfs/dbraw/zinc/20/53/60/1038205360.db2.gz JBRSHNQRXRFSLU-LBPRGKRZSA-N 2 0 336.357 4.039 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1C[C@@H](C)c2c1cccc2Br ZINC000423434052 1038237081 /nfs/dbraw/zinc/23/70/81/1038237081.db2.gz NSOWKIZRPTYTGW-JMSVASOKSA-N 2 0 325.294 4.105 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1ccc(SCC(F)F)cc1 ZINC000423460339 1038240382 /nfs/dbraw/zinc/24/03/82/1038240382.db2.gz ASMONBFCGCOFHJ-GZBFAFLISA-N 2 0 328.472 4.212 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1ccc(Br)cc1 ZINC000423461238 1038241163 /nfs/dbraw/zinc/24/11/63/1038241163.db2.gz NSXZHZZKTCDMHI-MAZHCROVSA-N 2 0 325.294 4.007 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000423459877 1038241268 /nfs/dbraw/zinc/24/12/68/1038241268.db2.gz RNQWVHAMBHDERN-DOMZBBRYSA-N 2 0 333.476 4.044 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H](c2ccc(Br)cc2)C2CC2)C1 ZINC000423461973 1038242532 /nfs/dbraw/zinc/24/25/32/1038242532.db2.gz DBEUEJMHKIRWER-JCURWCKSSA-N 2 0 337.305 4.007 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423463456 1038242789 /nfs/dbraw/zinc/24/27/89/1038242789.db2.gz GAGATCUMBBFVHE-FRFSOERESA-N 2 0 328.422 4.134 20 0 EIADRP Clc1ccc([C@@H](Cc2cccnc2)[NH2+]CCC[C@H]2CCC[NH2+]2)cc1 ZINC000423469156 1038245380 /nfs/dbraw/zinc/24/53/80/1038245380.db2.gz CKSLIMMYOBPEBR-WOJBJXKFSA-N 2 0 343.902 4.141 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000423470720 1038246904 /nfs/dbraw/zinc/24/69/04/1038246904.db2.gz LUTGWGKHJWBQON-IXDOHACOSA-N 2 0 327.516 4.331 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423481773 1038251717 /nfs/dbraw/zinc/25/17/17/1038251717.db2.gz ONPLDJJYVWSHDG-MAUKXSAKSA-N 2 0 343.540 4.225 20 0 EIADRP CSC[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(C(F)(F)F)cc1 ZINC000423480507 1038252034 /nfs/dbraw/zinc/25/20/34/1038252034.db2.gz NJUGFOXPQQYSSJ-JKSUJKDBSA-N 2 0 346.462 4.231 20 0 EIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cnn(C2CCCC2)c1 ZINC000423499462 1038254497 /nfs/dbraw/zinc/25/44/97/1038254497.db2.gz AYPYWIDUSATFRY-UZLBHIALSA-N 2 0 326.488 4.129 20 0 EIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1nc2c(s1)CCCC2 ZINC000423504567 1038256631 /nfs/dbraw/zinc/25/66/31/1038256631.db2.gz NNBTXWXLDBTOBA-ZBFHGGJFSA-N 2 0 329.513 4.153 20 0 EIADRP Cc1c([C@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)cnn1-c1cccc(Cl)c1 ZINC000423487327 1038261913 /nfs/dbraw/zinc/26/19/13/1038261913.db2.gz UBRZHVKBOOIRPN-YOEHRIQHSA-N 2 0 346.906 4.017 20 0 EIADRP CC[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(OC)c(OC)c1 ZINC000423495316 1038264716 /nfs/dbraw/zinc/26/47/16/1038264716.db2.gz BQZGKSDCXPPMJJ-MOPGFXCFSA-N 2 0 342.483 4.225 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000423491977 1038265336 /nfs/dbraw/zinc/26/53/36/1038265336.db2.gz LAUNYBNRFZGMPV-YUTCNCBUSA-N 2 0 333.476 4.036 20 0 EIADRP c1ccc2c(c1)sc1c2CCC[C@H]1[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1 ZINC000423557509 1038278292 /nfs/dbraw/zinc/27/82/92/1038278292.db2.gz ZWNWCCJRRFSLTH-ATNYBXOESA-N 2 0 326.509 4.256 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]CCC3=CC[NH2+]CC3)cs2)cs1 ZINC000423545057 1038289150 /nfs/dbraw/zinc/28/91/50/1038289150.db2.gz XEWCSAWYQUKDEO-LBPRGKRZSA-N 2 0 333.526 4.140 20 0 EIADRP C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000423545578 1038289856 /nfs/dbraw/zinc/28/98/56/1038289856.db2.gz XZQQIMIGGBBYNX-ZDUSSCGKSA-N 2 0 344.446 4.301 20 0 EIADRP C[C@H]([NH2+][C@@H]1CSCc2ccccc21)c1cccc(C[NH+](C)C)c1 ZINC000924850099 1038326616 /nfs/dbraw/zinc/32/66/16/1038326616.db2.gz QURGSSKUBFBGLA-MGPUTAFESA-N 2 0 326.509 4.387 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC[C@H](c2nc3c(s2)CCCC3)C1 ZINC000490070160 1038331241 /nfs/dbraw/zinc/33/12/41/1038331241.db2.gz WRCXGXISGHLADO-DLBZAZTESA-N 2 0 347.572 4.076 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@H]2CCc3[nH]c4ccc(C)cc4c3C2)CC1 ZINC000490123753 1038351550 /nfs/dbraw/zinc/35/15/50/1038351550.db2.gz FAUNACDFFUOBAA-SFHVURJKSA-N 2 0 339.527 4.188 20 0 EIADRP CSC[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(C(F)(F)F)cc1 ZINC000594511099 1038356426 /nfs/dbraw/zinc/35/64/26/1038356426.db2.gz RAZLTUBTWKPHKH-UHOFOFEASA-N 2 0 346.462 4.039 20 0 EIADRP CC(C)[C@H](CSc1ccccc1)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000490159815 1038364859 /nfs/dbraw/zinc/36/48/59/1038364859.db2.gz ZQAXAZMFWVBBHV-FQEVSTJZSA-N 2 0 332.557 4.267 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)CC[N@@H+]1C ZINC000608061538 1038442956 /nfs/dbraw/zinc/44/29/56/1038442956.db2.gz JLQCDGZVCNUQEF-NQIIRXRSSA-N 2 0 347.506 4.262 20 0 EIADRP Cc1ccc(COc2ccc(C[NH2+][C@H]3CC[N@H+](C)[C@@H](C)C3)cc2)cc1 ZINC000608061370 1038453859 /nfs/dbraw/zinc/45/38/59/1038453859.db2.gz RGXOILJNFWAARJ-RXVVDRJESA-N 2 0 338.495 4.146 20 0 EIADRP Cc1cc(N2CC[C@H]([N@H+](C)Cc3ccccc3)C2)c2ccccc2[nH+]1 ZINC000608092968 1038603970 /nfs/dbraw/zinc/60/39/70/1038603970.db2.gz ZWOLCPMFBLRWKK-IBGZPJMESA-N 2 0 331.463 4.254 20 0 EIADRP Cc1ccc(C[NH+](C)C)cc1NC(=O)CC[C@@H]([NH3+])CC1CCCCC1 ZINC000424148646 1038647782 /nfs/dbraw/zinc/64/77/82/1038647782.db2.gz USSNMGOHKBCTME-LJQANCHMSA-N 2 0 345.531 4.073 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@H](Cc1ccncc1)c1cccs1 ZINC000424266217 1038762652 /nfs/dbraw/zinc/76/26/52/1038762652.db2.gz WPYQMWFMOSTQSA-IEBWSBKVSA-N 2 0 343.540 4.281 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H](c2cccnc2C(F)(F)F)C2CC2)CC1 ZINC001168314937 1038819557 /nfs/dbraw/zinc/81/95/57/1038819557.db2.gz IJLXHDJEMULBGI-ZBCRRDGASA-N 2 0 341.421 4.014 20 0 EIADRP Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]Cc1ccccc1OCC[NH+](C)C ZINC000504911856 1038847800 /nfs/dbraw/zinc/84/78/00/1038847800.db2.gz MTSGYTIAUAYPQQ-YLJYHZDGSA-N 2 0 338.495 4.274 20 0 EIADRP CC(C)[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1cccc(C(F)(F)F)c1 ZINC000539162853 1038865284 /nfs/dbraw/zinc/86/52/84/1038865284.db2.gz MLXCARWRSAMKGX-RDTXWAMCSA-N 2 0 340.433 4.476 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000539201329 1038879178 /nfs/dbraw/zinc/87/91/78/1038879178.db2.gz WTWIIUSWZHCSHY-RDTXWAMCSA-N 2 0 340.433 4.478 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2cccc(Br)c2)C1 ZINC000481024777 1038964538 /nfs/dbraw/zinc/96/45/38/1038964538.db2.gz NJPQJONRZQKKHC-YOEHRIQHSA-N 2 0 339.321 4.222 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000481045402 1038976527 /nfs/dbraw/zinc/97/65/27/1038976527.db2.gz ZWZPJRXBLYNDNA-IAGOWNOFSA-N 2 0 344.474 4.048 20 0 EIADRP C[C@@H](Cc1ccccc1F)[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000481045403 1038978867 /nfs/dbraw/zinc/97/88/67/1038978867.db2.gz ZWZPJRXBLYNDNA-IRXDYDNUSA-N 2 0 344.474 4.048 20 0 EIADRP Cc1cc(Br)ccc1C[NH2+]Cc1ccc([C@@H](C)[NH3+])cc1 ZINC000414801695 1038982727 /nfs/dbraw/zinc/98/27/27/1038982727.db2.gz ALRXLDODXJCNNH-CYBMUJFWSA-N 2 0 333.273 4.067 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000555232558 1038999540 /nfs/dbraw/zinc/99/95/40/1038999540.db2.gz HVPRVHXZAGIKNW-ZXMXYHOLSA-N 2 0 348.534 4.333 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)c(OC(F)F)cc1C ZINC000414808090 1039026412 /nfs/dbraw/zinc/02/64/12/1039026412.db2.gz JZOLPNLJEHLNEM-AWEZNQCLSA-N 2 0 334.410 4.214 20 0 EIADRP c1cc(OCC[NH+]2CCCC2)ccc1C[NH2+]CCC1=CCCCC1 ZINC000642195379 1039069821 /nfs/dbraw/zinc/06/98/21/1039069821.db2.gz GDPMBCPWSBMJSP-UHFFFAOYSA-N 2 0 328.500 4.141 20 0 EIADRP Cc1cc(Br)c(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)s1 ZINC000414816344 1039084775 /nfs/dbraw/zinc/08/47/75/1039084775.db2.gz PNGMKDDQGIGMJJ-LLVKDONJSA-N 2 0 339.302 4.129 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CCCCc2ccc(Cl)s2)[C@@H]2CCC[C@H]21 ZINC000552052885 1039107133 /nfs/dbraw/zinc/10/71/33/1039107133.db2.gz IUMLOVMOTVXYCR-HRCADAONSA-N 2 0 326.937 4.187 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1cccc(OC(F)F)c1 ZINC000477916067 1039226136 /nfs/dbraw/zinc/22/61/36/1039226136.db2.gz QEJZWSOOOGWSOY-CQSZACIVSA-N 2 0 326.431 4.061 20 0 EIADRP CCc1ccc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1 ZINC000481307051 1039253898 /nfs/dbraw/zinc/25/38/98/1039253898.db2.gz IRMZIKCEIWKOPR-QGZVFWFLSA-N 2 0 326.484 4.040 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](Cc2ccccc2)c2sccc2C)C1 ZINC000481314185 1039283790 /nfs/dbraw/zinc/28/37/90/1039283790.db2.gz BNPWDZBOPYSXCH-MOPGFXCFSA-N 2 0 328.525 4.272 20 0 EIADRP CCC[C@@H]([NH2+]C[C@H]1CC[N@H+](CC)C1)c1cccc(C(F)(F)F)c1 ZINC000481325247 1039295228 /nfs/dbraw/zinc/29/52/28/1039295228.db2.gz VBJJTDJWJMBBMT-RHSMWYFYSA-N 2 0 328.422 4.478 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2COc3ccccc32)cc1 ZINC000090845041 1039307941 /nfs/dbraw/zinc/30/79/41/1039307941.db2.gz NZYHVNFHVORNQK-MRUHUIDDSA-N 2 0 347.462 4.396 20 0 EIADRP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)c1ccc(OCC(F)(F)F)cc1 ZINC000481330927 1039308440 /nfs/dbraw/zinc/30/84/40/1039308440.db2.gz FBFBXJPYSBFVSZ-LSDHHAIUSA-N 2 0 344.421 4.010 20 0 EIADRP c1cc(-c2nc3ccccc3s2)oc1C[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000414843522 1039344941 /nfs/dbraw/zinc/34/49/41/1039344941.db2.gz QCJQJMZDSHLMBG-CQSZACIVSA-N 2 0 341.480 4.036 20 0 EIADRP c1csc([C@@H]([NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)C2CCCC2)c1 ZINC000091726560 1039389043 /nfs/dbraw/zinc/38/90/43/1039389043.db2.gz STOUOHJOIGLDEG-JXFKEZNVSA-N 2 0 348.556 4.070 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2cccc(OC(F)F)c2)CC1 ZINC000121713306 1039439401 /nfs/dbraw/zinc/43/94/01/1039439401.db2.gz JDKRSCJMCXEXLT-CQSZACIVSA-N 2 0 326.431 4.061 20 0 EIADRP Fc1ccc(C(F)(F)F)cc1C[NH2+]CCCCC[NH+]1CCCC1 ZINC000555613409 1039447200 /nfs/dbraw/zinc/44/72/00/1039447200.db2.gz CQFNSPSTVRIILW-UHFFFAOYSA-N 2 0 332.385 4.200 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1cccc(C)c1 ZINC000514106128 1039615554 /nfs/dbraw/zinc/61/55/54/1039615554.db2.gz VVFIDPMDGVQRTH-NRFANRHFSA-N 2 0 326.484 4.176 20 0 EIADRP Cc1cc(C)cc([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)c1 ZINC000122274625 1039639145 /nfs/dbraw/zinc/63/91/45/1039639145.db2.gz AQDLFNYGPDZCAK-GOSISDBHSA-N 2 0 326.484 4.095 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc2ccccc2o1 ZINC000122398862 1039702337 /nfs/dbraw/zinc/70/23/37/1039702337.db2.gz KTADWEMVDWRDLX-MRXNPFEDSA-N 2 0 338.451 4.224 20 0 EIADRP C[C@H](CC[NH2+][C@H](c1cccnc1)C1CCC1)[N@H+](C)Cc1ccccc1 ZINC000481666503 1039719296 /nfs/dbraw/zinc/71/92/96/1039719296.db2.gz IXANJMWBOPJLSZ-GCJKJVERSA-N 2 0 337.511 4.423 20 0 EIADRP CCCCOc1ccc(C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1OC ZINC000061003161 1039780440 /nfs/dbraw/zinc/78/04/40/1039780440.db2.gz XPSAHOSNXAXFMB-UHFFFAOYSA-N 2 0 348.531 4.273 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cc(C)sc2C)[C@H](C)C1 ZINC000122844937 1039798955 /nfs/dbraw/zinc/79/89/55/1039798955.db2.gz PEQLWUNCNZJPFO-ALKREAHSSA-N 2 0 338.561 4.153 20 0 EIADRP C[N@@H+]1CC[C@]2(CC[NH+](CCCCc3cccc(C(F)(F)F)c3)C2)C1 ZINC000430121185 1039845469 /nfs/dbraw/zinc/84/54/69/1039845469.db2.gz GIVINGOSNIDYIB-SFHVURJKSA-N 2 0 340.433 4.056 20 0 EIADRP Cc1nc([C@H](C)[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cs1 ZINC000552920144 1039868910 /nfs/dbraw/zinc/86/89/10/1039868910.db2.gz SSSAPUUFJWJSTJ-TXPKVOOTSA-N 2 0 343.540 4.403 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cccc(OC(F)(F)F)c2)CC1 ZINC000535083155 1039920607 /nfs/dbraw/zinc/92/06/07/1039920607.db2.gz LYAZDCXAHFBWRC-UHFFFAOYSA-N 2 0 344.421 4.137 20 0 EIADRP CN(c1ccccc1C[N@@H+]1CC[C@H]1c1ccccc1)C1CC[NH+](C)CC1 ZINC000434986061 1039984279 /nfs/dbraw/zinc/98/42/79/1039984279.db2.gz MCCNCNUUAFFMCO-QHCPKHFHSA-N 2 0 349.522 4.164 20 0 EIADRP C[C@@H]([NH2+]Cc1coc2ccccc12)c1ccc(OCC[NH+](C)C)cc1 ZINC000551205298 1040060873 /nfs/dbraw/zinc/06/08/73/1040060873.db2.gz JBHXJTQJZKRFTE-MRXNPFEDSA-N 2 0 338.451 4.224 20 0 EIADRP CC(C)=CCC[C@H](C)CC[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1 ZINC000482212063 1040080629 /nfs/dbraw/zinc/08/06/29/1040080629.db2.gz PIJOPUDUOKVABO-TYPHKJRUSA-N 2 0 336.564 4.117 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+]Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC000551242759 1040090934 /nfs/dbraw/zinc/09/09/34/1040090934.db2.gz ZSNBPSLGJQEQBP-UHFFFAOYSA-N 2 0 349.931 4.285 20 0 EIADRP CCOC1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCC1 ZINC000551264831 1040123987 /nfs/dbraw/zinc/12/39/87/1040123987.db2.gz OJWSHOUSPXFTFP-MZADTFQBSA-N 2 0 342.527 4.121 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2c3cc(F)ccc3C[C@H]2C)c1 ZINC000482323922 1040167394 /nfs/dbraw/zinc/16/73/94/1040167394.db2.gz UJJGFRKNQMULGQ-VFNWGFHPSA-N 2 0 326.459 4.301 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1ccc(OC(F)F)cc1 ZINC000482328899 1040180494 /nfs/dbraw/zinc/18/04/94/1040180494.db2.gz IVLIDVYIAYJZSV-CRAIPNDOSA-N 2 0 340.458 4.449 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)C1 ZINC000482336224 1040186096 /nfs/dbraw/zinc/18/60/96/1040186096.db2.gz RVECHZWGPGIUIM-HUUCEWRRSA-N 2 0 328.422 4.476 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cccc(OC(F)(F)F)c2)C1 ZINC000482355197 1040196371 /nfs/dbraw/zinc/19/63/71/1040196371.db2.gz FKRXCVUQOCIMEU-CABCVRRESA-N 2 0 344.421 4.356 20 0 EIADRP C[C@@H]1Cc2ccccc2[C@@H]1[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000482456269 1040254149 /nfs/dbraw/zinc/25/41/49/1040254149.db2.gz ZGWQUNFJGWFIJH-KKLQWCBXSA-N 2 0 334.507 4.074 20 0 EIADRP C[C@@H](Cc1ccccc1)C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000482518168 1040314778 /nfs/dbraw/zinc/31/47/78/1040314778.db2.gz KQGOFIBNDRRBHS-IBGZPJMESA-N 2 0 337.511 4.109 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc2c(s1)CCC2 ZINC000479467134 1040393347 /nfs/dbraw/zinc/39/33/47/1040393347.db2.gz VDPXLYFPHNQKBN-WMZOPIPTSA-N 2 0 340.536 4.410 20 0 EIADRP C[C@@H](Cc1c(Cl)cccc1Cl)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995700 1040393689 /nfs/dbraw/zinc/39/36/89/1040393689.db2.gz WWJXPZNWKYHUTC-QWHCGFSZSA-N 2 0 327.299 4.189 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2cscc2Br)CC1 ZINC000514972328 1040396968 /nfs/dbraw/zinc/39/69/68/1040396968.db2.gz MCGXRGCQZOGVAR-UHFFFAOYSA-N 2 0 345.350 4.064 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)ccc1F ZINC000479531820 1040457695 /nfs/dbraw/zinc/45/76/95/1040457695.db2.gz VQOSUKAZUGZKGM-IBGZPJMESA-N 2 0 332.850 4.318 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cc2cc(Cl)ccc2o1 ZINC000539494273 1040469460 /nfs/dbraw/zinc/46/94/60/1040469460.db2.gz CQNZUUJZBKPNPX-XJKSGUPXSA-N 2 0 338.879 4.094 20 0 EIADRP c1ccc(C[NH+]2CCC[C@H]3C[N@H+](CCCc4ccncc4)CC[C@@H]32)cc1 ZINC000462314226 1040474823 /nfs/dbraw/zinc/47/48/23/1040474823.db2.gz JBUAKLCMTLYAFJ-GOTSBHOMSA-N 2 0 349.522 4.001 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cn(C(C)C)nc2C)CC1)CC(C)C ZINC000515093418 1040479823 /nfs/dbraw/zinc/47/98/23/1040479823.db2.gz KPELWSPVJXJRBI-UHFFFAOYSA-N 2 0 348.579 4.352 20 0 EIADRP C[C@@H]([NH2+]CCCc1cccc(F)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000482874816 1040533567 /nfs/dbraw/zinc/53/35/67/1040533567.db2.gz PUGKDUNKZOTADZ-QGZVFWFLSA-N 2 0 344.474 4.050 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000482894185 1040555084 /nfs/dbraw/zinc/55/50/84/1040555084.db2.gz RVKYCRROCPPJAX-PXNSSMCTSA-N 2 0 338.495 4.008 20 0 EIADRP Clc1ccc2oc(C3CC[NH+](CCC4CC[NH2+]CC4)CC3)nc2c1 ZINC000479684864 1040566423 /nfs/dbraw/zinc/56/64/23/1040566423.db2.gz ASGFGMGXIPFAJQ-UHFFFAOYSA-N 2 0 347.890 4.050 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](C[C@H]2CCC3(CCCC3)O2)CC1 ZINC000515218185 1040570267 /nfs/dbraw/zinc/57/02/67/1040570267.db2.gz UUDZWFHXVXCMDC-HXUWFJFHSA-N 2 0 336.564 4.312 20 0 EIADRP COc1ncc([C@@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cc1Cl ZINC000551788738 1040601339 /nfs/dbraw/zinc/60/13/39/1040601339.db2.gz JWHKVGIYIAFTGU-OAHLLOKOSA-N 2 0 339.911 4.050 20 0 EIADRP CCOCc1ccc(C[NH2+][C@H](C)c2cccc(C[NH+](C)C)c2)cc1 ZINC000924638448 1040632032 /nfs/dbraw/zinc/63/20/32/1040632032.db2.gz JSPFPIYCTPSZBS-QGZVFWFLSA-N 2 0 326.484 4.136 20 0 EIADRP Cc1ccccc1[C@H](CC(C)C)[NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1 ZINC000483199007 1040757603 /nfs/dbraw/zinc/75/76/03/1040757603.db2.gz NGWMSJMHMOTFDK-KNQAVFIVSA-N 2 0 344.543 4.173 20 0 EIADRP CCC[NH+]1CCC([NH2+]CC2(OC)CCC(c3ccccc3)CC2)CC1 ZINC000554086606 1040794895 /nfs/dbraw/zinc/79/48/95/1040794895.db2.gz YBRMPWFFIDTLTD-UHFFFAOYSA-N 2 0 344.543 4.193 20 0 EIADRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(OC)c3ccccc23)C1 ZINC000539821751 1040815202 /nfs/dbraw/zinc/81/52/02/1040815202.db2.gz LECWWBFJUZDFKT-KRWDZBQOSA-N 2 0 326.484 4.012 20 0 EIADRP COc1ccc(C[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)cc1Cl ZINC000462671756 1040819720 /nfs/dbraw/zinc/81/97/20/1040819720.db2.gz DEUYEWFVOZVPKV-HZPDHXFCSA-N 2 0 338.923 4.196 20 0 EIADRP Cc1cn2c(n1)[C@H](C[NH2+][C@H](C)c1ccc(OCC(C)C)cc1)CCC2 ZINC000483444492 1040861383 /nfs/dbraw/zinc/86/13/83/1040861383.db2.gz FTLSARLIGQGWIN-MJGOQNOKSA-N 2 0 341.499 4.455 20 0 EIADRP Cc1ccncc1[C@@H](C)[NH2+][C@H]1[C@H](C)C[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000537881518 1040869306 /nfs/dbraw/zinc/86/93/06/1040869306.db2.gz NZHAJUAUGYBCJP-MOXWOTFGSA-N 2 0 337.511 4.197 20 0 EIADRP C[C@@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1ccc2c(c1)COC2 ZINC000483672077 1040960729 /nfs/dbraw/zinc/96/07/29/1040960729.db2.gz PPUYZLPVPHLNLJ-ZWKOTPCHSA-N 2 0 338.495 4.278 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(CNC2CC[NH+](C3CCCC3)CC2)c1 ZINC000537969807 1040973880 /nfs/dbraw/zinc/97/38/80/1040973880.db2.gz SVKWMKCSMOZSSV-UHFFFAOYSA-N 2 0 343.559 4.023 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2ccc(Br)s2)CC1 ZINC000483724074 1040974566 /nfs/dbraw/zinc/97/45/66/1040974566.db2.gz GDCKBFITLUVDGM-GFCCVEGCSA-N 2 0 345.350 4.283 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)CC1 ZINC000483753632 1040999655 /nfs/dbraw/zinc/99/96/55/1040999655.db2.gz ZWLULCBYCRTKGG-AWEZNQCLSA-N 2 0 328.422 4.478 20 0 EIADRP CSC1(C[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)CC[NH+](C)CC1 ZINC000515716681 1041008841 /nfs/dbraw/zinc/00/88/41/1041008841.db2.gz RJEDJABETOUILW-QGZVFWFLSA-N 2 0 340.964 4.454 20 0 EIADRP Fc1cccc2[nH]c(C[NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)cc21 ZINC000436282137 1041027500 /nfs/dbraw/zinc/02/75/00/1041027500.db2.gz QHPXKKBBHWVPSS-UHFFFAOYSA-N 2 0 337.442 4.193 20 0 EIADRP CC(C)[C@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1cccnc1 ZINC000538115703 1041067119 /nfs/dbraw/zinc/06/71/19/1041067119.db2.gz AWLKXZWBWGWDFY-RXVVDRJESA-N 2 0 325.500 4.279 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@H](c2ccccc2)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000436300982 1041069123 /nfs/dbraw/zinc/06/91/23/1041069123.db2.gz XJXNTKQIBNNYJC-YYWHXJBOSA-N 2 0 338.495 4.224 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000436306042 1041078545 /nfs/dbraw/zinc/07/85/45/1041078545.db2.gz NTILICQRBKONJP-GZMRBYKVSA-N 2 0 340.433 4.270 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)cn1 ZINC000480221448 1041092182 /nfs/dbraw/zinc/09/21/82/1041092182.db2.gz UHDWFBNSKRQBRN-MRXNPFEDSA-N 2 0 343.902 4.298 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccc(Cl)cn1 ZINC000480221447 1041092774 /nfs/dbraw/zinc/09/27/74/1041092774.db2.gz UHDWFBNSKRQBRN-INIZCTEOSA-N 2 0 343.902 4.298 20 0 EIADRP C[C@@H]([NH2+][C@@H](c1cccs1)C1CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000480274213 1041152978 /nfs/dbraw/zinc/15/29/78/1041152978.db2.gz MJNBBJHFPRIZTM-FOIQADDNSA-N 2 0 344.524 4.490 20 0 EIADRP Cc1ccc(SC2(C[NH2+][C@@H]3CC[N@H+](C)[C@H](C)C3)CCCC2)cc1 ZINC000484287866 1041195898 /nfs/dbraw/zinc/19/58/98/1041195898.db2.gz CYHWAVGHHIMLBB-QZTJIDSGSA-N 2 0 332.557 4.472 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC000484316755 1041207343 /nfs/dbraw/zinc/20/73/43/1041207343.db2.gz ZOTCIHCIKUFDQS-TZMCWYRMSA-N 2 0 333.303 4.001 20 0 EIADRP Cc1cc(C)cc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c1 ZINC000060952476 1041218293 /nfs/dbraw/zinc/21/82/93/1041218293.db2.gz AXDJYNHFEKBIJR-UHFFFAOYSA-N 2 0 328.525 4.367 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(-c3scnc3C)cc2)[C@@H](C)C1 ZINC000667666261 1041240184 /nfs/dbraw/zinc/24/01/84/1041240184.db2.gz HJKDVEFSROVGCN-KXBFYZLASA-N 2 0 343.540 4.281 20 0 EIADRP C[NH+](C)[C@@H]1CCC[C@@H]([NH2+][C@H]2CCc3ccc(OC(F)(F)F)cc32)C1 ZINC000484472557 1041247361 /nfs/dbraw/zinc/24/73/61/1041247361.db2.gz KVMMPHJPXGJDCA-CPUCHLNUSA-N 2 0 342.405 4.035 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)c2ccccc12 ZINC000484496507 1041303424 /nfs/dbraw/zinc/30/34/24/1041303424.db2.gz RMDHTRPAXXILHP-BBWFWOEESA-N 2 0 326.484 4.372 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)c2ccccc12 ZINC000484496508 1041303834 /nfs/dbraw/zinc/30/38/34/1041303834.db2.gz RMDHTRPAXXILHP-GVDBMIGSSA-N 2 0 326.484 4.372 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccc(Oc2ccc(F)cc2)cc1 ZINC000480445709 1041303975 /nfs/dbraw/zinc/30/39/75/1041303975.db2.gz OMUYKTOXCRVFEZ-MGPUTAFESA-N 2 0 328.431 4.048 20 0 EIADRP Cc1cccc(CCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC000287323220 1041423687 /nfs/dbraw/zinc/42/36/87/1041423687.db2.gz FMSVDHDEKJOAPD-WBDAEOGXSA-N 2 0 349.522 4.108 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]CC[C@@H]2CCC[N@@H+]2C)cc1OC ZINC000540377595 1041428380 /nfs/dbraw/zinc/42/83/80/1041428380.db2.gz QHYHLNPFPKZLNH-WMZOPIPTSA-N 2 0 334.504 4.009 20 0 EIADRP CN(c1ccccc1C[NH2+]C/C=C\c1ccccc1)C1CC[NH+](C)CC1 ZINC000538671625 1041470902 /nfs/dbraw/zinc/47/09/02/1041470902.db2.gz JGNAFFMSVTULKK-FLIBITNWSA-N 2 0 349.522 4.020 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H](C)c1cccc(F)c1 ZINC000480734928 1041495854 /nfs/dbraw/zinc/49/58/54/1041495854.db2.gz VZVOQLDNKSUYMM-QGZVFWFLSA-N 2 0 344.474 4.397 20 0 EIADRP COc1ccc([C@@H](CCC(C)C)[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000480749104 1041504230 /nfs/dbraw/zinc/50/42/30/1041504230.db2.gz ZWJARYOOIGBSRA-LAUBAEHRSA-N 2 0 330.516 4.246 20 0 EIADRP COc1ccc([C@@H](CCC(C)C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000480749102 1041505401 /nfs/dbraw/zinc/50/54/01/1041505401.db2.gz ZWJARYOOIGBSRA-DYESRHJHSA-N 2 0 330.516 4.246 20 0 EIADRP c1csc(C[NH+]2CCC3(CC[N@H+](Cc4ccccc4)C3)CC2)c1 ZINC000538762575 1041534913 /nfs/dbraw/zinc/53/49/13/1041534913.db2.gz XSUPPBQJVOOJHV-UHFFFAOYSA-N 2 0 326.509 4.236 20 0 EIADRP CCC[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1cccc(C(F)(F)F)c1 ZINC000540605222 1041558172 /nfs/dbraw/zinc/55/81/72/1041558172.db2.gz FTTIYBUNGYFKOT-KRWDZBQOSA-N 2 0 326.406 4.398 20 0 EIADRP CSC1(C[NH2+][C@H](C)c2oc3ccccc3c2C)CC[NH+](C)CC1 ZINC000516516479 1041613052 /nfs/dbraw/zinc/61/30/52/1041613052.db2.gz FCARRUHNXHUTJW-OAHLLOKOSA-N 2 0 332.513 4.219 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1Nc1ccc(C[NH+]2CCCC[C@H]2C)cc1 ZINC000540699941 1041614799 /nfs/dbraw/zinc/61/47/99/1041614799.db2.gz RRMSCPHOFKVVRT-IKVWTGGYSA-N 2 0 329.532 4.202 20 0 EIADRP C[C@@H](CCc1cccc(C(F)(F)F)c1)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000414900482 1041737523 /nfs/dbraw/zinc/73/75/23/1041737523.db2.gz DSKJKEABPHYFNM-YOEHRIQHSA-N 2 0 328.422 4.006 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H]2CCCc3c4cc(C)ccc4[nH]c32)CC1 ZINC000516992731 1041833824 /nfs/dbraw/zinc/83/38/24/1041833824.db2.gz KGNYLDVYOJJKBB-HXUWFJFHSA-N 2 0 325.500 4.175 20 0 EIADRP C[C@@H]1C[NH+](CCCC[NH2+][C@@H]2C[C@@H](c3ccccc3)C2(C)C)C[C@@H](C)O1 ZINC000464059665 1041844653 /nfs/dbraw/zinc/84/46/53/1041844653.db2.gz ZCTOVZJSENYSTE-RMVXJAJNSA-N 2 0 344.543 4.048 20 0 EIADRP C[C@@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CC1(C)CC[NH2+]CC1 ZINC000414913307 1041898920 /nfs/dbraw/zinc/89/89/20/1041898920.db2.gz WDXMSWCAQXLEMC-AWEZNQCLSA-N 2 0 328.422 4.006 20 0 EIADRP Clc1cccc([C@@H](Cc2cccnc2)[NH2+]CCC[NH+]2CCCC2)c1 ZINC000425911731 1041928860 /nfs/dbraw/zinc/92/88/60/1041928860.db2.gz BQSXLJFRWQLNNZ-HXUWFJFHSA-N 2 0 343.902 4.094 20 0 EIADRP Cc1ccc2cc([C@H](C)[NH2+]CCCC[NH+]3C[C@H](C)O[C@@H](C)C3)oc2c1 ZINC000425927137 1041952272 /nfs/dbraw/zinc/95/22/72/1041952272.db2.gz YNPULDBLPDUHKE-BZSNNMDCSA-N 2 0 344.499 4.281 20 0 EIADRP CCN1CCC[C@@H]1C[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000425936778 1041984665 /nfs/dbraw/zinc/98/46/65/1041984665.db2.gz JPVZDYSRRQHCGK-UXHICEINSA-N 2 0 343.902 4.093 20 0 EIADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+]([C@H]2CC[C@](C)(c3ccccc3)C2)C1 ZINC000438094681 1042042488 /nfs/dbraw/zinc/04/24/88/1042042488.db2.gz OBVLVGAIPKHDMW-BVSLBCMMSA-N 2 0 326.528 4.161 20 0 EIADRP Cc1ccc([C@@H]([NH2+]Cc2cccc(OCC[NH+](C)C)c2)C2CCC2)o1 ZINC000541744761 1042092340 /nfs/dbraw/zinc/09/23/40/1042092340.db2.gz MSSZGSICIVJMKG-NRFANRHFSA-N 2 0 342.483 4.159 20 0 EIADRP Fc1ccc(C[N@@H+]2CCCN(c3cc[nH+]c4ccccc43)CC2)cc1 ZINC000517639316 1042111936 /nfs/dbraw/zinc/11/19/36/1042111936.db2.gz KQDFXNDAEZSUPW-UHFFFAOYSA-N 2 0 335.426 4.086 20 0 EIADRP CC[NH+](CC)C[C@@H]1CC[N@H+](CCCOc2ccc3ccccc3c2)C1 ZINC000464772670 1042165248 /nfs/dbraw/zinc/16/52/48/1042165248.db2.gz FRPFZORGQLQCKB-IBGZPJMESA-N 2 0 340.511 4.272 20 0 EIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]Cc3cccc4cc[nH]c43)CC2)C1 ZINC000467373543 1042298304 /nfs/dbraw/zinc/29/83/04/1042298304.db2.gz NKAYFJFVANAOGS-JXFKEZNVSA-N 2 0 325.500 4.301 20 0 EIADRP Cc1cc(C)c(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1C ZINC000303149407 1042323008 /nfs/dbraw/zinc/32/30/08/1042323008.db2.gz FCWXXNPJMNTAEJ-JOCHJYFZSA-N 2 0 336.523 4.266 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C/C=C/c2ccc(OCc3ccccc3)cc2)CC[NH2+]1 ZINC000414962044 1042395100 /nfs/dbraw/zinc/39/51/00/1042395100.db2.gz ZMBHWQGZMHNHJL-CZBMUTHLSA-N 2 0 336.479 4.009 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccc(F)cn1 ZINC000491397942 1042440095 /nfs/dbraw/zinc/44/00/95/1042440095.db2.gz RNQXSLROXCGHGC-HXUWFJFHSA-N 2 0 341.474 4.448 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2cc(C)ccc2C)cc1 ZINC000518265559 1042440502 /nfs/dbraw/zinc/44/05/02/1042440502.db2.gz ZMHAPONUCGZUHO-UHFFFAOYSA-N 2 0 340.511 4.314 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCCN3)CC[N@@H+]1Cc1ccccc1 ZINC000414974615 1042461086 /nfs/dbraw/zinc/46/10/86/1042461086.db2.gz DUDJKIOKKVBLDZ-AVRDEDQJSA-N 2 0 349.522 4.187 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCCN3)CC[N@@H+]1Cc1ccccc1 ZINC000414974622 1042461769 /nfs/dbraw/zinc/46/17/69/1042461769.db2.gz DUDJKIOKKVBLDZ-GCJKJVERSA-N 2 0 349.522 4.187 20 0 EIADRP C[NH+](C)CC(C)(C)C[NH2+][C@H](c1ccc(Br)s1)C1CC1 ZINC000439148300 1042520869 /nfs/dbraw/zinc/52/08/69/1042520869.db2.gz WXMVZWIXASDAJN-AWEZNQCLSA-N 2 0 345.350 4.139 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2c(Cl)ccc3cccnc32)CC1 ZINC000518474607 1042540572 /nfs/dbraw/zinc/54/05/72/1042540572.db2.gz GBCAMHWADHUJPW-UHFFFAOYSA-N 2 0 345.918 4.442 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000414989504 1042556289 /nfs/dbraw/zinc/55/62/89/1042556289.db2.gz HFJZHOQQHBZWDY-UKRRQHHQSA-N 2 0 334.410 4.048 20 0 EIADRP C[C@@H](NC1(C[NH2+][C@H](C)c2ccccc2)CCOCC1)c1ccccc1 ZINC000173434166 1042572776 /nfs/dbraw/zinc/57/27/76/1042572776.db2.gz MIIUGACFOAMCMQ-RTBURBONSA-N 2 0 338.495 4.237 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCC[N@H+](C)Cc2ccccc2)cc1F ZINC000304618825 1042578565 /nfs/dbraw/zinc/57/85/65/1042578565.db2.gz NUUBBMIYQPFZPS-INIZCTEOSA-N 2 0 330.447 4.007 20 0 EIADRP CCCc1csc(C[NH+]2CCC(CC[N@H+](CC)CC3CC3)CC2)n1 ZINC000426407896 1042675753 /nfs/dbraw/zinc/67/57/53/1042675753.db2.gz XYEDETZWBZDOPS-UHFFFAOYSA-N 2 0 349.588 4.430 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2C[C@H]2C2CC[NH2+]CC2)cc1 ZINC000415000257 1042676904 /nfs/dbraw/zinc/67/69/04/1042676904.db2.gz AOKSGEPSJSBNAV-FNAHDJPLSA-N 2 0 342.527 4.088 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](c1ccccc1)c1ccc(C)cc1 ZINC000493075095 1042811075 /nfs/dbraw/zinc/81/10/75/1042811075.db2.gz BIOFOMOEGYKOMV-VXKWHMMOSA-N 2 0 340.511 4.031 20 0 EIADRP CCc1ccc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)s1 ZINC000309710703 1042819949 /nfs/dbraw/zinc/81/99/49/1042819949.db2.gz JESXOHUZMZRMCF-WMZOPIPTSA-N 2 0 328.525 4.483 20 0 EIADRP CCc1cccc2c(CC[NH2+]C3CC[NH+](C(C)(C)C)CC3)c[nH]c21 ZINC000178093355 1042858052 /nfs/dbraw/zinc/85/80/52/1042858052.db2.gz STJPMYCVEJMSNB-UHFFFAOYSA-N 2 0 327.516 4.125 20 0 EIADRP C[C@H]([NH2+]Cc1cccc2cccnc21)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311609395 1042862476 /nfs/dbraw/zinc/86/24/76/1042862476.db2.gz DZEDYWIJGNPCND-PGRDOPGGSA-N 2 0 345.490 4.235 20 0 EIADRP CC[C@@H]1C[C@@H](C[NH+]2CCC(CC[N@H+](CC)CC3CC3)CC2)CCO1 ZINC000507774386 1042876082 /nfs/dbraw/zinc/87/60/82/1042876082.db2.gz KAIQIBJWPBKJSN-LEWJYISDSA-N 2 0 336.564 4.026 20 0 EIADRP C[C@@H](Cc1cccc(F)c1)[NH2+]CC1CC[NH+](C2CCCCC2)CC1 ZINC001168459650 1042956930 /nfs/dbraw/zinc/95/69/30/1042956930.db2.gz NNIPQOPKPUEYRH-KRWDZBQOSA-N 2 0 332.507 4.391 20 0 EIADRP C[C@@H]1CC([NH2+]CCOc2ccccc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168005138 1042962721 /nfs/dbraw/zinc/96/27/21/1042962721.db2.gz GPFVXYLRLKNPMK-RTBURBONSA-N 2 0 338.495 4.097 20 0 EIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000493897351 1042979776 /nfs/dbraw/zinc/97/97/76/1042979776.db2.gz NOUYNRSJRKELIV-AVRDEDQJSA-N 2 0 338.495 4.148 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2scnc2C2CC2)CC1 ZINC000494984391 1043094194 /nfs/dbraw/zinc/09/41/94/1043094194.db2.gz FBWBHPOMYBSUJG-MRXNPFEDSA-N 2 0 347.572 4.497 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CCC2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000338773762 1043142055 /nfs/dbraw/zinc/14/20/55/1043142055.db2.gz FRMPCPBQLXRYSA-ZACQAIPSSA-N 2 0 341.499 4.425 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1cc2cnccc2o1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000657965808 1043221835 /nfs/dbraw/zinc/22/18/35/1043221835.db2.gz BOBQZHSXLJZENT-AOIWGVFYSA-N 2 0 349.478 4.389 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(Oc2cccnc2)cc1)C1CC[NH+](C)CC1 ZINC000672806875 1043406916 /nfs/dbraw/zinc/40/69/16/1043406916.db2.gz YYTCGYYMFVTPKK-DLBZAZTESA-N 2 0 339.483 4.255 20 0 EIADRP C[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1ccc(Oc2ccccc2)cn1 ZINC000521025735 1043498096 /nfs/dbraw/zinc/49/80/96/1043498096.db2.gz IVTPZZSCZLWDME-YRNRMSPPSA-N 2 0 325.456 4.042 20 0 EIADRP CC[C@](C)([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000730817056 1043633114 /nfs/dbraw/zinc/63/31/14/1043633114.db2.gz FNHMLNNUIXAQQT-NRFANRHFSA-N 2 0 326.484 4.042 20 0 EIADRP COc1ccc(-c2nc(C)c([C@@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)s2)cc1 ZINC000665281013 1043650242 /nfs/dbraw/zinc/65/02/42/1043650242.db2.gz RNNHGUSYWWZBJU-CXAGYDPISA-N 2 0 347.528 4.151 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccnn1-c1ccccc1 ZINC000467371190 1043768114 /nfs/dbraw/zinc/76/81/14/1043768114.db2.gz UDIJWAZCXGTAKS-IBGZPJMESA-N 2 0 340.515 4.035 20 0 EIADRP Cc1c([C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cnn1C(C)(C)C ZINC000191179021 1043793069 /nfs/dbraw/zinc/79/30/69/1043793069.db2.gz LYXOUMHVBGSFAD-KRWDZBQOSA-N 2 0 334.552 4.109 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442790827 1043841162 /nfs/dbraw/zinc/84/11/62/1043841162.db2.gz MIDAJFGJWNJWGA-SJLPKXTDSA-N 2 0 340.433 4.273 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3ccc4[nH]ccc4c3)CC2)C1 ZINC000442796128 1043843128 /nfs/dbraw/zinc/84/31/28/1043843128.db2.gz FSNUNKJFDWQNQO-UTKZUKDTSA-N 2 0 339.527 4.343 20 0 EIADRP C[C@@H]1CC([NH2+]CCCc2ccccn2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168014452 1043855021 /nfs/dbraw/zinc/85/50/21/1043855021.db2.gz LGQMTLHPYSUDFD-RTBURBONSA-N 2 0 337.511 4.045 20 0 EIADRP [NH3+]CC[C@H]1CCC[N@H+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000442920472 1043897184 /nfs/dbraw/zinc/89/71/84/1043897184.db2.gz LMARWOSPEHTYQK-CQSZACIVSA-N 2 0 334.410 4.002 20 0 EIADRP C[C@@H](CCCC(C)(C)O)[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168015050 1043963567 /nfs/dbraw/zinc/96/35/67/1043963567.db2.gz ONLONCYDDAXERZ-HUUJSLGLSA-N 2 0 346.559 4.347 20 0 EIADRP Cc1ccc(OC2CCN(CCC[NH+]3CCCCC3)CC2)cc1C ZINC000195632381 1044154085 /nfs/dbraw/zinc/15/40/85/1044154085.db2.gz CQTXWNCTOATLFN-UHFFFAOYSA-N 2 0 330.516 4.023 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCCC[C@H]1[C@@H]1CCOC1 ZINC000474043033 1044166945 /nfs/dbraw/zinc/16/69/45/1044166945.db2.gz YUZAUSYSQXRLHW-BHIFYINESA-N 2 0 344.543 4.212 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]2[C@H]2CCOC2)cc1 ZINC000474044880 1044276517 /nfs/dbraw/zinc/27/65/17/1044276517.db2.gz JKKMRXBHEUSDRM-FDFHNCONSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@@H](Cc1cccc(F)c1)[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC001168470371 1044290664 /nfs/dbraw/zinc/29/06/64/1044290664.db2.gz XURVMTAKDJHZFH-KRWDZBQOSA-N 2 0 332.507 4.391 20 0 EIADRP CC(C)CC[C@H]1CC[C@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C1 ZINC000657538347 1044382242 /nfs/dbraw/zinc/38/22/42/1044382242.db2.gz ZORLYHKDAKLIRF-ICSRJNTNSA-N 2 0 336.564 4.072 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3c2ccc(OC)c3F)c1 ZINC000675728667 1044460894 /nfs/dbraw/zinc/46/08/94/1044460894.db2.gz SRVJWOIRWZOWOG-LJQANCHMSA-N 2 0 342.458 4.063 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]CCC(C)(C)c2ccccc2)[C@H](C)C1 ZINC000675770731 1044485104 /nfs/dbraw/zinc/48/51/04/1044485104.db2.gz YLVAVAKSBPVVMV-CTNGQTDRSA-N 2 0 346.559 4.081 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@H](C)C2CC[NH+](C)CC2)ccc1OCC(C)C ZINC000675775945 1044487926 /nfs/dbraw/zinc/48/79/26/1044487926.db2.gz BQFJLCIREQJPCD-SJORKVTESA-N 2 0 348.531 4.111 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](C)Cc2ccc(Cl)cc2Cl)CC1 ZINC000675800928 1044505302 /nfs/dbraw/zinc/50/53/02/1044505302.db2.gz IEPKFZIXLPGXFK-ZDUSSCGKSA-N 2 0 329.315 4.388 20 0 EIADRP CS[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C(C)(C)C ZINC000543411860 1044551972 /nfs/dbraw/zinc/55/19/72/1044551972.db2.gz BZWRZFFEHJLASS-QXAKKESOSA-N 2 0 334.573 4.407 20 0 EIADRP CS[C@H](C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1)C(C)(C)C ZINC000543412102 1044554023 /nfs/dbraw/zinc/55/40/23/1044554023.db2.gz VQRKGHXMMJSPKU-CGTJXYLNSA-N 2 0 326.594 4.397 20 0 EIADRP C[C@@H]1CC([NH2+][C@@H]2CCc3ncccc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168024268 1044605832 /nfs/dbraw/zinc/60/58/32/1044605832.db2.gz CZYMKNIIAFRCFI-DRSNIGMVSA-N 2 0 335.495 4.100 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[NH2+]C1CC[NH+](C[C@H]2CC=CCC2)CC1 ZINC001168476304 1044629265 /nfs/dbraw/zinc/62/92/65/1044629265.db2.gz SUHQPJAXWBOSHS-MSOLQXFVSA-N 2 0 330.491 4.167 20 0 EIADRP Cc1csc(CC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)n1 ZINC000648417863 1044634165 /nfs/dbraw/zinc/63/41/65/1044634165.db2.gz IOBMGMVIHRAZGT-UHFFFAOYSA-N 2 0 337.577 4.263 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2nc3ccc(F)cc3s2)C1 ZINC000428878595 1044809253 /nfs/dbraw/zinc/80/92/53/1044809253.db2.gz AMMLCHQRAQRDSW-HUUCEWRRSA-N 2 0 349.519 4.283 20 0 EIADRP COc1cccc([C@@H](CNc2cc(C)[nH+]c3ccccc23)[NH+](C)C)c1 ZINC000327289994 1044816533 /nfs/dbraw/zinc/81/65/33/1044816533.db2.gz JPJPYZZRUBOPLJ-OAQYLSRUSA-N 2 0 335.451 4.267 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+]C[C@@H](C)C[NH+]2CCCC2)cc1 ZINC000237337797 1044917841 /nfs/dbraw/zinc/91/78/41/1044917841.db2.gz ZLGYPENPJZGJLS-GOSISDBHSA-N 2 0 338.495 4.184 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](CC2CCCC2)CC1)[C@@H]1C[C@H]1c1ccccc1 ZINC000670154305 1044934120 /nfs/dbraw/zinc/93/41/20/1044934120.db2.gz XMYIQOVGKYWCQO-WTNAPCKOSA-N 2 0 326.528 4.423 20 0 EIADRP Cc1nc2c(cccc2CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)o1 ZINC000922770303 1044940729 /nfs/dbraw/zinc/94/07/29/1044940729.db2.gz FXCLCHQDQRVAEH-UHFFFAOYSA-N 2 0 341.499 4.065 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2csc(Br)c2)CC1 ZINC000922847590 1044994879 /nfs/dbraw/zinc/99/48/79/1044994879.db2.gz AZAKXNXOGRWYOB-UHFFFAOYSA-N 2 0 343.334 4.007 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2cscc2Br)CC1 ZINC000922845210 1044998353 /nfs/dbraw/zinc/99/83/53/1044998353.db2.gz NLFTZGRBPULKSF-UHFFFAOYSA-N 2 0 343.334 4.007 20 0 EIADRP CC[NH+]1CCC([NH2+]CCCCc2cccc(C(F)(F)F)c2)CC1 ZINC000474469349 1045009968 /nfs/dbraw/zinc/00/99/68/1045009968.db2.gz MANGNFSAPRHTHM-UHFFFAOYSA-N 2 0 328.422 4.102 20 0 EIADRP COc1ccc(CC[C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1 ZINC000766006055 1045033555 /nfs/dbraw/zinc/03/35/55/1045033555.db2.gz LUKXOQLQTSMDKI-INIZCTEOSA-N 2 0 344.474 4.007 20 0 EIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+][C@@H]1CCCSCC1 ZINC000657907114 1045136082 /nfs/dbraw/zinc/13/60/82/1045136082.db2.gz GTJZGQOJIRYUSN-BWPNAZKDSA-N 2 0 332.557 4.018 20 0 EIADRP C[NH+]1CCC(N2CCC([NH2+]C3CCC4(CCCCC4)CC3)CC2)CC1 ZINC000466737562 1045155576 /nfs/dbraw/zinc/15/55/76/1045155576.db2.gz HRDMVHHBSHVVRZ-UHFFFAOYSA-N 2 0 347.591 4.028 20 0 EIADRP CCN(Cc1nc2cc(F)ccc2o1)Cc1ccc(C[NH+](C)C)cc1 ZINC000626062719 1045165173 /nfs/dbraw/zinc/16/51/73/1045165173.db2.gz CYEPXPABSJYNSZ-UHFFFAOYSA-N 2 0 341.430 4.051 20 0 EIADRP O[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2CCC3(CCCCC3)CC2)CC1 ZINC000466747146 1045180477 /nfs/dbraw/zinc/18/04/77/1045180477.db2.gz FDMUNLGCCXLHFB-LEWJYISDSA-N 2 0 348.575 4.237 20 0 EIADRP c1cc2c(cccc2C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)[nH]1 ZINC000236658754 1045363979 /nfs/dbraw/zinc/36/39/79/1045363979.db2.gz PSXUFPICWYDTHU-UHFFFAOYSA-N 2 0 333.479 4.444 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C)CC1)[C@H](C)c1ccccc1C(F)(F)F ZINC000768100581 1045712925 /nfs/dbraw/zinc/71/29/25/1045712925.db2.gz CQQNULXZPIXBIP-UONOGXRCSA-N 2 0 328.422 4.129 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1cncc(F)c1 ZINC000247057803 1045839758 /nfs/dbraw/zinc/83/97/58/1045839758.db2.gz NQYXKBRCQLZBMB-DLBZAZTESA-N 2 0 341.474 4.303 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1OC ZINC000248404235 1045872544 /nfs/dbraw/zinc/87/25/44/1045872544.db2.gz PTMGXDSAXWRJOK-JZXOWHBKSA-N 2 0 346.515 4.007 20 0 EIADRP CC[C@H]1C[C@H]([N@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170188947 1045919740 /nfs/dbraw/zinc/91/97/40/1045919740.db2.gz ABUPYMWCKAGVFT-NCYKPQTJSA-N 2 0 330.516 4.025 20 0 EIADRP CCc1noc(C)c1[C@@H](C)[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000769875464 1046101825 /nfs/dbraw/zinc/10/18/25/1046101825.db2.gz USFYGXJBNJVEAU-OAHLLOKOSA-N 2 0 329.488 4.236 20 0 EIADRP CCc1ccc(-c2nc(C[NH+]3CCC(CC[NH2+]C)CC3)cs2)cc1 ZINC000261999292 1046173501 /nfs/dbraw/zinc/17/35/01/1046173501.db2.gz PBDPKURCGJMZIP-UHFFFAOYSA-N 2 0 343.540 4.194 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccc(OC(F)F)cc2)C1 ZINC000125951159 1046385673 /nfs/dbraw/zinc/38/56/73/1046385673.db2.gz TYVSRVJZVBKSAF-GJZGRUSLSA-N 2 0 326.431 4.059 20 0 EIADRP CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@@H+](C(C)C)C2)cc1OCC ZINC000125985076 1046406612 /nfs/dbraw/zinc/40/66/12/1046406612.db2.gz VVTYGTIODRYDLR-MSOLQXFVSA-N 2 0 348.531 4.255 20 0 EIADRP CC[N@H+](CCC1CC[NH+](C[C@H]2CC2(Cl)Cl)CC1)CC1CC1 ZINC000771475333 1046409156 /nfs/dbraw/zinc/40/91/56/1046409156.db2.gz IYAUZLSOTJECTM-MRXNPFEDSA-N 2 0 333.347 4.014 20 0 EIADRP COc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CCCN(Cc2cccs2)C1 ZINC000126815521 1046563499 /nfs/dbraw/zinc/56/34/99/1046563499.db2.gz HBSGMMGTHLUOLE-SJORKVTESA-N 2 0 344.524 4.320 20 0 EIADRP COc1ccc(C2(C[NH2+]C3CCN(C4CC4)CC3)CCCCC2)cc1 ZINC000459401758 1046596711 /nfs/dbraw/zinc/59/67/11/1046596711.db2.gz XVJWGIUZEVDAKU-UHFFFAOYSA-N 2 0 342.527 4.114 20 0 EIADRP CCCOc1ccc(C[NH+]2CCC(C[N@H+](C)C(C)C)CC2)cc1OC ZINC000536652968 1046596940 /nfs/dbraw/zinc/59/69/40/1046596940.db2.gz DBIWDLKUEORTJZ-UHFFFAOYSA-N 2 0 348.531 4.036 20 0 EIADRP CCCCOc1cccc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000459400236 1046598984 /nfs/dbraw/zinc/59/89/84/1046598984.db2.gz ZUDNFOQCWMLJMR-UHFFFAOYSA-N 2 0 339.483 4.019 20 0 EIADRP c1ccc([C@@H]2CCCC[C@H]2[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459402294 1046601881 /nfs/dbraw/zinc/60/18/81/1046601881.db2.gz YZENEIHCYXUUOT-FCHUYYIVSA-N 2 0 335.495 4.366 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2ccc(OC(F)F)c(Cl)c2)[C@@H](C)C1 ZINC000536678539 1046666394 /nfs/dbraw/zinc/66/63/94/1046666394.db2.gz CASQGRBTSJJWQA-WFASDCNBSA-N 2 0 346.849 4.104 20 0 EIADRP CCOc1ccc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC000379643036 1046737471 /nfs/dbraw/zinc/73/74/71/1046737471.db2.gz ASJQLZYYGUZDMV-WIYYLYMNSA-N 2 0 338.495 4.228 20 0 EIADRP COc1cccc2c1CC[C@@H]2[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000536831051 1046822704 /nfs/dbraw/zinc/82/27/04/1046822704.db2.gz FANHDSQNQSHTSP-NGICGMGXSA-N 2 0 342.527 4.315 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCc1cccc(F)c1F ZINC000536863769 1046829381 /nfs/dbraw/zinc/82/93/81/1046829381.db2.gz MSKUJLBHWZNHIN-OXJNMPFZSA-N 2 0 344.449 4.008 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]CC(C)(C)c2c(F)cccc2Cl)[C@H](C)C1 ZINC000536875850 1046839037 /nfs/dbraw/zinc/83/90/37/1046839037.db2.gz JFKJRTMHLMEYDP-CZUORRHYSA-N 2 0 326.887 4.077 20 0 EIADRP CC(C)[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(F)cn1 ZINC000497544613 1046853515 /nfs/dbraw/zinc/85/35/15/1046853515.db2.gz FLUIQQDPYJQRHJ-NRFANRHFSA-N 2 0 341.474 4.303 20 0 EIADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000786820030 1046875493 /nfs/dbraw/zinc/87/54/93/1046875493.db2.gz MEUHQANTAXXMCO-PGRDOPGGSA-N 2 0 344.543 4.397 20 0 EIADRP COc1ccc([C@@H]([NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)C2CC2)cc1 ZINC000536946956 1046876674 /nfs/dbraw/zinc/87/66/74/1046876674.db2.gz BRUZMNDYWFAMTK-UTKZUKDTSA-N 2 0 330.516 4.248 20 0 EIADRP COc1ccc([C@H]([NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)C2CC2)cc1 ZINC000536947127 1046877776 /nfs/dbraw/zinc/87/77/76/1046877776.db2.gz KCKJLLIOMZRTIG-LAUBAEHRSA-N 2 0 330.516 4.391 20 0 EIADRP CC[C@@H]([NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21)C(C)(C)C ZINC000537197945 1047018545 /nfs/dbraw/zinc/01/85/45/1047018545.db2.gz NMYYXLDYGNPYMW-IEBWSBKVSA-N 2 0 330.516 4.389 20 0 EIADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000537303713 1047085334 /nfs/dbraw/zinc/08/53/34/1047085334.db2.gz IVOYGQAYMOPURI-CHWSQXEVSA-N 2 0 343.298 4.001 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](c2ccc(F)cn2)C(C)C)c1 ZINC000497816902 1047098411 /nfs/dbraw/zinc/09/84/11/1047098411.db2.gz KHKGCHQRZDNNSE-HXUWFJFHSA-N 2 0 329.463 4.159 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000497839060 1047114685 /nfs/dbraw/zinc/11/46/85/1047114685.db2.gz FTLPMRFFWXGHGJ-DYESRHJHSA-N 2 0 330.491 4.472 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+][C@@H]2COCc3cccc(Cl)c32)C1 ZINC000788524999 1047199893 /nfs/dbraw/zinc/19/98/93/1047199893.db2.gz ADTAJWLIMVPGOI-MAUKXSAKSA-N 2 0 336.907 4.013 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@H]2COCc3cccc(Cl)c32)C1 ZINC000788525000 1047201104 /nfs/dbraw/zinc/20/11/04/1047201104.db2.gz ADTAJWLIMVPGOI-QAPCUYQASA-N 2 0 336.907 4.013 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1cc[nH]c(=O)c1 ZINC000788525002 1047202203 /nfs/dbraw/zinc/20/22/03/1047202203.db2.gz AEIGLMZUEHZTQM-DLBZAZTESA-N 2 0 339.483 4.012 20 0 EIADRP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2[NH2+]C1CCN(C2CC2)CC1 ZINC000129673085 1047464177 /nfs/dbraw/zinc/46/41/77/1047464177.db2.gz IKEUWDKRLOZQHB-FQEVSTJZSA-N 2 0 340.511 4.430 20 0 EIADRP C[C@@H]1CC[C@H]([NH+]2CCC([NH3+])(Cc3cccc(C(F)(F)F)c3)CC2)C1 ZINC001170121899 1047485966 /nfs/dbraw/zinc/48/59/66/1047485966.db2.gz ORXZUXAISJCOQH-PBHICJAKSA-N 2 0 340.433 4.230 20 0 EIADRP CC[NH+](CC)CCC[NH2+]C1CC(c2cccc(Br)c2)C1 ZINC000036842390 1047486363 /nfs/dbraw/zinc/48/63/63/1047486363.db2.gz MSDIXUXDEQYHNX-UHFFFAOYSA-N 2 0 339.321 4.017 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]C[C@H]3CCc4ccccc43)CC2)CC1 ZINC000790051567 1047509720 /nfs/dbraw/zinc/50/97/20/1047509720.db2.gz AQPHMPJSVVUGTN-QNGMFEMESA-N 2 0 326.528 4.349 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@@H]3C[C@H]3c3ccccc3)CC2)C1 ZINC000556240198 1047605546 /nfs/dbraw/zinc/60/55/46/1047605546.db2.gz HEPGOVRULGYWMY-YKWDRNOUSA-N 2 0 326.528 4.423 20 0 EIADRP CC(C)C[C@@H](CCO)C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000556261902 1047633896 /nfs/dbraw/zinc/63/38/96/1047633896.db2.gz OWMBPSSFUJPHOU-ITAUSPCMSA-N 2 0 346.559 4.064 20 0 EIADRP C[NH+](C)C1CCC([NH2+]C(C)(C)c2ccc(Br)cc2)CC1 ZINC001168294984 1047664574 /nfs/dbraw/zinc/66/45/74/1047664574.db2.gz MEIQHMASOITEPF-UHFFFAOYSA-N 2 0 339.321 4.147 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)cc1F ZINC000130297816 1047673935 /nfs/dbraw/zinc/67/39/35/1047673935.db2.gz RTZOLMFAXMUAAP-LSDHHAIUSA-N 2 0 332.385 4.098 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2ccc(Cl)cc2C(F)(F)F)CC1 ZINC001168298504 1047675575 /nfs/dbraw/zinc/67/55/75/1047675575.db2.gz XTYYGAHUYUOYFQ-UHFFFAOYSA-N 2 0 334.813 4.321 20 0 EIADRP CC[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1cccc(Br)c1 ZINC000130626607 1047755318 /nfs/dbraw/zinc/75/53/18/1047755318.db2.gz XOMIKMMODPLXSS-QGZVFWFLSA-N 2 0 339.321 4.222 20 0 EIADRP C[N@H+](CCCN[C@@H]1CC[NH+](C)[C@@H](c2ccccc2)C1)C1CCCCC1 ZINC000550608677 1047758246 /nfs/dbraw/zinc/75/82/46/1047758246.db2.gz LGJMVKAZCANWIW-IFMALSPDSA-N 2 0 343.559 4.066 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H](c2ncccc2C(F)(F)F)C2CC2)CC1 ZINC001168305268 1047762474 /nfs/dbraw/zinc/76/24/74/1047762474.db2.gz GIXQQRGURZYNHS-XUJLQICISA-N 2 0 341.421 4.014 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H](c2ccnc(C(F)(F)F)c2)C2CC2)CC1 ZINC001168305290 1047763678 /nfs/dbraw/zinc/76/36/78/1047763678.db2.gz HAOPHIBOWNMASH-VMBOVVBDSA-N 2 0 341.421 4.014 20 0 EIADRP C[NH+](C)C1CCC([NH2+]C(C)(C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001168305852 1047779726 /nfs/dbraw/zinc/77/97/26/1047779726.db2.gz OOUOXXWLLGLKEU-UHFFFAOYSA-N 2 0 342.449 4.489 20 0 EIADRP C[NH+](C)C1CCC([N@H+](CC2CCCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001168306115 1047781620 /nfs/dbraw/zinc/78/16/20/1047781620.db2.gz QPIVCNMKMQAPON-NEBFTCOFSA-N 3 0 335.580 4.011 20 0 EIADRP CC(C)[C@H](NCC[C@@H](C)[N@H+](C)Cc1ccccc1)c1ccc(F)cn1 ZINC000498939042 1047992771 /nfs/dbraw/zinc/99/27/71/1047992771.db2.gz FDXHNMPIJDWPHW-UTKZUKDTSA-N 2 0 343.490 4.418 20 0 EIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)[C@@H](C)c1ccccc1C(F)(F)F ZINC000824988015 1048016820 /nfs/dbraw/zinc/01/68/20/1048016820.db2.gz GAFOGGJIRFEOCB-YZDRTPDPSA-N 2 0 340.433 4.412 20 0 EIADRP C[NH+]1CCC2(CC[N@H+](Cc3ccc(C(F)(F)F)c(Cl)c3)C2)CC1 ZINC001143809993 1048222342 /nfs/dbraw/zinc/22/23/42/1048222342.db2.gz JRBXXXZPSIGXNH-UHFFFAOYSA-N 2 0 346.824 4.277 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1Cl)c1cccc(OCC[NH+](C)C)c1 ZINC000132427038 1048292922 /nfs/dbraw/zinc/29/29/22/1048292922.db2.gz QNQIBMJNFATACZ-OAHLLOKOSA-N 2 0 332.875 4.131 20 0 EIADRP FC(F)Sc1ccc(C[NH2+]CCCCC[NH+]2CCCC2)cc1 ZINC000815151029 1048369509 /nfs/dbraw/zinc/36/95/09/1048369509.db2.gz JHTVQJZPDRFGEK-UHFFFAOYSA-N 2 0 328.472 4.357 20 0 EIADRP c1cc2c(s1)C[NH+](CCCC[N@@H+]1CCc3ccsc3C1)CC2 ZINC000132689998 1048439246 /nfs/dbraw/zinc/43/92/46/1048439246.db2.gz RDUBWCKPHMXHLO-UHFFFAOYSA-N 2 0 332.538 4.006 20 0 EIADRP C[NH+](C)[C@H]1CC[C@H]([NH2+][C@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171148947 1048493431 /nfs/dbraw/zinc/49/34/31/1048493431.db2.gz SZLKRACOFTVNKC-JYJNAYRXSA-N 2 0 341.326 4.313 20 0 EIADRP Cc1ccc(-c2n[nH]cc2C[N@@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000809739109 1048511019 /nfs/dbraw/zinc/51/10/19/1048511019.db2.gz XQSIOQZIBHJHRW-UHFFFAOYSA-N 2 0 348.494 4.079 20 0 EIADRP Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000815574887 1048538284 /nfs/dbraw/zinc/53/82/84/1048538284.db2.gz GCAOCGSDXIXNCY-QGZVFWFLSA-N 2 0 344.474 4.315 20 0 EIADRP CCCCCC[C@@H](CC)[NH2+]CC1CC[NH+](CC2CCOCC2)CC1 ZINC001170589709 1048564661 /nfs/dbraw/zinc/56/46/61/1048564661.db2.gz ZLIAVQZMXXIGEX-OAQYLSRUSA-N 2 0 338.580 4.464 20 0 EIADRP Cc1c([C@@H](C)[NH2+]CCCCC[NH+]2CCCC2)cnn1-c1ccccc1 ZINC000815647346 1048569824 /nfs/dbraw/zinc/56/98/24/1048569824.db2.gz HPGOJGHEMCZDLT-GOSISDBHSA-N 2 0 340.515 4.097 20 0 EIADRP CC1(C)Cc2cccc(CNC3CC[NH+](C4CCCCC4)CC3)c2O1 ZINC000236698675 1048834064 /nfs/dbraw/zinc/83/40/64/1048834064.db2.gz UCFIFLWAVWDWBZ-UHFFFAOYSA-N 2 0 342.527 4.287 20 0 EIADRP C[C@@H]1C[C@@H]1c1ccc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)o1 ZINC000237368409 1048931865 /nfs/dbraw/zinc/93/18/65/1048931865.db2.gz WSDCITNNYSFAOU-BEFAXECRSA-N 2 0 344.524 4.466 20 0 EIADRP [NH3+]CCc1ccc(C[NH2+][C@H]2CCc3cc(Cl)cc(Cl)c32)cc1 ZINC000817948440 1049063233 /nfs/dbraw/zinc/06/32/33/1049063233.db2.gz KBMZMKDZXJMQMA-KRWDZBQOSA-N 2 0 335.278 4.272 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)[C@H](C)c1nc2ccccc2s1 ZINC000817949546 1049064702 /nfs/dbraw/zinc/06/47/02/1049064702.db2.gz RAWABMYBUQWWNN-LSDHHAIUSA-N 2 0 339.508 4.079 20 0 EIADRP CC(C)c1ccc(C2(O)CCC([NH2+][C@H](C)CCCC[NH3+])CC2)cc1 ZINC000817976210 1049074524 /nfs/dbraw/zinc/07/45/24/1049074524.db2.gz IDNQTJFIVJJQKP-MDMXATFFSA-N 2 0 332.532 4.047 20 0 EIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cnn(-c2ccccc2)c1 ZINC000817982285 1049077000 /nfs/dbraw/zinc/07/70/00/1049077000.db2.gz QWRZERFNXDURNX-LAUBAEHRSA-N 2 0 334.467 4.003 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000817981660 1049077312 /nfs/dbraw/zinc/07/73/12/1049077312.db2.gz MHHRQTKWSKLLQJ-FFSVYQOJSA-N 2 0 326.456 4.096 20 0 EIADRP CC(C)c1ccc(C2(O)CCC([NH2+]CCC[C@@H]3CCC[NH2+]3)CC2)cc1 ZINC000817982189 1049078637 /nfs/dbraw/zinc/07/86/37/1049078637.db2.gz ZLTYWSVMQSRPCB-HWELCPFYSA-N 2 0 344.543 4.062 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@@H]2CCc3cccc(Cl)c3C2)CC1(C)C ZINC001170908929 1049174161 /nfs/dbraw/zinc/17/41/61/1049174161.db2.gz RANFQHXZUSOCBB-OAHLLOKOSA-N 2 0 334.935 4.438 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1ccc2c(c1)CCO2 ZINC000773101504 1049583574 /nfs/dbraw/zinc/58/35/74/1049583574.db2.gz YYAKJZKQOAELAC-RPCJCACASA-N 2 0 342.527 4.315 20 0 EIADRP Fc1cccc2c1CC[C@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)C2 ZINC001171394389 1049611731 /nfs/dbraw/zinc/61/17/31/1049611731.db2.gz SGTHFJZBFOYJEG-FQEVSTJZSA-N 2 0 338.470 4.069 20 0 EIADRP FC1(F)CCC([NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)CC1 ZINC000716716087 1049703082 /nfs/dbraw/zinc/70/30/82/1049703082.db2.gz ZNVYCAGQONXAJS-UHOSZYNNSA-N 2 0 334.454 4.207 20 0 EIADRP CN1CCC([N@H+](C2CCCC2)[C@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171500528 1049737495 /nfs/dbraw/zinc/73/74/95/1049737495.db2.gz QXTFAFZHSANXCG-IBGZPJMESA-N 2 0 348.481 4.161 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]C2(Cc3ccccc3)CCOCC2)CC1(C)C ZINC001171630354 1049762615 /nfs/dbraw/zinc/76/26/15/1049762615.db2.gz NTSRTXXDSDLAFE-UHFFFAOYSA-N 2 0 344.543 4.019 20 0 EIADRP Cc1cc(C)cc(OC[C@@H](C)[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)c1 ZINC001171614503 1049765626 /nfs/dbraw/zinc/76/56/26/1049765626.db2.gz ZJPUOSZBHMSBJL-QGZVFWFLSA-N 2 0 332.532 4.312 20 0 EIADRP C[NH+]1C(C)(C)CC(NC(=[NH2+])C23CC4CC(CC(C4)C2)C3)CC1(C)C ZINC001171618725 1049766214 /nfs/dbraw/zinc/76/62/14/1049766214.db2.gz AXENAGKNZQFXGQ-UHFFFAOYSA-N 2 0 331.548 4.421 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CCSCc2ccc(F)cc2)CC1(C)C ZINC001171620198 1049766445 /nfs/dbraw/zinc/76/64/45/1049766445.db2.gz YSHJQFLUVXTEKU-UHFFFAOYSA-N 2 0 338.536 4.300 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706776 1049776527 /nfs/dbraw/zinc/77/65/27/1049776527.db2.gz MACDXJRERGAPMZ-OTWHNJEPSA-N 2 0 348.481 4.161 20 0 EIADRP C[NH+]1C(C)(C)CC([N@@H+]2CCC[C@H](Sc3ccncc3)C2)CC1(C)C ZINC001171639985 1049779438 /nfs/dbraw/zinc/77/94/38/1049779438.db2.gz XPQDKCGZUGCJEG-SFHVURJKSA-N 2 0 347.572 4.290 20 0 EIADRP Cc1cccc2c(CC[NH3+])cn([C@H]3C[C@@H](C)[N@@H+](Cc4ccccc4)C3)c21 ZINC001171726355 1049784728 /nfs/dbraw/zinc/78/47/28/1049784728.db2.gz VERMBNJPXMICEV-NQIIRXRSSA-N 2 0 347.506 4.286 20 0 EIADRP Cc1c(CC[NH3+])c2ccccc2n1[C@H]1C[C@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171727251 1049785247 /nfs/dbraw/zinc/78/52/47/1049785247.db2.gz TXZBBCIPFWARSQ-PXNSSMCTSA-N 2 0 347.506 4.286 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)[C@@H]2Cc3cccc(F)c3C2)CC1 ZINC001171786969 1049804959 /nfs/dbraw/zinc/80/49/59/1049804959.db2.gz FVDKOJJFZNUHSV-GUDVDZBRSA-N 2 0 330.491 4.055 20 0 EIADRP CC1(C)C[C@H]([NH2+]CCc2ccc(F)cc2)CC[N@@H+]1Cc1ccccc1 ZINC001171963646 1049825382 /nfs/dbraw/zinc/82/53/82/1049825382.db2.gz IJYCXRWNFDAMGM-OAQYLSRUSA-N 2 0 340.486 4.401 20 0 EIADRP C[C@]1(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCS1 ZINC000245686799 1049826314 /nfs/dbraw/zinc/82/63/14/1049826314.db2.gz JQRNVYDRXVKTCH-YSTOQKLRSA-N 2 0 330.541 4.057 20 0 EIADRP CC(C)([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1cccnc1 ZINC001171965724 1049826410 /nfs/dbraw/zinc/82/64/10/1049826410.db2.gz QSTXATSDXWUEGV-FQEVSTJZSA-N 2 0 337.511 4.350 20 0 EIADRP CC1(C)C[C@H]([NH2+]C[C@@H]2CCC(F)(F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171967078 1049827974 /nfs/dbraw/zinc/82/79/74/1049827974.db2.gz XFXZRKVNDUCNNF-QZTJIDSGSA-N 2 0 336.470 4.455 20 0 EIADRP CCCC[C@@H](COC)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000813881963 1049830251 /nfs/dbraw/zinc/83/02/51/1049830251.db2.gz YEELAEXDSUOMAY-MJLAPFRSSA-N 2 0 344.543 4.367 20 0 EIADRP CCOC(=O)C1(C)CCC([NH2+]CC[PH+](C(C)C)C(C)C)CC1 ZINC001171945761 1049832136 /nfs/dbraw/zinc/83/21/36/1049832136.db2.gz JSZIOPMTWGYXIU-UHFFFAOYSA-N 2 0 329.465 4.387 20 0 EIADRP CC1(C)C[C@H](Nc2cccc(CC[NH3+])c2)CC[N@@H+]1Cc1ccccc1 ZINC001171979059 1049838316 /nfs/dbraw/zinc/83/83/16/1049838316.db2.gz KVTTVQUTANDYLM-OAQYLSRUSA-N 2 0 337.511 4.043 20 0 EIADRP CSC1CC[NH+]([C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171986338 1049840866 /nfs/dbraw/zinc/84/08/66/1049840866.db2.gz HOBXSHMDMWGVOT-GOSISDBHSA-N 2 0 332.557 4.257 20 0 EIADRP C[N@H+](CC1CC(F)(F)C1)[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171987772 1049841157 /nfs/dbraw/zinc/84/11/57/1049841157.db2.gz JFVCWVYGWHUOAL-SFHVURJKSA-N 2 0 336.470 4.407 20 0 EIADRP CCCO[C@H]1CC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172076489 1049844568 /nfs/dbraw/zinc/84/45/68/1049844568.db2.gz ZOQFPJVFVLRDEC-LRSLUSHPSA-N 2 0 342.527 4.073 20 0 EIADRP CSC1CC[NH+]([C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172076139 1049844749 /nfs/dbraw/zinc/84/47/49/1049844749.db2.gz VOLVMSGAWZSJFY-PMOLBWCYSA-N 2 0 344.568 4.400 20 0 EIADRP C[NH2+]Cc1cccc(N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172084277 1049847075 /nfs/dbraw/zinc/84/70/75/1049847075.db2.gz VRQWAMNNQVPIOP-WBDAEOGXSA-N 2 0 349.522 4.404 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@H](N2CCc4cccnc4C2)C3)cc1 ZINC001172081923 1049847781 /nfs/dbraw/zinc/84/77/81/1049847781.db2.gz IGKDWSOKAXALES-KOUNCHBCSA-N 2 0 347.506 4.025 20 0 EIADRP Cc1ccccc1[C@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccncc1 ZINC001172099944 1049849859 /nfs/dbraw/zinc/84/98/59/1049849859.db2.gz NVKSIITYDMAWCP-XAPVIXHLSA-N 2 0 335.495 4.084 20 0 EIADRP FC1(F)CC[C@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172068232 1049851247 /nfs/dbraw/zinc/85/12/47/1049851247.db2.gz PSESVDKMJHPNCN-CADBVGFASA-N 2 0 334.454 4.350 20 0 EIADRP C[C@H]1C[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)CCc2ccc(Cl)cc21 ZINC001172128822 1049854487 /nfs/dbraw/zinc/85/44/87/1049854487.db2.gz UPYDPKISJSDRLK-FZDIXFNVSA-N 2 0 332.919 4.317 20 0 EIADRP C[C@H]1C[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3C)CCc2ccc(Cl)cc21 ZINC001172128825 1049854726 /nfs/dbraw/zinc/85/47/26/1049854726.db2.gz UPYDPKISJSDRLK-WQANXHIZSA-N 2 0 332.919 4.317 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Br)s1 ZINC001172103746 1049856887 /nfs/dbraw/zinc/85/68/87/1049856887.db2.gz XDUHJBGCTDZDSX-RVMXOQNASA-N 2 0 343.334 4.177 20 0 EIADRP C[N@H+](Cc1ccc(Cl)c(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172118215 1049858865 /nfs/dbraw/zinc/85/88/65/1049858865.db2.gz OJLDNISDHUYWKT-QDMKHBRRSA-N 2 0 327.299 4.441 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CC1(Cc3cccc(Cl)c3)CC1)C2 ZINC001172112634 1049858945 /nfs/dbraw/zinc/85/89/45/1049858945.db2.gz YBXIYMCRKMEVIQ-REPLKXPHSA-N 2 0 332.919 4.268 20 0 EIADRP C[N@H+](Cc1ccccc1C(F)(F)F)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172124218 1049860261 /nfs/dbraw/zinc/86/02/61/1049860261.db2.gz JNXPDKIXEMJQLE-MUJYYYPQSA-N 2 0 326.406 4.153 20 0 EIADRP c1ccc2c(c1)C[C@@H]([NH2+]C1CC[NH+](C[C@H]3CC=CCC3)CC1)CS2 ZINC001172194593 1049868911 /nfs/dbraw/zinc/86/89/11/1049868911.db2.gz VMPIFZKLXLKWKE-FXAWDEMLSA-N 2 0 342.552 4.114 20 0 EIADRP C[NH+](C)C1CCN(c2ccc(N[C@H]3CCCC34CCC4)cc2)CC1 ZINC000824066216 1049897554 /nfs/dbraw/zinc/89/75/54/1049897554.db2.gz PWZKXVNPUQUFKN-FQEVSTJZSA-N 2 0 327.516 4.352 20 0 EIADRP COc1cc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)ccc1F ZINC000152664324 1049906353 /nfs/dbraw/zinc/90/63/53/1049906353.db2.gz HKUZRWFLFUWKED-INIZCTEOSA-N 2 0 342.458 4.281 20 0 EIADRP CC(C)OCC[C@H](C)[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001172459670 1049916832 /nfs/dbraw/zinc/91/68/32/1049916832.db2.gz KPSHRPILUNLAIX-ILWGZMRPSA-N 2 0 344.543 4.034 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccncc2)[C@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172555413 1049931404 /nfs/dbraw/zinc/93/14/04/1049931404.db2.gz ICGRZNQMERYDGF-ODAXIHTASA-N 2 0 349.522 4.490 20 0 EIADRP Clc1ccc2c(c1)C[C@H]([NH2+]CC1CC[NH+](C3CCCCC3)CC1)C2 ZINC001172709644 1049971468 /nfs/dbraw/zinc/97/14/68/1049971468.db2.gz CVGVVBJMTGKYDR-HXUWFJFHSA-N 2 0 346.946 4.442 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2ccc(Br)s2)C1 ZINC000246902214 1050005115 /nfs/dbraw/zinc/00/51/15/1050005115.db2.gz FLKUXUWKOIVNGJ-OLZOCXBDSA-N 2 0 345.350 4.282 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2ccc(-c3ccccc3OC)cc2)C1 ZINC000246902595 1050005223 /nfs/dbraw/zinc/00/52/23/1050005223.db2.gz FWKAEEXJTUXSQM-QZTJIDSGSA-N 2 0 338.495 4.355 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2ccc(CC)s2)[C@H](C)C1 ZINC000248174435 1050045519 /nfs/dbraw/zinc/04/55/19/1050045519.db2.gz VJBVKJMUFCTYPB-RYRKJORJSA-N 2 0 338.561 4.098 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000248397946 1050053865 /nfs/dbraw/zinc/05/38/65/1050053865.db2.gz ILTAOIGWUOPEKF-SCTDSRPQSA-N 2 0 330.516 4.389 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1cc(Br)cs1 ZINC000248656486 1050071463 /nfs/dbraw/zinc/07/14/63/1050071463.db2.gz DETRVVSPYMJRFH-CYZMBNFOSA-N 2 0 331.323 4.034 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]C[C@@H](C)c2ccc(C(F)(F)F)cc2)[C@@H](C)C1 ZINC000249137877 1050093778 /nfs/dbraw/zinc/09/37/78/1050093778.db2.gz XENCLJLFTDPAAX-KEYYUXOJSA-N 2 0 328.422 4.129 20 0 EIADRP Clc1cc2c(c(Cl)c1)CC[C@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000089695997 1050128764 /nfs/dbraw/zinc/12/87/64/1050128764.db2.gz PRPLALUPGOEJQE-APPDUMDISA-N 2 0 325.283 4.055 20 0 EIADRP COc1ccsc1C[NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC001177180651 1050164532 /nfs/dbraw/zinc/16/45/32/1050164532.db2.gz CNQJOGYRQYUQDZ-UHFFFAOYSA-N 2 0 344.524 4.278 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([N@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828152 1050165599 /nfs/dbraw/zinc/16/55/99/1050165599.db2.gz IPRRGCNJDTXLJH-BVSLBCMMSA-N 2 0 326.528 4.367 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)CC2 ZINC001172832722 1050168760 /nfs/dbraw/zinc/16/87/60/1050168760.db2.gz UJLQRSBNSYQHPL-QFIPXVFZSA-N 2 0 326.528 4.097 20 0 EIADRP CCC1(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)CCOCC1 ZINC001177257640 1050175102 /nfs/dbraw/zinc/17/51/02/1050175102.db2.gz XRVARCNPUAFOJQ-LJQANCHMSA-N 2 0 344.543 4.215 20 0 EIADRP COc1ccc(C[NH2+]CCC[NH+]2C[C@@H](C)C[C@H](C)C2)c2ccccc12 ZINC001177293861 1050177060 /nfs/dbraw/zinc/17/70/60/1050177060.db2.gz AHEPMIMUVXBDGW-ROUUACIJSA-N 2 0 340.511 4.306 20 0 EIADRP CC(C)c1nc(C[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)c2ccccn21 ZINC001177299492 1050180829 /nfs/dbraw/zinc/18/08/29/1050180829.db2.gz SIKJLBATCCSDFS-GOSISDBHSA-N 2 0 342.531 4.202 20 0 EIADRP COC1(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)CCCCC1 ZINC001177266113 1050183010 /nfs/dbraw/zinc/18/30/10/1050183010.db2.gz AMYDVPCMXGDVAZ-LJQANCHMSA-N 2 0 344.543 4.500 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC001172851130 1050189849 /nfs/dbraw/zinc/18/98/49/1050189849.db2.gz FRFGEJQCBOIHDS-CQSZACIVSA-N 2 0 347.865 4.064 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[NH2+]C[C@@H](C)CC(C)(C)CC[NH3+] ZINC001172852853 1050190281 /nfs/dbraw/zinc/19/02/81/1050190281.db2.gz VRSSJZAIHYVBHR-UONOGXRCSA-N 2 0 328.903 4.401 20 0 EIADRP C[C@@H]([NH2+][C@H](C)c1cccc(F)c1F)c1cccc(OCC[NH+](C)C)c1 ZINC000090963517 1050218881 /nfs/dbraw/zinc/21/88/81/1050218881.db2.gz FWBAEKGTXQLKPT-HUUCEWRRSA-N 2 0 348.437 4.317 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)CS1 ZINC001177529961 1050242117 /nfs/dbraw/zinc/24/21/17/1050242117.db2.gz WNSAWGXLMXIYMB-YLJYHZDGSA-N 2 0 332.557 4.436 20 0 EIADRP CC(C)CC[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)C1 ZINC001177529925 1050243229 /nfs/dbraw/zinc/24/32/29/1050243229.db2.gz UXAMUHPDTZYRCW-UYAOXDASSA-N 2 0 332.532 4.322 20 0 EIADRP Cc1cccc(CC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)n1 ZINC000449294507 1050269926 /nfs/dbraw/zinc/26/99/26/1050269926.db2.gz LVTOVSVRKYNYLO-UHFFFAOYSA-N 2 0 331.548 4.201 20 0 EIADRP CCCOC1CCC([N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)CC1 ZINC001173100360 1050302653 /nfs/dbraw/zinc/30/26/53/1050302653.db2.gz ILAYRMMZKLMZLD-ITAUSPCMSA-N 2 0 344.543 4.178 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](c2ccccc2)C2CCOCC2)CC1 ZINC001173104656 1050305570 /nfs/dbraw/zinc/30/55/70/1050305570.db2.gz TYGLHUBWCDRCKP-HRTMPFAESA-N 2 0 344.543 4.397 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccsc2Br)CC1 ZINC001173103249 1050305853 /nfs/dbraw/zinc/30/58/53/1050305853.db2.gz GQBDWMNCVDSDOR-UHFFFAOYSA-N 2 0 345.350 4.253 20 0 EIADRP CC[NH+](CC)C1CCC([N@H+](C2CCCC2)[C@H]2CC[C@H]([NH3+])CC2)CC1 ZINC001173110347 1050307728 /nfs/dbraw/zinc/30/77/28/1050307728.db2.gz MNDVASVSPMYJMN-PPFQCUIHSA-N 3 0 335.580 4.154 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H]2CCCc3ccc(OC)cc32)CC1 ZINC001173109852 1050307916 /nfs/dbraw/zinc/30/79/16/1050307916.db2.gz IYEIWZZAJAACTA-WIXQSORDSA-N 2 0 330.516 4.315 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H]2CCOc3ccc(Cl)cc32)CC1 ZINC001173108554 1050308009 /nfs/dbraw/zinc/30/80/09/1050308009.db2.gz MUSNMFHDRNPSCI-LEOMRAHMSA-N 2 0 336.907 4.406 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H]2CCOc3c(F)cc(F)cc32)CC1 ZINC001173110435 1050309056 /nfs/dbraw/zinc/30/90/56/1050309056.db2.gz ORHWVHNXJBIOCP-JMLCCBQJSA-N 2 0 338.442 4.031 20 0 EIADRP CC[NH+](CC)C1CCC([N@H+](C)[C@H](C)Cc2ccccc2OC)CC1 ZINC001173113312 1050309115 /nfs/dbraw/zinc/30/91/15/1050309115.db2.gz MZBUNHBKDJKSFE-QHGAOEGBSA-N 2 0 332.532 4.211 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CC2(Cc3cccc(F)c3)CC2)CC1 ZINC001173110610 1050309314 /nfs/dbraw/zinc/30/93/14/1050309314.db2.gz PQTPPURPEPIRPV-UHFFFAOYSA-N 2 0 332.507 4.391 20 0 EIADRP CC[NH+](CC)C1CCC([N@H+]2C[C@H]3[C@@H](C2)CCC[C@H]3OCC2CC2)CC1 ZINC001173111104 1050310343 /nfs/dbraw/zinc/31/03/43/1050310343.db2.gz RWAPSHAYTFIOMK-VQSBLYBRSA-N 2 0 348.575 4.167 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@H](Oc3ccccc3C)C2)CC1 ZINC001173112197 1050310612 /nfs/dbraw/zinc/31/06/12/1050310612.db2.gz SMSVAQANODZVDG-CBNMVNINSA-N 2 0 344.543 4.491 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCO[C@@](C)(c3ccc(F)cc3)C2)CC1 ZINC001173112575 1050310800 /nfs/dbraw/zinc/31/08/00/1050310800.db2.gz CBYVICPSVABWCZ-XVAXZDLZSA-N 2 0 348.506 4.026 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@@H](C)CC2CCCCC2)[C@@H](C)C1 ZINC001177843948 1050312467 /nfs/dbraw/zinc/31/24/67/1050312467.db2.gz ICRPCABPNQPXQC-ZJOUEHCJSA-N 2 0 338.580 4.320 20 0 EIADRP CC(C)(CCCc1ccccc1)C[NH2+]Cc1ccnn1-c1cc[nH+]cc1 ZINC001177885473 1050320110 /nfs/dbraw/zinc/32/01/10/1050320110.db2.gz QRQGFZLKWPTXFP-UHFFFAOYSA-N 2 0 348.494 4.406 20 0 EIADRP c1ccc(OC2CCC([NH2+]CC3CC[NH+](C4CCC4)CC3)CC2)cc1 ZINC001173197220 1050341798 /nfs/dbraw/zinc/34/17/98/1050341798.db2.gz ASPQBOCNUWVWMI-UHFFFAOYSA-N 2 0 342.527 4.231 20 0 EIADRP CCc1ccc(C[C@H](C)[NH+]2CCC([NH3+])(c3ccc(F)cc3)CC2)cc1 ZINC001173249142 1050375254 /nfs/dbraw/zinc/37/52/54/1050375254.db2.gz JWHAQEFSXRWDFZ-KRWDZBQOSA-N 2 0 340.486 4.269 20 0 EIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+]CC2(CCC)CCC2)CC1 ZINC001178180703 1050397459 /nfs/dbraw/zinc/39/74/59/1050397459.db2.gz FYAVEIOUFKOKQO-UHFFFAOYSA-N 2 0 343.559 4.279 20 0 EIADRP CC[C@@H]1CC[C@H]([N@@H+]2C[C@@H]3CCC[C@H](N(C)Cc4ccccn4)[C@H]3C2)C1 ZINC001173276630 1050405664 /nfs/dbraw/zinc/40/56/64/1050405664.db2.gz CLORNAMJBCZDRP-NQOGSSOHSA-N 2 0 341.543 4.193 20 0 EIADRP CC[C@@H]1CC[C@@H]([NH+]2CCC3(CC([N@H+](C)Cc4ccncc4)C3)CC2)C1 ZINC001173278998 1050408026 /nfs/dbraw/zinc/40/80/26/1050408026.db2.gz NVMAZKALAOKVRT-UYAOXDASSA-N 2 0 341.543 4.337 20 0 EIADRP CC[NH+](CC)CCCN1CC[NH+]([C@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173344064 1050432281 /nfs/dbraw/zinc/43/22/81/1050432281.db2.gz QFFSWLVDXYTLRD-NRFANRHFSA-N 2 0 349.607 4.229 20 0 EIADRP C[C@H]([NH2+]Cc1cccc2ccoc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001178330267 1050436386 /nfs/dbraw/zinc/43/63/86/1050436386.db2.gz ALMSVPXXIXCOGO-UWJYYQICSA-N 2 0 334.463 4.433 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2Cc3cc(F)c(F)cc3C2)C2CCCCC2)CC1 ZINC001173475336 1050458293 /nfs/dbraw/zinc/45/82/93/1050458293.db2.gz CMVJXULZRDRUEO-SAABIXHNSA-N 2 0 348.481 4.337 20 0 EIADRP CC1CCC(C)(C[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)CC1 ZINC001178629842 1050519933 /nfs/dbraw/zinc/51/99/33/1050519933.db2.gz UVQPKWYEMFDGDF-UHFFFAOYSA-N 2 0 344.543 4.467 20 0 EIADRP c1ccc2c(c1)CCC21CCC([NH2+]C2CC[NH+](C3CCC3)CC2)CC1 ZINC001173689639 1050544269 /nfs/dbraw/zinc/54/42/69/1050544269.db2.gz RTOXJWDWMNBIEX-UHFFFAOYSA-N 2 0 338.539 4.420 20 0 EIADRP COCc1c(C)cc(C)c(C[NH2+]CCCCC[NH+]2CCCC2)c1C ZINC001178811908 1050560089 /nfs/dbraw/zinc/56/00/89/1050560089.db2.gz ZXQOKWNRYYABES-UHFFFAOYSA-N 2 0 332.532 4.114 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@H](C)c2cccnc2)ccc1OC ZINC000182226503 1050564280 /nfs/dbraw/zinc/56/42/80/1050564280.db2.gz OKJCBFHDFAZUBY-DLBZAZTESA-N 2 0 341.499 4.344 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)[C@@H]1CCC[C@H](C)C1 ZINC001178962039 1050599377 /nfs/dbraw/zinc/59/93/77/1050599377.db2.gz ATJNVBXWFARBJJ-IRFCIJBXSA-N 2 0 344.543 4.466 20 0 EIADRP CC1(C)CCC[C@H](C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C1 ZINC001179094879 1050632756 /nfs/dbraw/zinc/63/27/56/1050632756.db2.gz DIQFPJOPMADHCA-FQEVSTJZSA-N 2 0 329.532 4.100 20 0 EIADRP COc1cc(C[NH2+]CCC2CC[NH+](C(C)C)CC2)ccc1OC(C)C ZINC001179277988 1050668657 /nfs/dbraw/zinc/66/86/57/1050668657.db2.gz PWCPRHFCKNCBJC-UHFFFAOYSA-N 2 0 348.531 4.083 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]Cc2ccc(-n3ccnc3)cc2)c1 ZINC000075809914 1050674324 /nfs/dbraw/zinc/67/43/24/1050674324.db2.gz IYRUQKMLMHCKLY-UHFFFAOYSA-N 2 0 348.494 4.004 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]C1CCc2ccccc2CC1 ZINC001179338362 1050680545 /nfs/dbraw/zinc/68/05/45/1050680545.db2.gz GKMNTOZAAUPNIX-AUSIDOKSSA-N 2 0 348.534 4.292 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(Cl)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000152911149 1050882737 /nfs/dbraw/zinc/88/27/37/1050882737.db2.gz GCMDDNNLNVUADW-OAHLLOKOSA-N 2 0 332.875 4.131 20 0 EIADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC001180302568 1050945663 /nfs/dbraw/zinc/94/56/63/1050945663.db2.gz ZLYNMXDPUBINFN-XYEHWOGUSA-N 2 0 326.528 4.455 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@@H](C)C2CCOCC2)ccc1OC ZINC000183130337 1050987459 /nfs/dbraw/zinc/98/74/59/1050987459.db2.gz HOEWWQAIHPAKRH-DLBZAZTESA-N 2 0 348.531 4.003 20 0 EIADRP C[C@]1(c2ccccc2)CC[C@H]([NH+]2CCC([NH+]3CCCCC3)CC2)C1 ZINC001180540034 1051028747 /nfs/dbraw/zinc/02/87/47/1051028747.db2.gz FVJWQLOCJVAOIS-VXKWHMMOSA-N 2 0 326.528 4.447 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@H](C)SC)cc1C[NH+]1CCCCC1 ZINC000183378209 1051102610 /nfs/dbraw/zinc/10/26/10/1051102610.db2.gz WTMDLUBOAOHFFD-JKSUJKDBSA-N 2 0 336.545 4.083 20 0 EIADRP Cc1cc(Nc2cccc3c2C[N@H+](C)C[C@@H]3c2ccccc2)cc[nH+]1 ZINC001174656998 1051129287 /nfs/dbraw/zinc/12/92/87/1051129287.db2.gz YKAMZAMXGIXLNO-HXUWFJFHSA-N 2 0 329.447 4.133 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2cccc(OCC3CCCCC3)c2)C1 ZINC000620513426 1051148847 /nfs/dbraw/zinc/14/88/47/1051148847.db2.gz IUZGOKZMODHIKM-FQEVSTJZSA-N 2 0 330.516 4.077 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCS2)cc1C[NH+]1CCCCC1 ZINC000775395813 1051210346 /nfs/dbraw/zinc/21/03/46/1051210346.db2.gz MKFJRVKWBZSWRZ-APWZRJJASA-N 2 0 348.556 4.227 20 0 EIADRP CCN(CCC[NH+]1CCCC1)Cc1cc2ccccc2c(OC)c1 ZINC001181506616 1051243445 /nfs/dbraw/zinc/24/34/45/1051243445.db2.gz SYYKYKWQAULUGB-UHFFFAOYSA-N 2 0 326.484 4.156 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccc(C(F)F)c(F)c2)cc1 ZINC001181483956 1051245247 /nfs/dbraw/zinc/24/52/47/1051245247.db2.gz CMQZNHLCCSHRRR-UHFFFAOYSA-N 2 0 336.401 4.457 20 0 EIADRP C[C@@H]([NH2+]CC1(N[C@@H](C)c2ccccc2)CCOCC1)c1cccs1 ZINC000153917137 1051246484 /nfs/dbraw/zinc/24/64/84/1051246484.db2.gz KVYWEWSIDCLBLB-DLBZAZTESA-N 2 0 344.524 4.299 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CC2(C)CCOCC2)ccc1OC ZINC000775416678 1051291897 /nfs/dbraw/zinc/29/18/97/1051291897.db2.gz WREPXEPLDLFCGF-KRWDZBQOSA-N 2 0 348.531 4.004 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cccc3ncccc23)C1 ZINC001191048959 1051350623 /nfs/dbraw/zinc/35/06/23/1051350623.db2.gz VLVCRMHDWSLVHU-RTBURBONSA-N 2 0 337.511 4.321 20 0 EIADRP Clc1ccc([C@@H]2CC[C@H]([NH2+]Cc3ccc4c[nH+]cn4c3)C2)cc1 ZINC001182249346 1051441389 /nfs/dbraw/zinc/44/13/89/1051441389.db2.gz FYTFTULKKNNNBO-AEFFLSMTSA-N 2 0 325.843 4.414 20 0 EIADRP COc1cc(C)ccc1[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311188772 1051470249 /nfs/dbraw/zinc/47/02/49/1051470249.db2.gz DJWVWNJTRNVTPU-QUCCMNQESA-N 2 0 338.495 4.176 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](CCCOc3cccc(C(C)(C)C)c3)CC[C@@H]21 ZINC001191521356 1051472454 /nfs/dbraw/zinc/47/24/54/1051472454.db2.gz PYFYREOFWSGLPC-RXVVDRJESA-N 2 0 344.543 4.169 20 0 EIADRP CC(C)[C@H]1CC[N@H+](CCC[NH+]2CCC(Cc3ccccc3)CC2)C1 ZINC001191541434 1051479734 /nfs/dbraw/zinc/47/97/34/1051479734.db2.gz SKFVNYVOLJITTQ-QFIPXVFZSA-N 2 0 328.544 4.309 20 0 EIADRP [NH3+]CCC1CCN(Cc2cc(F)cc(C(F)(F)F)c2Cl)CC1 ZINC001206507006 1051529674 /nfs/dbraw/zinc/52/96/74/1051529674.db2.gz WDTZOTNSOCANIK-UHFFFAOYSA-N 2 0 338.776 4.059 20 0 EIADRP CSc1ccccc1C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC(C)CC1 ZINC001175352144 1051543302 /nfs/dbraw/zinc/54/33/02/1051543302.db2.gz OJXBCBWIKMYDJA-LJQANCHMSA-N 2 0 332.557 4.495 20 0 EIADRP [NH3+]C[C@]1(F)CCC[N@H+](Cc2cc(Cl)ccc2C(F)(F)F)CC1 ZINC001205571015 1051548802 /nfs/dbraw/zinc/54/88/02/1051548802.db2.gz RSJKGHJSRFFWAR-AWEZNQCLSA-N 2 0 338.776 4.012 20 0 EIADRP CC(C)C[N@@H+](Cc1cnc2ccccc2c1)CC1CC[NH+](C)CC1 ZINC001175600778 1051664915 /nfs/dbraw/zinc/66/49/15/1051664915.db2.gz CALUJSAMCYOPHX-UHFFFAOYSA-N 2 0 325.500 4.035 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H]2CCC[C@@H](C3CC3)C2)(c2ccccc2)CC1 ZINC001183355474 1051826533 /nfs/dbraw/zinc/82/65/33/1051826533.db2.gz QQMYHONBMKCULH-CTNGQTDRSA-N 2 0 326.528 4.208 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[NH2+]CC1(c2ccccc2)CC[NH+](C)CC1 ZINC001183355458 1051826668 /nfs/dbraw/zinc/82/66/68/1051826668.db2.gz PXOWVSGTJQCUIV-GOSISDBHSA-N 2 0 340.486 4.010 20 0 EIADRP CCc1cccc(C[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC001192909335 1051829904 /nfs/dbraw/zinc/82/99/04/1051829904.db2.gz HNUCCTWHBYIRED-UHFFFAOYSA-N 2 0 337.511 4.383 20 0 EIADRP COCC[C@H](c1ccccc1)[NH+]1CCC(C)([NH+]2CCCCC2)CC1 ZINC001175965823 1051852694 /nfs/dbraw/zinc/85/26/94/1051852694.db2.gz RVZZNIJXTUHBRW-HXUWFJFHSA-N 2 0 330.516 4.105 20 0 EIADRP C[C@H]1CC[N@H+](Cc2c(Cl)cccc2C(F)(F)F)CC[C@H]1C[NH3+] ZINC001205628564 1051914944 /nfs/dbraw/zinc/91/49/44/1051914944.db2.gz VZXUTCYMPLUGOM-RYUDHWBXSA-N 2 0 334.813 4.166 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+][C@@H]1CC[C@@](C)(c2ccccc2)C1)c1cccnc1 ZINC001183919252 1051927284 /nfs/dbraw/zinc/92/72/84/1051927284.db2.gz HXVPKHKAUOOSPB-BHIFYINESA-N 2 0 337.511 4.174 20 0 EIADRP CC(C)[NH+]1CCN(CCC[NH2+]C(C)(C)CC2CCCCCC2)CC1 ZINC001193474036 1051928970 /nfs/dbraw/zinc/92/89/70/1051928970.db2.gz UDDLBLLUWFUWEP-UHFFFAOYSA-N 2 0 337.596 4.131 20 0 EIADRP CC(C)(C[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)C1CCC1 ZINC000716731038 1051980858 /nfs/dbraw/zinc/98/08/58/1051980858.db2.gz JFDWZDGUZJSWDB-JBACZVJFSA-N 2 0 326.528 4.455 20 0 EIADRP CC(C)COc1ccccc1CN1C[C@]23C[N@H+](C)C[C@@]2(C1)CCCC3 ZINC001184399415 1052003007 /nfs/dbraw/zinc/00/30/07/1052003007.db2.gz WBYQZTFUCCGTAK-SZPZYZBQSA-N 2 0 342.527 4.029 20 0 EIADRP Cc1cccc([C@@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c1 ZINC000165206902 1052054465 /nfs/dbraw/zinc/05/44/65/1052054465.db2.gz OMGPSGLGOJRTFW-GOSISDBHSA-N 2 0 326.484 4.176 20 0 EIADRP CC1CC[NH+](CCCC[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000166173789 1052086120 /nfs/dbraw/zinc/08/61/20/1052086120.db2.gz SLEGEPRBBNLSNZ-UNMCSNQZSA-N 2 0 344.543 4.256 20 0 EIADRP CCC[C@H]([NH2+]C[C@@H]1CN(Cc2ccccc2)CCCO1)C(C)(C)C ZINC001194426546 1052146638 /nfs/dbraw/zinc/14/66/38/1052146638.db2.gz LBWINWMPIAIAMK-UXHICEINSA-N 2 0 332.532 4.082 20 0 EIADRP Cc1cccc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c1F ZINC001177127969 1052227870 /nfs/dbraw/zinc/22/78/70/1052227870.db2.gz YOBUKZYRAJZQNT-UHFFFAOYSA-N 2 0 326.459 4.410 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccc(OC(F)F)cc1 ZINC000171128138 1052396085 /nfs/dbraw/zinc/39/60/85/1052396085.db2.gz UOQRJMCCWNCNNC-AWEZNQCLSA-N 2 0 334.410 4.200 20 0 EIADRP CC(C)Oc1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000171129378 1052396458 /nfs/dbraw/zinc/39/64/58/1052396458.db2.gz ZSOIHAHBPAQEGW-KRWDZBQOSA-N 2 0 326.484 4.386 20 0 EIADRP CCOc1cccc2cc([C@@H](C)N[C@@H]3CC[N@H+](C)C(C)(C)C3)oc21 ZINC000623342617 1052626099 /nfs/dbraw/zinc/62/60/99/1052626099.db2.gz GQXUTNKLQDJWIX-GDBMZVCRSA-N 2 0 330.472 4.355 20 0 EIADRP CCOc1cccc2cc([C@H](C)N[C@@H]3CC[N@H+](C)C(C)(C)C3)oc21 ZINC000623342619 1052626167 /nfs/dbraw/zinc/62/61/67/1052626167.db2.gz GQXUTNKLQDJWIX-GOEBONIOSA-N 2 0 330.472 4.355 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3cccc4n[nH]cc43)cc2)C1 ZINC000623357428 1052632318 /nfs/dbraw/zinc/63/23/18/1052632318.db2.gz OKRDFVYEOVMQGM-KRWDZBQOSA-N 2 0 348.494 4.085 20 0 EIADRP c1[nH]nc2cccc(C[NH2+]Cc3cccc(C[NH+]4CCCCCC4)c3)c12 ZINC000623385955 1052641634 /nfs/dbraw/zinc/64/16/34/1052641634.db2.gz DVHPMKUHNWIOIA-UHFFFAOYSA-N 2 0 348.494 4.229 20 0 EIADRP C[C@@H]([NH2+][C@H]1CCCc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000178094541 1052699159 /nfs/dbraw/zinc/69/91/59/1052699159.db2.gz MDLFTGQJQCFNAL-VGSWGCGISA-N 2 0 338.495 4.355 20 0 EIADRP C[C@@H]([NH2+]Cc1cc2ccccc2o1)c1cccc(OCC[NH+](C)C)c1 ZINC000178486550 1052706476 /nfs/dbraw/zinc/70/64/76/1052706476.db2.gz UHILADLYSLLJLB-MRXNPFEDSA-N 2 0 338.451 4.224 20 0 EIADRP C[C@@H]([NH2+][C@@H](c1ccccc1)C1CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000178494141 1052706980 /nfs/dbraw/zinc/70/69/80/1052706980.db2.gz OKIJETOCNYEWEQ-VGSWGCGISA-N 2 0 338.495 4.429 20 0 EIADRP C[C@H]([NH2+]Cc1cc2ccccc2o1)c1cccc(OCC[NH+](C)C)c1 ZINC000178486542 1052707107 /nfs/dbraw/zinc/70/71/07/1052707107.db2.gz UHILADLYSLLJLB-INIZCTEOSA-N 2 0 338.451 4.224 20 0 EIADRP Clc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000623755264 1052779535 /nfs/dbraw/zinc/77/95/35/1052779535.db2.gz ABWLZIDAEWAULR-CLCXKQKWSA-N 2 0 343.902 4.415 20 0 EIADRP C[C@H]([NH2+]C1(c2ccccc2)CCC1)c1cccc(OCC[NH+](C)C)c1 ZINC000180343685 1052795823 /nfs/dbraw/zinc/79/58/23/1052795823.db2.gz FXGUKDRJNFSVPA-SFHVURJKSA-N 2 0 338.495 4.357 20 0 EIADRP Clc1ccc2c(c1)[C@H]([NH2+]Cc1ccnn1-c1cc[nH+]cc1)CCC2 ZINC000623833451 1052820106 /nfs/dbraw/zinc/82/01/06/1052820106.db2.gz GOWHAEYISMPPQF-LJQANCHMSA-N 2 0 338.842 4.088 20 0 EIADRP Clc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000623861235 1052824642 /nfs/dbraw/zinc/82/46/42/1052824642.db2.gz SJGQZRZFOOYSFG-ORAYPTAESA-N 2 0 343.902 4.273 20 0 EIADRP Cc1ccc(C(C)(C)C[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)nc1 ZINC000624112847 1052866134 /nfs/dbraw/zinc/86/61/34/1052866134.db2.gz NHDFNVCOWVQAJD-XLIONFOSSA-N 2 0 343.559 4.300 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2nc3ccccc3o2)CC1 ZINC000182777603 1052949749 /nfs/dbraw/zinc/94/97/49/1052949749.db2.gz ATEKGAKCELLRIG-UHFFFAOYSA-N 2 0 329.488 4.162 20 0 EIADRP Cc1oc2ccccc2c1C[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000381134575 1053054852 /nfs/dbraw/zinc/05/48/52/1053054852.db2.gz AEUCCACRWBUTMA-IBGZPJMESA-N 2 0 334.463 4.353 20 0 EIADRP Cc1cccc2[nH]c(C[NH2+]C3CCC([NH+]4CCCCC4)CC3)cc21 ZINC000850179415 1053082358 /nfs/dbraw/zinc/08/23/58/1053082358.db2.gz ZGJBJMCWISERIF-UHFFFAOYSA-N 2 0 325.500 4.363 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1cnn(-c2ccccc2)c1C ZINC000764435664 1053102913 /nfs/dbraw/zinc/10/29/13/1053102913.db2.gz RVLITPUAELMEAF-QZTJIDSGSA-N 2 0 342.531 4.342 20 0 EIADRP Cc1ccc(C[NH+](C)C)cc1N[C@H](C)c1cccc(C[NH+](C)C)c1 ZINC000864005588 1053126498 /nfs/dbraw/zinc/12/64/98/1053126498.db2.gz CDTBKELESVDUKW-QGZVFWFLSA-N 2 0 325.500 4.291 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2c(c1)CCO2 ZINC000764973525 1053395850 /nfs/dbraw/zinc/39/58/50/1053395850.db2.gz QSHIXLAIBUKJAC-FGTMMUONSA-N 2 0 330.516 4.030 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)c1ccc(SC(F)F)cc1)C[NH+]1CCCC1 ZINC000765119269 1053444258 /nfs/dbraw/zinc/44/42/58/1053444258.db2.gz MSECVGCFRUDVSA-KGLIPLIRSA-N 2 0 328.472 4.384 20 0 EIADRP C[C@@H]([NH2+]C[C@H](C)C[NH+]1CCCC1)c1ccc(SC(F)F)cc1 ZINC000765119271 1053445072 /nfs/dbraw/zinc/44/50/72/1053445072.db2.gz MSECVGCFRUDVSA-UONOGXRCSA-N 2 0 328.472 4.384 20 0 EIADRP CC[C@@H]1C[C@H]1C[NH+]1CCC2(CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001195649401 1053453462 /nfs/dbraw/zinc/45/34/62/1053453462.db2.gz IXIXFLVVEJOVIU-RTWAWAEBSA-N 2 0 326.528 4.411 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)c1cccc(F)c1 ZINC000765360758 1053515693 /nfs/dbraw/zinc/51/56/93/1053515693.db2.gz SHQMWRMNRHXVFX-IRXDYDNUSA-N 2 0 344.474 4.220 20 0 EIADRP CCOc1cccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000385805307 1053550291 /nfs/dbraw/zinc/55/02/91/1053550291.db2.gz NHLNJVUOKPDENL-NQIIRXRSSA-N 2 0 338.495 4.086 20 0 EIADRP C[C@@H](CSC(C)(C)C)[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000765450263 1053550451 /nfs/dbraw/zinc/55/04/51/1053550451.db2.gz PBYNWNYEOWEPQC-PKOBYXMFSA-N 2 0 334.573 4.408 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1)c1ccnc(Cl)c1 ZINC000765449392 1053550585 /nfs/dbraw/zinc/55/05/85/1053550585.db2.gz JJJAPKMQMWUBKW-AEFFLSMTSA-N 2 0 343.902 4.298 20 0 EIADRP CC[NH+](CC)Cc1ccc(CNCc2c(Cl)n[nH]c2C2CC2)cc1 ZINC000921514302 1053561208 /nfs/dbraw/zinc/56/12/08/1053561208.db2.gz XXFZJJUILIFFFH-UHFFFAOYSA-N 2 0 346.906 4.072 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc2c(c1)CCO2 ZINC000120876340 1053631760 /nfs/dbraw/zinc/63/17/60/1053631760.db2.gz JPHNSLDWAFWLTC-FQEVSTJZSA-N 2 0 342.458 4.063 20 0 EIADRP C[C@@H](CCc1cncc2ccccc21)[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000866290744 1053680445 /nfs/dbraw/zinc/68/04/45/1053680445.db2.gz YFJKKRKDYPFSDR-KRWDZBQOSA-N 2 0 339.527 4.408 20 0 EIADRP C[C@@H](Cc1cccs1)[NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000690007585 1053741774 /nfs/dbraw/zinc/74/17/74/1053741774.db2.gz SPBAGCJURPZFBJ-PXNSSMCTSA-N 2 0 328.525 4.181 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]CC[C@@H]2CCCS2)C3)cc1 ZINC000866482256 1053746049 /nfs/dbraw/zinc/74/60/49/1053746049.db2.gz ZJEXLENRIZOXDD-HAGHYFMRSA-N 2 0 330.541 4.057 20 0 EIADRP C[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ccccc1OC(F)F ZINC000866516274 1053763577 /nfs/dbraw/zinc/76/35/77/1053763577.db2.gz NYHFJLAARSWNJH-WRSVWVKZSA-N 2 0 326.431 4.202 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@H](Cc2ccncc2)c2cccs2)CC1 ZINC000866517650 1053764121 /nfs/dbraw/zinc/76/41/21/1053764121.db2.gz MBQWBNWSGYJDAK-QPIRBTGLSA-N 2 0 343.540 4.279 20 0 EIADRP C[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ncc(-c2ccccc2)n1C ZINC000866516853 1053765017 /nfs/dbraw/zinc/76/50/17/1053765017.db2.gz DGKVITWXTGMBQD-AFJQURTJSA-N 2 0 340.515 4.001 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCc2ccccc2C1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386546136 1053771341 /nfs/dbraw/zinc/77/13/41/1053771341.db2.gz SFZXELNJKSBGRT-OFAXGOBFSA-N 2 0 334.507 4.044 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCc2c1cccc2F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386578556 1053781304 /nfs/dbraw/zinc/78/13/04/1053781304.db2.gz ZGJCZCGMRKYEEG-AQOAWAETSA-N 2 0 338.470 4.313 20 0 EIADRP CCC1([NH+]2CCC2)CC[NH+](CC2CCC(C(F)(F)F)CC2)CC1 ZINC001197890233 1054013839 /nfs/dbraw/zinc/01/38/39/1054013839.db2.gz CNMIVIBGSDMELW-UHFFFAOYSA-N 2 0 332.454 4.305 20 0 EIADRP CC(C)C[C@@H](C)C[N@@H+]1CC[C@H](Oc2ccnc(C[NH+](C)C(C)C)c2)C1 ZINC000856559696 1054085069 /nfs/dbraw/zinc/08/50/69/1054085069.db2.gz SMUOPAJPWAIMNW-NQIIRXRSSA-N 2 0 347.547 4.057 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CC[C@H]3CC3(Cl)Cl)CC2)C1 ZINC000857065405 1054169063 /nfs/dbraw/zinc/16/90/63/1054169063.db2.gz NUACRKIZOJEBRT-YCPHGPKFSA-N 2 0 333.347 4.203 20 0 EIADRP Cc1nccn1C[C@H](C)C[NH2+][C@@H]1CCC[C@H]1c1ccccc1Cl ZINC000542667112 1054179160 /nfs/dbraw/zinc/17/91/60/1054179160.db2.gz WYFZVZWIYUGQNX-DKSSEZFCSA-N 2 0 331.891 4.407 20 0 EIADRP CC(C)(C)c1coc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)n1 ZINC000921629138 1054193418 /nfs/dbraw/zinc/19/34/18/1054193418.db2.gz KDKGRXLOHRWLTK-UHFFFAOYSA-N 2 0 347.528 4.035 20 0 EIADRP C([NH2+][C@@H]1CCOC2(CCCC2)C1)C1([NH+]2CCCCC2)CCCCC1 ZINC001198980595 1054317905 /nfs/dbraw/zinc/31/79/05/1054317905.db2.gz JJESQDNYQCFPMT-LJQANCHMSA-N 2 0 334.548 4.257 20 0 EIADRP CS[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC001199021171 1054321003 /nfs/dbraw/zinc/32/10/03/1054321003.db2.gz CSFHVULXEFLRER-VQTJNVASSA-N 2 0 332.557 4.436 20 0 EIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CCc1ccccc1F ZINC001198989704 1054322463 /nfs/dbraw/zinc/32/24/63/1054322463.db2.gz AFMRURBMZDSNAR-UHFFFAOYSA-N 2 0 328.475 4.116 20 0 EIADRP CC1(C)C[C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CCO1 ZINC000872071933 1054378512 /nfs/dbraw/zinc/37/85/12/1054378512.db2.gz ABXKNBSNWPNGOL-WVVQBRDUSA-N 2 0 342.527 4.119 20 0 EIADRP CC1(C)C[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CCO1 ZINC000872071932 1054379151 /nfs/dbraw/zinc/37/91/51/1054379151.db2.gz ABXKNBSNWPNGOL-UDEWTMQYSA-N 2 0 342.527 4.119 20 0 EIADRP CCOc1cccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)CC)c2)c1 ZINC000123940362 1054380340 /nfs/dbraw/zinc/38/03/40/1054380340.db2.gz OFFODTACZPTHFY-QGZVFWFLSA-N 2 0 326.484 4.388 20 0 EIADRP CC[C@@H](CCC(F)(F)F)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000872085449 1054382386 /nfs/dbraw/zinc/38/23/86/1054382386.db2.gz NNOYLBXPOPEVMN-KRWDZBQOSA-N 2 0 343.437 4.004 20 0 EIADRP COc1ccc(C[NH2+]Cc2ccccc2C[N@H+](C)C(C)C)cc1Cl ZINC001199296540 1054383146 /nfs/dbraw/zinc/38/31/46/1054383146.db2.gz VHAFOIRPVLYRMS-UHFFFAOYSA-N 2 0 346.902 4.479 20 0 EIADRP Cc1nn(C(C)(C)C)c(C)c1C[NH2+]CCCC[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC001199321422 1054392290 /nfs/dbraw/zinc/39/22/90/1054392290.db2.gz XXEXTFHVJZQEAW-IRXDYDNUSA-N 2 0 348.579 4.103 20 0 EIADRP CC(C)c1[nH+]c(CNC[C@H](C2CCCCC2)[NH+](C)C)c2ccccn21 ZINC001199335786 1054394596 /nfs/dbraw/zinc/39/45/96/1054394596.db2.gz CDWRSAZJAXBGEY-HXUWFJFHSA-N 2 0 342.531 4.058 20 0 EIADRP c1sc(C[NH2+]C2CC[NH+](CC3CC3)CC2)cc1-c1ccccc1 ZINC001199413497 1054408938 /nfs/dbraw/zinc/40/89/38/1054408938.db2.gz PFKVDZGESJRLJY-UHFFFAOYSA-N 2 0 326.509 4.379 20 0 EIADRP Clc1cccc2c1OCC[C@@H]2[NH2+]Cc1cc(-n2ccnc2)cs1 ZINC001199751180 1054462199 /nfs/dbraw/zinc/46/21/99/1054462199.db2.gz LXIVJFGVRGEWAI-INIZCTEOSA-N 2 0 345.855 4.201 20 0 EIADRP C[C@H](C[NH2+]Cc1ccccc1OCC[NH+](C)C)CC1CCCCC1 ZINC001199822436 1054480980 /nfs/dbraw/zinc/48/09/80/1054480980.db2.gz GFKPNEKWVLJFIM-SFHVURJKSA-N 2 0 332.532 4.323 20 0 EIADRP c1csc(-c2nc(C[NH2+][C@@H]3CCCCC34CC[NH2+]CC4)cs2)c1 ZINC000873232327 1054510421 /nfs/dbraw/zinc/51/04/21/1054510421.db2.gz FMZHAHZPXNJBNW-MRXNPFEDSA-N 2 0 347.553 4.274 20 0 EIADRP Clc1ccccc1C1([NH2+]Cc2cc3c(s2)CC[NH2+]C3)CCC1 ZINC000873213831 1054510891 /nfs/dbraw/zinc/51/08/91/1054510891.db2.gz REUMNVYWAXLNQY-UHFFFAOYSA-N 2 0 332.900 4.216 20 0 EIADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000873254818 1054515498 /nfs/dbraw/zinc/51/54/98/1054515498.db2.gz BFYDZOASPCSQLG-STECZYCISA-N 2 0 326.406 4.059 20 0 EIADRP [NH3+][C@H]1C[C@H](C[NH2+][C@@H](c2ccccc2Cl)c2cc(F)ccc2F)C1 ZINC000873254943 1054515731 /nfs/dbraw/zinc/51/57/31/1054515731.db2.gz BXABBKLAKAQCFZ-FNFWKMNBSA-N 2 0 336.813 4.035 20 0 EIADRP CSc1cccc([C@@H]([NH2+]C[C@H]2C[C@H]([NH3+])C2)c2cc(F)ccc2F)c1 ZINC000873255249 1054515932 /nfs/dbraw/zinc/51/59/32/1054515932.db2.gz FJTVXWJUDIXGCC-KPAZRMRSSA-N 2 0 348.462 4.103 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873268775 1054517960 /nfs/dbraw/zinc/51/79/60/1054517960.db2.gz ZWPWUYZIVMODNI-CHWSQXEVSA-N 2 0 347.503 4.296 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCCc2nc(-c3ccccc3)sc21)C1CC[NH2+]CC1 ZINC000873267853 1054518518 /nfs/dbraw/zinc/51/85/18/1054518518.db2.gz KTQZHOXQHWLSEO-RHSMWYFYSA-N 2 0 341.524 4.165 20 0 EIADRP C[C@H](c1ccncc1)N1CCC([NH2+]C2CCC(C(F)F)CC2)CC1 ZINC000282249283 1054775756 /nfs/dbraw/zinc/77/57/56/1054775756.db2.gz JLXSLFHGNOUEJF-ODIFPOPNSA-N 2 0 337.458 4.021 20 0 EIADRP C[N@H+](Cc1ccncc1)C1CC2(C1)CC[NH+](CC1CCCCC1)CC2 ZINC001201392681 1054789268 /nfs/dbraw/zinc/78/92/68/1054789268.db2.gz DPLUKVTUYVOUIC-UHFFFAOYSA-N 2 0 341.543 4.338 20 0 EIADRP C[N@H+](Cc1ccco1)[C@H]1CCC12CC[NH+](CCc1ccccc1)CC2 ZINC001201596276 1054847302 /nfs/dbraw/zinc/84/73/02/1054847302.db2.gz BXKURMGJRGDNBA-NRFANRHFSA-N 2 0 338.495 4.199 20 0 EIADRP c1ccc(CC[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)cc1 ZINC001201602835 1054861881 /nfs/dbraw/zinc/86/18/81/1054861881.db2.gz CMFDPYJTWMNIRX-UHFFFAOYSA-N 2 0 334.507 4.217 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3cccc4cnccc43)CC2)CC1 ZINC001201607575 1054863769 /nfs/dbraw/zinc/86/37/69/1054863769.db2.gz GABXCVUOBWFORR-UHFFFAOYSA-N 2 0 337.511 4.368 20 0 EIADRP COc1ccc(C[NH2+]CC[C@@H](C)[NH+]2CCCCC2)cc1C(C)(C)C ZINC001201962405 1054968850 /nfs/dbraw/zinc/96/88/50/1054968850.db2.gz AXJFRRNQVBUHEI-QGZVFWFLSA-N 2 0 332.532 4.347 20 0 EIADRP Clc1nccc2oc(C[NH2+]C3CCC([NH+]4CCCCC4)CC3)cc21 ZINC000877075408 1055013170 /nfs/dbraw/zinc/01/31/70/1055013170.db2.gz BHPDJHOFENFLJO-UHFFFAOYSA-N 2 0 347.890 4.368 20 0 EIADRP COc1ccc(CC[C@@H](C)[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1 ZINC000119148413 1055121372 /nfs/dbraw/zinc/12/13/72/1055121372.db2.gz DKXSCJPQAQVQKD-QGZVFWFLSA-N 2 0 330.516 4.013 20 0 EIADRP COc1cc([C@H](C)[NH2+]CC2CC[NH+](C)CC2)ccc1OCCC(C)C ZINC000765778759 1055274129 /nfs/dbraw/zinc/27/41/29/1055274129.db2.gz AHNLYAMTZNNLBL-KRWDZBQOSA-N 2 0 348.531 4.113 20 0 EIADRP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655825137 1055677180 /nfs/dbraw/zinc/67/71/80/1055677180.db2.gz YEZKUDMCLTXVNU-QNQQVFGPSA-N 2 0 326.406 4.039 20 0 EIADRP CC[NH+](CC)CCOCC[NH2+][C@H](C)c1cc(Cl)sc1Cl ZINC000542680174 1055818952 /nfs/dbraw/zinc/81/89/52/1055818952.db2.gz JZAYLJMNKTVCBF-LLVKDONJSA-N 2 0 339.332 4.064 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)C1CCC(C(F)(F)F)CC1 ZINC000474615810 1055925103 /nfs/dbraw/zinc/92/51/03/1055925103.db2.gz GUJOESSHLKXSHG-JEYLPNPQSA-N 2 0 332.454 4.208 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CC3c4ccccc4C2c2ccccc23)C1 ZINC000656193727 1056692971 /nfs/dbraw/zinc/69/29/71/1056692971.db2.gz QMNHHEIZZGCSKS-ONQFPYBPSA-N 2 0 332.491 4.143 20 0 EIADRP Cc1cccc(C(C)(C)C[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)c1 ZINC000063320131 1056802205 /nfs/dbraw/zinc/80/22/05/1056802205.db2.gz XKOXOIAUUWAESA-UHFFFAOYSA-N 2 0 340.511 4.003 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1OCc1ccccc1)C1CC[NH+](C)CC1 ZINC000381142621 1060208993 /nfs/dbraw/zinc/20/89/93/1060208993.db2.gz SQCQWFUGKBGBHA-GOSISDBHSA-N 2 0 338.495 4.086 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000386483102 1060268999 /nfs/dbraw/zinc/26/89/99/1060268999.db2.gz WLRQDPIDGSNHHW-AZUAARDMSA-N 2 0 338.495 4.258 20 0 EIADRP c1ccc(C[C@H]([NH2+]C2CCC([NH+]3CCCCC3)CC2)C2CC2)cc1 ZINC000766510298 1060421760 /nfs/dbraw/zinc/42/17/60/1060421760.db2.gz GKRTZWDUMPGKGR-HRTMPFAESA-N 2 0 326.528 4.394 20 0 EIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)c1 ZINC000766510283 1060425579 /nfs/dbraw/zinc/42/55/79/1060425579.db2.gz GEMCLKJNSZCMQM-YLZJTPGZSA-N 2 0 343.515 4.093 20 0 EIADRP COc1ccc(CC[C@@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)cc1 ZINC000766512515 1060487581 /nfs/dbraw/zinc/48/75/81/1060487581.db2.gz LQNJRLXOMRLJMU-KMFTYDHNSA-N 2 0 344.543 4.403 20 0 EIADRP CCCCCC(C)(C)C[NH2+][C@@H]1CCN(Cc2ccccn2)C[C@@H]1C ZINC000766551971 1060536565 /nfs/dbraw/zinc/53/65/65/1060536565.db2.gz XKBKIGQEUNBZDS-AZUAARDMSA-N 2 0 331.548 4.488 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccc(SC(F)(F)F)cc2)CCC[C@H]1C[NH3+] ZINC001205996032 1060565228 /nfs/dbraw/zinc/56/52/28/1060565228.db2.gz UBOWPPKEPATJCA-JSGCOSHPSA-N 2 0 332.435 4.105 20 0 EIADRP Cc1ccc(CC[NH2+]C2[C@@H](C)C[NH+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC001168993194 1060566992 /nfs/dbraw/zinc/56/69/92/1060566992.db2.gz IRYYHKDZFJPNFV-PMACEKPBSA-N 2 0 336.523 4.284 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C(C)(C)Cc1ccccc1C(F)(F)F)C2 ZINC001169119392 1060647563 /nfs/dbraw/zinc/64/75/63/1060647563.db2.gz SIVRZKFGCRUFFF-PHZGNYQRSA-N 2 0 340.433 4.241 20 0 EIADRP CCCC[C@H]([NH3+])Cc1cn([C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2ccccc12 ZINC001169109481 1060657898 /nfs/dbraw/zinc/65/78/98/1060657898.db2.gz JDNYHUBZMNHQQG-HAGHYFMRSA-N 2 0 339.527 4.499 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH+]1CC[C@@H](c3ccc(OC(C)(C)C)cc3)C1)C2 ZINC001169160429 1060672972 /nfs/dbraw/zinc/67/29/72/1060672972.db2.gz FBUZOQODHKRDRY-ZRNYENFQSA-N 2 0 342.527 4.278 20 0 EIADRP CCN1CCC([NH2+][C@@H]2CC[C@H](C[C@@H]3CC[C@H]([NH3+])[C@H](C)C3)C[C@@H]2C)CC1 ZINC001169233953 1060704157 /nfs/dbraw/zinc/70/41/57/1060704157.db2.gz YRCMSQTYZSKORT-ZEXGJKEESA-N 2 0 349.607 4.019 20 0 EIADRP C[N@@H+]1CCC[C@H](CCNc2[nH+]ccc3c2ccn3Cc2ccccc2)C1 ZINC001156390079 1061006571 /nfs/dbraw/zinc/00/65/71/1061006571.db2.gz UUDOHFSMSWAMHB-LJQANCHMSA-N 2 0 348.494 4.228 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cc(F)c(F)c(F)c2)cc1 ZINC000067946298 520751076 /nfs/dbraw/zinc/75/10/76/520751076.db2.gz SFFUQCGRRCINCD-UHFFFAOYSA-N 2 0 336.401 4.236 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2sccc2Br)CC1 ZINC000532215473 1032097866 /nfs/dbraw/zinc/09/78/66/1032097866.db2.gz SLYOJQQCJOFVSA-GFCCVEGCSA-N 2 0 345.350 4.283 20 0 EIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]C[C@H]1CCC[N@@H+](C)C1 ZINC000532226264 1032105834 /nfs/dbraw/zinc/10/58/34/1032105834.db2.gz RQZGUQQWKHFPKP-MOPGFXCFSA-N 2 0 328.525 4.272 20 0 EIADRP Clc1ccc(SCC[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459378447 1032115339 /nfs/dbraw/zinc/11/53/39/1032115339.db2.gz OGFJXWFOKXZRPN-UHFFFAOYSA-N 2 0 347.915 4.086 20 0 EIADRP CC[C@@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccccc1OC(F)F ZINC000151935421 1032136662 /nfs/dbraw/zinc/13/66/62/1032136662.db2.gz LJDYYPQBPBGPPQ-XJKSGUPXSA-N 2 0 326.431 4.059 20 0 EIADRP CC[N@H+](C1CCN(c2cc(C)nc(C(C)C)n2)CC1)[C@@H]1C=CCCC1 ZINC000532734532 1032272096 /nfs/dbraw/zinc/27/20/96/1032272096.db2.gz LOYUILTYVDQOFO-GOSISDBHSA-N 2 0 342.531 4.308 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)C[C@H](C)O1 ZINC000648431537 1032293497 /nfs/dbraw/zinc/29/34/97/1032293497.db2.gz BPAXAJQZSBWTCE-RMFSNUHRSA-N 2 0 344.543 4.497 20 0 EIADRP CC[C@H]1C[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)CCO1 ZINC000648438132 1032309818 /nfs/dbraw/zinc/30/98/18/1032309818.db2.gz RFZZXRRBHPRODL-RTWAWAEBSA-N 2 0 330.516 4.110 20 0 EIADRP Clc1cc2cccnc2c(CN2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000172575430 1032326693 /nfs/dbraw/zinc/32/66/93/1032326693.db2.gz POVUZWURWFTYCH-LJQANCHMSA-N 2 0 343.902 4.339 20 0 EIADRP CC[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccncc1 ZINC000245750726 1032459235 /nfs/dbraw/zinc/45/92/35/1032459235.db2.gz TZBIKJDSJZDLTG-LRSLUSHPSA-N 2 0 335.495 4.318 20 0 EIADRP CC[C@H](C)Oc1cc(C[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)ccc1OC ZINC000666755301 1032499632 /nfs/dbraw/zinc/49/96/32/1032499632.db2.gz KMCOEADNZASEOO-JKSUJKDBSA-N 2 0 342.483 4.182 20 0 EIADRP c1cc2c(o1)CCC[C@H]2NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000178800269 1032540675 /nfs/dbraw/zinc/54/06/75/1032540675.db2.gz PIOQHRLTOHCOBX-SMLSOGCJSA-N 2 0 336.479 4.442 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccccc1F ZINC000180152258 1032595344 /nfs/dbraw/zinc/59/53/44/1032595344.db2.gz QQDWEMJSOVSERL-FQEVSTJZSA-N 2 0 330.447 4.007 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(C(F)(F)F)s2)CC1 ZINC000432740322 1032643070 /nfs/dbraw/zinc/64/30/70/1032643070.db2.gz FWQBUFWUVLPSPE-UHFFFAOYSA-N 2 0 334.451 4.321 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+]CC[C@@H](C)[NH+]1CCCCC1 ZINC000512416743 1032723923 /nfs/dbraw/zinc/72/39/23/1032723923.db2.gz VGIFYLFUVQALJD-LRXXLLMYSA-N 2 0 330.516 4.090 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)CS1 ZINC000683108311 1018835329 /nfs/dbraw/zinc/83/53/29/1018835329.db2.gz BPQXJIZNJGCTKU-AABGKKOBSA-N 2 0 332.557 4.018 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1cc2ccccc2s1 ZINC000339416622 1018856454 /nfs/dbraw/zinc/85/64/54/1018856454.db2.gz OVLFVVGQVDTARK-UHFFFAOYSA-N 2 0 334.448 4.080 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1cccc(Br)c1 ZINC000643545816 1018892913 /nfs/dbraw/zinc/89/29/13/1018892913.db2.gz CNNWBUDXOUVDDX-CVEARBPZSA-N 2 0 337.305 4.165 20 0 EIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+]C3CCCCCC3)CC2)cc1 ZINC000236582213 1032820228 /nfs/dbraw/zinc/82/02/28/1032820228.db2.gz KXRMUBUXDMTPGX-UHFFFAOYSA-N 2 0 344.543 4.370 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH+]2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001208613705 1019459737 /nfs/dbraw/zinc/45/97/37/1019459737.db2.gz YMUBJSLFCPVHKF-HIFRSBDPSA-N 2 0 327.299 4.125 20 0 EIADRP CCC[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccccn1 ZINC000179464465 1019737530 /nfs/dbraw/zinc/73/75/30/1019737530.db2.gz QVLZORFDHMRFNJ-NRFANRHFSA-N 2 0 337.511 4.425 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccc(Cl)cn1 ZINC000274903659 1019846499 /nfs/dbraw/zinc/84/64/99/1019846499.db2.gz LRMSLAJXXPACFW-HNNXBMFYSA-N 2 0 329.875 4.182 20 0 EIADRP C[NH+](C)[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc(F)cc3)s2)CC1 ZINC000432816806 1032872996 /nfs/dbraw/zinc/87/29/96/1032872996.db2.gz RKDGZEOXJLFNMS-QGZVFWFLSA-N 2 0 332.488 4.470 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2csc(-c3ccccc3)n2)CC1 ZINC000047973514 1020173647 /nfs/dbraw/zinc/17/36/47/1020173647.db2.gz DQWPSLDUNKHPPP-UHFFFAOYSA-N 2 0 343.540 4.364 20 0 EIADRP COc1ccc2oc([C@H](C)[NH2+][C@H](C)C3CC[NH+](C)CC3)c(C)c2c1 ZINC000153666406 1020362875 /nfs/dbraw/zinc/36/28/75/1020362875.db2.gz XFKXPXQTLQMDHJ-CABCVRRESA-N 2 0 330.472 4.131 20 0 EIADRP CC1CC[NH+](C[C@H]2CCCN(CC[C@@H]3CC3(Cl)Cl)C2)CC1 ZINC001167255608 1020677568 /nfs/dbraw/zinc/67/75/68/1020677568.db2.gz JSZUAJWRNLHXIF-JKSUJKDBSA-N 2 0 333.347 4.014 20 0 EIADRP C[NH+]1CCC(CC[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000538098141 1020878113 /nfs/dbraw/zinc/87/81/13/1020878113.db2.gz CZCNYDPTXOYGEY-GOSISDBHSA-N 2 0 340.433 4.478 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000655806565 1020974903 /nfs/dbraw/zinc/97/49/03/1020974903.db2.gz YPVNDLHSEFZDPP-HFSMHLIXSA-N 2 0 338.495 4.256 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)C1 ZINC000655804272 1020975052 /nfs/dbraw/zinc/97/50/52/1020975052.db2.gz RNWGZFKFHWKIJU-BVPBIZIASA-N 2 0 340.433 4.271 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)C1 ZINC000655804275 1020975068 /nfs/dbraw/zinc/97/50/68/1020975068.db2.gz RNWGZFKFHWKIJU-RNJTYBCJSA-N 2 0 340.433 4.271 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000655806560 1020975167 /nfs/dbraw/zinc/97/51/67/1020975167.db2.gz YNQXPHSQEBWJOT-KCQAQPDRSA-N 2 0 346.462 4.332 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccccc1OCc1ccccc1 ZINC000655805475 1020975608 /nfs/dbraw/zinc/97/56/08/1020975608.db2.gz HVADBQPKXFBWOF-RLLQIKCJSA-N 2 0 338.495 4.256 20 0 EIADRP CC[C@H]([NH2+]C1CC[NH+]([C@H](C)Cc2ccccc2)CC1)[C@@H]1CCCCO1 ZINC000655846805 1021010893 /nfs/dbraw/zinc/01/08/93/1021010893.db2.gz LZNVEOHGIYKVDN-COPCDDAFSA-N 2 0 344.543 4.019 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCCc3c(O)cccc32)cc1 ZINC000340470027 1021073910 /nfs/dbraw/zinc/07/39/10/1021073910.db2.gz YVBPBRCRLUBDKH-NRFANRHFSA-N 2 0 338.495 4.401 20 0 EIADRP COc1cc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)ccc1C ZINC000683704986 1021124119 /nfs/dbraw/zinc/12/41/19/1021124119.db2.gz HVBOAOUOUSVLMZ-NRFANRHFSA-N 2 0 338.495 4.005 20 0 EIADRP c1cc(N2CCCCC2)ncc1NC1=CC[C@@H]([NH+]2CCCC2)CC1 ZINC001210706121 1021564499 /nfs/dbraw/zinc/56/44/99/1021564499.db2.gz SNOJFDYZIVRKTN-LJQANCHMSA-N 2 0 326.488 4.016 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)C1 ZINC000580225598 1021777895 /nfs/dbraw/zinc/77/78/95/1021777895.db2.gz UTMDEGDQYQEHMI-IEBWSBKVSA-N 2 0 332.536 4.133 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCO3)c1 ZINC000177977853 1021837719 /nfs/dbraw/zinc/83/77/19/1021837719.db2.gz VIYSAWJWQVKZMK-KRWDZBQOSA-N 2 0 338.495 4.313 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1 ZINC000414103510 1021858426 /nfs/dbraw/zinc/85/84/26/1021858426.db2.gz DUXDLFYWESCUCR-BZSNNMDCSA-N 2 0 330.516 4.307 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H](C)c2cc(Cl)ccc2OC(F)F)CC1 ZINC000580389427 1021954453 /nfs/dbraw/zinc/95/44/53/1021954453.db2.gz FQIADPOYYBHHLW-GFCCVEGCSA-N 2 0 346.849 4.324 20 0 EIADRP C[C@@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2cc3ccccc3[nH]2)CC1 ZINC000683929440 1021996390 /nfs/dbraw/zinc/99/63/90/1021996390.db2.gz LRYUMBZXYBLXQA-KRWDZBQOSA-N 2 0 333.479 4.483 20 0 EIADRP C[C@H]([NH2+]C1CCC(C(F)F)CC1)c1cccc(OCC[NH+](C)C)c1 ZINC000414173104 1022029227 /nfs/dbraw/zinc/02/92/27/1022029227.db2.gz FKTDMXKTBJFLEC-UQPPLGOBSA-N 2 0 340.458 4.102 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1cnn(C(C)C)c1 ZINC000163788532 1022036684 /nfs/dbraw/zinc/03/66/84/1022036684.db2.gz OPJZUEBMSXMJSD-QGZVFWFLSA-N 2 0 328.504 4.157 20 0 EIADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccc(Oc2ccccc2)cn1 ZINC000414182579 1022056861 /nfs/dbraw/zinc/05/68/61/1022056861.db2.gz MWVJOXUYTMBSTE-MSOLQXFVSA-N 2 0 339.483 4.256 20 0 EIADRP COc1ccsc1[C@H](C)NCC[C@H](C)[N@H+](C)Cc1ccccc1 ZINC000471580444 1022062860 /nfs/dbraw/zinc/06/28/60/1022062860.db2.gz IFUKFAYONTXUKZ-HOTGVXAUSA-N 2 0 332.513 4.318 20 0 EIADRP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414188247 1022066405 /nfs/dbraw/zinc/06/64/05/1022066405.db2.gz QIEMUBZYDWJBHS-SFHVURJKSA-N 2 0 341.842 4.300 20 0 EIADRP Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414188246 1022067050 /nfs/dbraw/zinc/06/70/50/1022067050.db2.gz QIEMUBZYDWJBHS-GOSISDBHSA-N 2 0 341.842 4.300 20 0 EIADRP Cc1cn2c(n1)[C@@H](C[NH2+][C@@H](Cc1ccc(F)cc1)C(C)C)CCC2 ZINC000378182858 1022477524 /nfs/dbraw/zinc/47/75/24/1022477524.db2.gz JUCKMVAGUSUSSS-MJGOQNOKSA-N 2 0 329.463 4.065 20 0 EIADRP CCC[N@@H+]1CC[C@H](CNCc2ccc(-c3cccc(F)c3C)o2)C1 ZINC000236810899 1022493136 /nfs/dbraw/zinc/49/31/36/1022493136.db2.gz IQOGODFYSFVAJN-MRXNPFEDSA-N 2 0 330.447 4.216 20 0 EIADRP CCCCOc1ccc(C[N@H+](C)[C@H]2CCN(C)C[C@H]2C)cc1OCC ZINC000580801446 1022511545 /nfs/dbraw/zinc/51/15/45/1022511545.db2.gz JFPYGVJEIBKKAX-MJGOQNOKSA-N 2 0 348.531 4.036 20 0 EIADRP [NH3+]Cc1nn(-c2ccnc3ccc(C(F)(F)F)cc32)c2ccccc12 ZINC001167698452 1022679934 /nfs/dbraw/zinc/67/99/34/1022679934.db2.gz XZCBSSOKCVPDOO-UHFFFAOYSA-N 2 0 342.324 4.051 20 0 EIADRP c1nc(-c2ccccc2)sc1C[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000647542783 1022780639 /nfs/dbraw/zinc/78/06/39/1022780639.db2.gz BSWGVIFTIVTDTG-ROUUACIJSA-N 2 0 341.524 4.022 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000511551379 1022827895 /nfs/dbraw/zinc/82/78/95/1022827895.db2.gz DOFVSUQXMFVQAB-OBGWFSINSA-N 2 0 342.527 4.233 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@H]2CCCS2)ccc1OC ZINC000183107387 1022846623 /nfs/dbraw/zinc/84/66/23/1022846623.db2.gz OSGZIQKRHAFHDR-MAUKXSAKSA-N 2 0 336.545 4.083 20 0 EIADRP Clc1cccc2c1SCC[C@H]2[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423388966 1022864684 /nfs/dbraw/zinc/86/46/84/1022864684.db2.gz NUUOMDNBIGTUTC-QGZVFWFLSA-N 2 0 330.884 4.270 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)C(c1ccccc1)c1ccccc1 ZINC000178158839 1023061608 /nfs/dbraw/zinc/06/16/08/1023061608.db2.gz NPHJKQROAITBMN-YUXAGFNASA-N 2 0 334.507 4.423 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCCc3c(Br)cccc32)cc1 ZINC000581549044 1023352248 /nfs/dbraw/zinc/35/22/48/1023352248.db2.gz NASDSOZPBSCXRB-GOSISDBHSA-N 2 0 345.284 4.075 20 0 EIADRP Cc1ccccc1-c1nn(-c2ccccc2)cc1C[NH2+][C@@H](C)CCC[NH3+] ZINC000415019693 1023393248 /nfs/dbraw/zinc/39/32/48/1023393248.db2.gz IJHVBNGHJBBQGR-SFHVURJKSA-N 2 0 348.494 4.065 20 0 EIADRP C[C@H](NCc1nsc2ccccc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000660258047 1023393775 /nfs/dbraw/zinc/39/37/75/1023393775.db2.gz YVVYQIVNLLVQSE-GJZGRUSLSA-N 2 0 329.513 4.039 20 0 EIADRP Cc1ccc(-c2nc(CN3CCCC[C@@H]3[C@@H]3CC[NH2+]C3)cs2)cc1 ZINC000415034246 1023401688 /nfs/dbraw/zinc/40/16/88/1023401688.db2.gz CLTYFKNSNKWGIW-IEBWSBKVSA-N 2 0 341.524 4.083 20 0 EIADRP Cc1noc(C)c1[C@H](C)[NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000925616296 1023402114 /nfs/dbraw/zinc/40/21/14/1023402114.db2.gz QQAZWZJTCFSUSS-FTRWYGJKSA-N 2 0 341.499 4.243 20 0 EIADRP Cc1ccc(-c2ncc(C[N@@H+]3CCCC[C@H]3[C@H]3CC[NH2+]C3)s2)cc1 ZINC000415038595 1023404124 /nfs/dbraw/zinc/40/41/24/1023404124.db2.gz IABAIWHEXITKRM-HKUYNNGSSA-N 2 0 341.524 4.083 20 0 EIADRP Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000924605118 1023405453 /nfs/dbraw/zinc/40/54/53/1023405453.db2.gz SLMZKURXTBIRGN-MRXNPFEDSA-N 2 0 341.499 4.374 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H](CCC[NH3+])c2ccccc2)CC1 ZINC000415052860 1023409370 /nfs/dbraw/zinc/40/93/70/1023409370.db2.gz LVQOOQNRRYKSRT-BVYCBKJFSA-N 3 0 343.559 4.099 20 0 EIADRP Cc1ccc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)c(Br)c1 ZINC000415052386 1023410152 /nfs/dbraw/zinc/41/01/52/1023410152.db2.gz KXGRMFGAOXARMN-SFHVURJKSA-N 2 0 347.300 4.327 20 0 EIADRP COc1ccc2cc(C[NH2+][C@@H](CCC[NH3+])c3ccccc3)ccc2c1 ZINC000415073841 1023427323 /nfs/dbraw/zinc/42/73/23/1023427323.db2.gz ZWKMZJQFIQZLMA-QFIPXVFZSA-N 2 0 334.463 4.418 20 0 EIADRP CC(C)c1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000656679286 1023427927 /nfs/dbraw/zinc/42/79/27/1023427927.db2.gz WYSYFEWHSZIFFY-GOSISDBHSA-N 2 0 344.543 4.352 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(Cl)cc1 ZINC000656683485 1023431232 /nfs/dbraw/zinc/43/12/32/1023431232.db2.gz MCMFIKVCUAORCP-INIZCTEOSA-N 2 0 343.902 4.298 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C1CCC([NH3+])CC1 ZINC000415082710 1023432508 /nfs/dbraw/zinc/43/25/08/1023432508.db2.gz OPAAKGIDWHYTTB-NVPAJSRCSA-N 2 0 329.513 4.347 20 0 EIADRP Cc1ccc(C)c([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000656682343 1023433924 /nfs/dbraw/zinc/43/39/24/1023433924.db2.gz BIZSZECUNRCVBH-IBGZPJMESA-N 2 0 337.511 4.261 20 0 EIADRP Brc1ccc([C@H]([NH2+][C@@H]2CCC[NH2+]CC2)C2CCC2)cc1 ZINC000415090351 1023434218 /nfs/dbraw/zinc/43/42/18/1023434218.db2.gz ZBMXOSARXIWCHD-IAGOWNOFSA-N 2 0 337.305 4.022 20 0 EIADRP CC(C)C[C@H](C[NH+]1CCC([C@H]2C[C@H]([NH3+])CCO2)CC1)c1ccccc1 ZINC000415120022 1023451476 /nfs/dbraw/zinc/45/14/76/1023451476.db2.gz GDEUWXOCDOFTQG-YPAWHYETSA-N 2 0 344.543 4.035 20 0 EIADRP Cc1nc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c(C)s1 ZINC000397532262 1023454239 /nfs/dbraw/zinc/45/42/39/1023454239.db2.gz ZZBGRGKTVSOJNU-HNNXBMFYSA-N 2 0 343.540 4.323 20 0 EIADRP [NH3+][C@@H]1CCO[C@H](C2CC[NH+](Cc3cccc(C4CCCC4)c3)CC2)C1 ZINC000656786181 1023527431 /nfs/dbraw/zinc/52/74/31/1023527431.db2.gz LWBYXUAVPOHDKZ-YADHBBJMSA-N 2 0 342.527 4.063 20 0 EIADRP c1sc(C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)nc1-c1ccccc1 ZINC000656784833 1023531216 /nfs/dbraw/zinc/53/12/16/1023531216.db2.gz HSQOAODBBXUUGG-SFHVURJKSA-N 2 0 341.524 4.022 20 0 EIADRP CO[C@H]1CCC[C@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)C1 ZINC000684374289 1023567020 /nfs/dbraw/zinc/56/70/20/1023567020.db2.gz NLOFBTMYSMEBLK-SFTDATJTSA-N 2 0 330.516 4.110 20 0 EIADRP C[C@]1(C[NH2+]Cc2ccc3cnccc3c2)CCCN1Cc1ccccc1 ZINC000397914469 1023588523 /nfs/dbraw/zinc/58/85/23/1023588523.db2.gz GAIIAFQKVGOVAD-HSZRJFAPSA-N 2 0 345.490 4.379 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccccc1Br ZINC000019915296 1023633994 /nfs/dbraw/zinc/63/39/94/1023633994.db2.gz GQLCHBVNWPKZDS-CQSZACIVSA-N 2 0 327.310 4.049 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CC2(SC)CC2)cc1C[NH+]1CCCCC1 ZINC000193820322 1023728332 /nfs/dbraw/zinc/72/83/32/1023728332.db2.gz DKEXFMJMWNYNMV-INIZCTEOSA-N 2 0 348.556 4.227 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CC2(SC)CC2)cc1C[NH+]1CCCCC1 ZINC000193820334 1023728669 /nfs/dbraw/zinc/72/86/69/1023728669.db2.gz DKEXFMJMWNYNMV-MRXNPFEDSA-N 2 0 348.556 4.227 20 0 EIADRP C[NH+](C)Cc1ccc(-c2ccccc2C[NH2+]C[C@H]2CCC=CO2)cc1 ZINC000194199845 1023751302 /nfs/dbraw/zinc/75/13/02/1023751302.db2.gz IRGMHYUVGCNBFZ-OAQYLSRUSA-N 2 0 336.479 4.198 20 0 EIADRP c1cncc([C@@H]2CCC[C@@H]([NH2+]C[C@H]3CCC[N@@H+]3C3CCCCC3)C2)c1 ZINC000500377308 1023765754 /nfs/dbraw/zinc/76/57/54/1023765754.db2.gz NZERMFBRINYJGQ-SYYKKAFVSA-N 2 0 341.543 4.495 20 0 EIADRP CSC1(C[NH2+][C@@H](CC(C)C)c2cccs2)CC[NH+](C)CC1 ZINC000581853967 1023772729 /nfs/dbraw/zinc/77/27/29/1023772729.db2.gz DZAZRDXIOUXBEC-HNNXBMFYSA-N 2 0 326.575 4.252 20 0 EIADRP CC[N@@H+]1CCC[C@@H](C[NH2+]C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000500420901 1023815153 /nfs/dbraw/zinc/81/51/53/1023815153.db2.gz LYNUFAJNEXCBOS-SFKKXYGYSA-N 2 0 340.433 4.430 20 0 EIADRP Fc1ccc(/C=C/C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000511784740 1023881513 /nfs/dbraw/zinc/88/15/13/1023881513.db2.gz HTRSVHHRMMMBJK-ZLHKHBAESA-N 2 0 342.433 4.090 20 0 EIADRP Cc1ccc2c(c1)[C@@H](N[C@@H]1C[C@H]3CC[C@@H](C1)[N@H+]3Cc1ccccc1)CO2 ZINC000581962208 1023937039 /nfs/dbraw/zinc/93/70/39/1023937039.db2.gz PLZIPDQNBSZQFV-KEZQHZCBSA-N 2 0 348.490 4.214 20 0 EIADRP c1c2cnccc2oc1C[NH2+]Cc1ccccc1C[NH+]1CCCCC1 ZINC000651669916 1024127896 /nfs/dbraw/zinc/12/78/96/1024127896.db2.gz NXUYLQLMLADYMT-UHFFFAOYSA-N 2 0 335.451 4.104 20 0 EIADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000510671959 1024209246 /nfs/dbraw/zinc/20/92/46/1024209246.db2.gz ROOZVPMIOSWFJY-RDJZCZTQSA-N 2 0 342.449 4.348 20 0 EIADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000510672779 1024209733 /nfs/dbraw/zinc/20/97/33/1024209733.db2.gz WPFWQDFMGVHMEQ-SFTDATJTSA-N 2 0 332.507 4.407 20 0 EIADRP FCCC[C@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000510699590 1024250772 /nfs/dbraw/zinc/25/07/72/1024250772.db2.gz CDTQHSACKKRAJB-MJGOQNOKSA-N 2 0 338.536 4.468 20 0 EIADRP CC(C)c1ccc(-c2ncc(C[NH+]3CCC([C@H](C)[NH3+])CC3)s2)cc1 ZINC000430953610 1024291446 /nfs/dbraw/zinc/29/14/46/1024291446.db2.gz UFLNWKYTAHPWOH-HNNXBMFYSA-N 2 0 343.540 4.493 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3cc(F)ccc32)c1 ZINC000341705148 1024354676 /nfs/dbraw/zinc/35/46/76/1024354676.db2.gz IRRVLOHIEYSTLB-NRFANRHFSA-N 2 0 326.459 4.445 20 0 EIADRP CC[C@H](c1ccc(Cl)cc1)[N@@H+]1CCC[C@H]([C@@H]2C[C@@H]([NH3+])CCO2)C1 ZINC000652347860 1024688829 /nfs/dbraw/zinc/68/88/29/1024688829.db2.gz NGVKBXAPAJGLOC-KANFNMMFSA-N 2 0 336.907 4.009 20 0 EIADRP C[C@H]([NH2+]C/C=C\c1ccc(F)c(F)c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000511909681 1024744993 /nfs/dbraw/zinc/74/49/93/1024744993.db2.gz FRJMJEVRSDFNCZ-VEVDHJHJSA-N 2 0 334.454 4.221 20 0 EIADRP c1cc(C2CC[NH+](Cc3ccc(C[NH+]4CCCCC4)cc3)CC2)no1 ZINC000662049167 1024835490 /nfs/dbraw/zinc/83/54/90/1024835490.db2.gz UBNAJYIRROVUTJ-UHFFFAOYSA-N 2 0 339.483 4.040 20 0 EIADRP FC(F)(F)C1CCC(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)CC1 ZINC000663346948 1025143629 /nfs/dbraw/zinc/14/36/29/1025143629.db2.gz YKKGRYCBZUZCRM-ARWYELJZSA-N 2 0 332.454 4.067 20 0 EIADRP C[C@@H](Cc1coc2ccccc12)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663466261 1025390866 /nfs/dbraw/zinc/39/08/66/1025390866.db2.gz QDVIOSJHQTXFLR-WMZOPIPTSA-N 2 0 326.484 4.075 20 0 EIADRP Clc1cccc(C2CC([NH2+]C[C@H]3CCC[N@H+](CC4CC4)C3)C2)c1 ZINC000663466628 1025398972 /nfs/dbraw/zinc/39/89/72/1025398972.db2.gz WDABFGAASSKFTG-PPDQVPDSSA-N 2 0 332.919 4.298 20 0 EIADRP c1cncc([C@@H]([NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)C2CCCCC2)c1 ZINC000663467017 1025402627 /nfs/dbraw/zinc/40/26/27/1025402627.db2.gz YZWZURYEBFPYEW-KNQAVFIVSA-N 2 0 341.543 4.415 20 0 EIADRP Cc1nc(C(C)C)sc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663470228 1025411671 /nfs/dbraw/zinc/41/16/71/1025411671.db2.gz TWWIHJDOQUGEGP-PBHICJAKSA-N 2 0 335.561 4.348 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2occc2c1 ZINC000511995493 1025596501 /nfs/dbraw/zinc/59/65/01/1025596501.db2.gz ABNDZKZARBUYFV-UWJYYQICSA-N 2 0 334.463 4.433 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2occc2c1 ZINC000511995491 1025599727 /nfs/dbraw/zinc/59/97/27/1025599727.db2.gz ABNDZKZARBUYFV-LAUBAEHRSA-N 2 0 334.463 4.433 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(COc2ccccc2)CC1 ZINC001167827435 1025656283 /nfs/dbraw/zinc/65/62/83/1025656283.db2.gz VZKFFTORHIINEZ-IBGZPJMESA-N 2 0 332.532 4.288 20 0 EIADRP c1cncc([C@@H]2CCC[C@H]([NH2+]C3CC[NH+](CC4CCCC4)CC3)C2)c1 ZINC000500449339 1025692107 /nfs/dbraw/zinc/69/21/07/1025692107.db2.gz YXMRQDFBHAFWKO-KNQAVFIVSA-N 2 0 341.543 4.352 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(SCC(F)F)cc1 ZINC000643546665 1025742958 /nfs/dbraw/zinc/74/29/58/1025742958.db2.gz SOYYRDPBUKCKKB-DZGCQCFKSA-N 2 0 340.483 4.369 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cc(COC)cs2)cc1 ZINC000657296833 1025763322 /nfs/dbraw/zinc/76/33/22/1025763322.db2.gz ILDCBSTWJUWJEW-UHFFFAOYSA-N 2 0 332.513 4.026 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000511045031 1025832122 /nfs/dbraw/zinc/83/21/22/1025832122.db2.gz RMTHQWIIJXLHSZ-QMEWPPBRSA-N 2 0 332.532 4.192 20 0 EIADRP CCC[C@H](C(=O)c1ccccc1)[N@H+](C)[C@H](C)CCC[NH+](CC)CC ZINC001167835293 1025836493 /nfs/dbraw/zinc/83/64/93/1025836493.db2.gz RBOJGSXQGMSUTF-UYAOXDASSA-N 2 0 332.532 4.480 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)CC1 ZINC000333775838 1025842307 /nfs/dbraw/zinc/84/23/07/1025842307.db2.gz CWUNLHYJFMYEOT-UYSNPLJNSA-N 2 0 327.497 4.047 20 0 EIADRP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccc(OC(F)F)cc1 ZINC000319773490 1025859358 /nfs/dbraw/zinc/85/93/58/1025859358.db2.gz FKIHICHZNXZGPQ-GJZGRUSLSA-N 2 0 326.431 4.203 20 0 EIADRP COc1ccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)C2CC2)cc1 ZINC001167967032 1025863724 /nfs/dbraw/zinc/86/37/24/1025863724.db2.gz AGYCZDFQRQWZMC-GFSYIJCISA-N 2 0 340.511 4.141 20 0 EIADRP CCC[C@@H]([NH2+]CC1(N2CCCCC2)CC[NH+](C)CC1)c1ccsc1 ZINC000187737347 1025889859 /nfs/dbraw/zinc/88/98/59/1025889859.db2.gz VQXBWMPESUJNQN-LJQANCHMSA-N 2 0 349.588 4.129 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](Cc1cc(C)no1)Cc1ccccc1 ZINC001167841998 1025893173 /nfs/dbraw/zinc/89/31/73/1025893173.db2.gz VNSWKQRDVBZVTP-IBGZPJMESA-N 2 0 343.515 4.496 20 0 EIADRP FC1(F)CCCC[C@H]1C[NH2+]C1CC[NH+](CCc2ccccc2)CC1 ZINC000390919441 1025898500 /nfs/dbraw/zinc/89/85/00/1025898500.db2.gz WEYPNTXOXWLJLP-SFHVURJKSA-N 2 0 336.470 4.109 20 0 EIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@@H](CC2CCC2)c2ccccc2)CCCO1 ZINC000432421194 1025902794 /nfs/dbraw/zinc/90/27/94/1025902794.db2.gz OKJFVISBYQILHB-NQIIRXRSSA-N 2 0 330.516 4.008 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]CCC1CC[NH+](C)CC1 ZINC000431334984 1025971844 /nfs/dbraw/zinc/97/18/44/1025971844.db2.gz USQBVZZTVURFEG-FQEVSTJZSA-N 2 0 330.516 4.345 20 0 EIADRP COc1ccc2c(c1F)CC[C@H]2[NH2+]CC1CC[NH+](CCC(C)C)CC1 ZINC000582085446 1026113158 /nfs/dbraw/zinc/11/31/58/1026113158.db2.gz IAZGPWSYDMXCSU-LJQANCHMSA-N 2 0 348.506 4.169 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc2ccccc2o1 ZINC000048683748 1026155399 /nfs/dbraw/zinc/15/53/99/1026155399.db2.gz OXMZUQQQGQNUNW-MRXNPFEDSA-N 2 0 338.451 4.224 20 0 EIADRP Fc1cccc(C2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CCC2)c1 ZINC001167975250 1026236804 /nfs/dbraw/zinc/23/68/04/1026236804.db2.gz MYXHHHRAVJUBLC-IHWFROFDSA-N 2 0 328.475 4.200 20 0 EIADRP Cc1nc2c(s1)[C@@H]([NH2+]Cc1ccc(C[NH+]3CCCC3)cc1)CCC2 ZINC000162930492 1026330287 /nfs/dbraw/zinc/33/02/87/1026330287.db2.gz NTJRAMOGRJNWEP-SFHVURJKSA-N 2 0 341.524 4.215 20 0 EIADRP COc1ccccc1[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)C1CC1 ZINC001167978515 1026346426 /nfs/dbraw/zinc/34/64/26/1026346426.db2.gz NXWHZVOACNHSOT-MFXLTOHQSA-N 2 0 340.511 4.141 20 0 EIADRP c1cc2c(cc[nH+]c2N2CCC3(CC[N@@H+](Cc4ccccc4)C3)CC2)[nH]1 ZINC000663753217 1026401079 /nfs/dbraw/zinc/40/10/79/1026401079.db2.gz DZVGKVYGLNXVJA-UHFFFAOYSA-N 2 0 346.478 4.055 20 0 EIADRP C[NH+](C)CC1CC[NH+](Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000506880039 1026483526 /nfs/dbraw/zinc/48/35/26/1026483526.db2.gz GQPULFPSGQREIQ-UHFFFAOYSA-N 2 0 332.488 4.328 20 0 EIADRP CCCOc1cc(C[NH+]2CCC(C[NH+](CC)CC)CC2)ccc1OC ZINC000506883415 1026487010 /nfs/dbraw/zinc/48/70/10/1026487010.db2.gz GBLZRFFZBHMLJJ-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cnc(-c3ccc(C)o3)s2)CC1 ZINC000506908025 1026505089 /nfs/dbraw/zinc/50/50/89/1026505089.db2.gz JLDSCYIZWRZTAS-UHFFFAOYSA-N 2 0 347.528 4.265 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]C[C@@H]3CC[N@@H+](C4CC4)C3)cs2)cs1 ZINC000152425120 1026544140 /nfs/dbraw/zinc/54/41/40/1026544140.db2.gz JGYSWIYSQSFGFW-JSGCOSHPSA-N 2 0 347.553 4.315 20 0 EIADRP C[C@H]1CCC[C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000344727620 1026564104 /nfs/dbraw/zinc/56/41/04/1026564104.db2.gz TXNPLRQIFYMZTI-PZJWPPBQSA-N 2 0 344.543 4.226 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+]CC(Cc2ccccc2)Cc2ccccc2)C1 ZINC000582457712 1026666803 /nfs/dbraw/zinc/66/68/03/1026666803.db2.gz BHZWWKYVCGKOFB-QFIPXVFZSA-N 2 0 336.523 4.019 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC(c2ccnc3ccccc32)CC1 ZINC000563361629 1026668211 /nfs/dbraw/zinc/66/82/11/1026668211.db2.gz NFENYKNYZVPLFB-IBGZPJMESA-N 2 0 337.511 4.289 20 0 EIADRP C[N@@H+]1CCC[C@@H]1CC[NH+]1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511148321 1026750394 /nfs/dbraw/zinc/75/03/94/1026750394.db2.gz XOKFCLNKPINFAN-FUHWJXTLSA-N 2 0 340.433 4.369 20 0 EIADRP COc1ccccc1[C@@H](CNc1cc[nH+]c2cc(F)ccc12)[NH+](C)C ZINC000500469268 1026774660 /nfs/dbraw/zinc/77/46/60/1026774660.db2.gz POYAANXGJBHKKN-LJQANCHMSA-N 2 0 339.414 4.097 20 0 EIADRP C[C@@H](Cc1c(Cl)cccc1Cl)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000507443723 1026795356 /nfs/dbraw/zinc/79/53/56/1026795356.db2.gz NFGRFAPXHQGHHJ-ZDUSSCGKSA-N 2 0 329.315 4.246 20 0 EIADRP C[C@@H]([NH2+]CCCOCCc1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000342479097 1026803017 /nfs/dbraw/zinc/80/30/17/1026803017.db2.gz LGDMEGHNJHCKFG-LJQANCHMSA-N 2 0 349.478 4.172 20 0 EIADRP c1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH2+][C@@H](c4cccnc4)C4CC4)[C@H]3C2)cc1 ZINC000507463486 1026804312 /nfs/dbraw/zinc/80/43/12/1026804312.db2.gz UCGSBTBJCOGUAY-CWBXHPNXSA-N 2 0 347.506 4.033 20 0 EIADRP CCC1(C[NH2+][C@H](C)[C@H]2CCCOC2)CC[NH+](Cc2ccccc2)CC1 ZINC000507472643 1026807502 /nfs/dbraw/zinc/80/75/02/1026807502.db2.gz RKXUIMNHSFQEMC-CTNGQTDRSA-N 2 0 344.543 4.084 20 0 EIADRP CCN1CCC([NH2+][C@@H](C)c2ccc(SC(F)F)c(OC)c2)CC1 ZINC000159316421 1026810356 /nfs/dbraw/zinc/81/03/56/1026810356.db2.gz NRWXODRRGURMJH-LBPRGKRZSA-N 2 0 344.471 4.145 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1)[C@@H]1CCCOC1 ZINC000507511130 1026822073 /nfs/dbraw/zinc/82/20/73/1026822073.db2.gz NXBRGJSJWCKNGF-GHTZIAJQSA-N 2 0 344.543 4.356 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+][C@@H]2CCCc3cccnc32)C1 ZINC000684953664 1026889100 /nfs/dbraw/zinc/88/91/00/1026889100.db2.gz QQSJSTXCMJWDET-PGRDOPGGSA-N 2 0 349.522 4.481 20 0 EIADRP C[C@H](CC1CCCC1)[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000519651143 1026940759 /nfs/dbraw/zinc/94/07/59/1026940759.db2.gz DIHWLNVPMGGXMW-QGZVFWFLSA-N 2 0 330.516 4.218 20 0 EIADRP CC(C)C[C@@H]1CCC[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C1 ZINC000657538370 1026995315 /nfs/dbraw/zinc/99/53/15/1026995315.db2.gz ZQPKXSXOLNFLLZ-VQTJNVASSA-N 2 0 336.564 4.072 20 0 EIADRP C[C@@H](c1ccc(C(F)(F)F)cc1)[NH+]1CCC([C@H]2CC[NH2+]C2)CC1 ZINC000582726339 1027016878 /nfs/dbraw/zinc/01/68/78/1027016878.db2.gz XRZUSKMUBSEXMU-BBRMVZONSA-N 2 0 326.406 4.088 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000474477200 1027110700 /nfs/dbraw/zinc/11/07/00/1027110700.db2.gz RCBBSSSKCCLRQH-QRVBRYPASA-N 2 0 332.532 4.431 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@@H](C)[C@@H](C)c2ccc(OC)c(OC)c2)CC1 ZINC000474614532 1027312537 /nfs/dbraw/zinc/31/25/37/1027312537.db2.gz WVNCGQDHBATZNY-SJORKVTESA-N 2 0 348.531 4.050 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2ncc(-c3ccc(C)cc3)o2)CC1 ZINC000441185033 1027351563 /nfs/dbraw/zinc/35/15/63/1027351563.db2.gz ROIUEXJTMCNAJM-UHFFFAOYSA-N 2 0 341.499 4.204 20 0 EIADRP Clc1ccc(CCC[N@@H+]2CC[C@H]3[C@H](CCCN3C3CC3)C2)cc1 ZINC000441410723 1027528128 /nfs/dbraw/zinc/52/81/28/1027528128.db2.gz LTMXLAKPEYUKPX-XLIONFOSSA-N 2 0 332.919 4.221 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CCSc3ccccc32)ccc1F ZINC000120866006 1027604651 /nfs/dbraw/zinc/60/46/51/1027604651.db2.gz RWWXIIGBBOVGBV-SFHVURJKSA-N 2 0 330.472 4.214 20 0 EIADRP CC(C)O[C@H](C[NH+]1CCC(Nc2ccccn2)CC1)c1ccccc1 ZINC000582941085 1027720581 /nfs/dbraw/zinc/72/05/81/1027720581.db2.gz HZDSMLXJAHKUEK-HXUWFJFHSA-N 2 0 339.483 4.124 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](C1CC1)N(C)Cc1ccccc1)C1CCSCC1 ZINC000474921571 1027802924 /nfs/dbraw/zinc/80/29/24/1027802924.db2.gz DAXZWKCQAKUHSH-UZLBHIALSA-N 2 0 332.557 4.018 20 0 EIADRP COc1ccc([C@@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167995748 1027807777 /nfs/dbraw/zinc/80/77/77/1027807777.db2.gz PORMFVUPRTVAIQ-CZJMCEMMSA-N 2 0 340.511 4.238 20 0 EIADRP C[NH+](C)CC1CCC([NH2+]CCCc2c(F)cccc2Cl)CC1 ZINC000574635198 1027825700 /nfs/dbraw/zinc/82/57/00/1027825700.db2.gz AMNQMEVXYYKWCY-UHFFFAOYSA-N 2 0 326.887 4.122 20 0 EIADRP FC(F)(F)c1cccc([C@@H]2CC[N@H+](CCC[NH+]3CCCCC3)C2)c1 ZINC000444608399 1027888373 /nfs/dbraw/zinc/88/83/73/1027888373.db2.gz KZMSAEGABOJFSG-QGZVFWFLSA-N 2 0 340.433 4.371 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000583075301 1027958151 /nfs/dbraw/zinc/95/81/51/1027958151.db2.gz KYYIZIWXBXPKAG-QGZVFWFLSA-N 2 0 330.516 4.391 20 0 EIADRP C[C@@H](Cc1ccco1)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000796682290 1027979280 /nfs/dbraw/zinc/97/92/80/1027979280.db2.gz IDVIPCINMNUIFJ-KKXNLOMOSA-N 2 0 326.484 4.243 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cccc(OC(F)F)c1 ZINC000123642026 1028082035 /nfs/dbraw/zinc/08/20/35/1028082035.db2.gz CZBHVBLVLJKSBB-AWEZNQCLSA-N 2 0 334.410 4.200 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+]Cc2cccc(OCc3ccccc3)c2)CC1 ZINC000394428767 1028106514 /nfs/dbraw/zinc/10/65/14/1028106514.db2.gz AAKJEAIBIJSLFL-UHFFFAOYSA-N 2 0 338.495 4.087 20 0 EIADRP CC1(C)CC([NH2+]Cc2ccc(OCC(F)(F)F)cc2)CC(C)(C)[NH2+]1 ZINC000073458059 1028115642 /nfs/dbraw/zinc/11/56/42/1028115642.db2.gz FEBZOECNQIXUJM-UHFFFAOYSA-N 2 0 344.421 4.027 20 0 EIADRP c1ccc2c(c1)cccc2OCCC[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000523556991 1028210716 /nfs/dbraw/zinc/21/07/16/1028210716.db2.gz XFYDAWBKHMEDBN-IBGZPJMESA-N 2 0 338.495 4.026 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@H](c2ccccc2)CC1 ZINC000346143613 1028278423 /nfs/dbraw/zinc/27/84/23/1028278423.db2.gz DVCWYVKNDOLQGY-FQEVSTJZSA-N 2 0 346.478 4.345 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1cncs1 ZINC000125067932 1028344325 /nfs/dbraw/zinc/34/43/25/1028344325.db2.gz LEZAKWISBRUHIF-INIZCTEOSA-N 2 0 329.513 4.370 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CC[C@@H](C)[NH+]2CCCCC2)cc1 ZINC000346870253 1028803296 /nfs/dbraw/zinc/80/32/96/1028803296.db2.gz LSLLFWLRJBCPSN-QZTJIDSGSA-N 2 0 340.515 4.096 20 0 EIADRP COc1ccc2cc(C[NH2+]C[C@H](C)C[NH+]3CCCCC3)ccc2c1 ZINC000324441267 1029048836 /nfs/dbraw/zinc/04/88/36/1029048836.db2.gz FCMZZBGTQGTKBO-KRWDZBQOSA-N 2 0 326.484 4.060 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000650746866 1029084275 /nfs/dbraw/zinc/08/42/75/1029084275.db2.gz MNALQMLXXLUXDH-HZPDHXFCSA-N 2 0 326.406 4.060 20 0 EIADRP Cc1nc(C(C)C)oc1CN[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C ZINC000428430029 1029127060 /nfs/dbraw/zinc/12/70/60/1029127060.db2.gz GUEYEGXSAWATCT-VQIMIIECSA-N 2 0 341.499 4.107 20 0 EIADRP CCC[N@@H+]1CC[C@H](CN[C@@H](C)c2nc(-c3ccccc3)cs2)C1 ZINC000151136369 1029144148 /nfs/dbraw/zinc/14/41/48/1029144148.db2.gz QVDJXEVDCKRJMK-JKSUJKDBSA-N 2 0 329.513 4.193 20 0 EIADRP Cc1nc(F)ccc1C[NH2+]Cc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000278421067 1029180650 /nfs/dbraw/zinc/18/06/50/1029180650.db2.gz QQHLCPAHPMNYGL-INIZCTEOSA-N 2 0 341.474 4.051 20 0 EIADRP C[NH2+]Cc1ccc(NC2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)cc1 ZINC001168055390 1029199152 /nfs/dbraw/zinc/19/91/52/1029199152.db2.gz VOZZBDGHKIJRMF-QZTJIDSGSA-N 2 0 337.511 4.260 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2noc3ccccc32)CC1 ZINC000583822823 1029231806 /nfs/dbraw/zinc/23/18/06/1029231806.db2.gz YCNYOQNTEAKJRV-UHFFFAOYSA-N 2 0 349.478 4.361 20 0 EIADRP C[C@H]([NH2+]CCC1CC[NH2+]CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000650763502 1029275291 /nfs/dbraw/zinc/27/52/91/1029275291.db2.gz BZTGIUMODCYJLJ-ZDUSSCGKSA-N 2 0 346.462 4.381 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CCC1CC[NH2+]CC1 ZINC000650764228 1029278759 /nfs/dbraw/zinc/27/87/59/1029278759.db2.gz TZSGLZVIQSTKBT-HNNXBMFYSA-N 2 0 343.540 4.467 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H]1CCCc2occc21 ZINC000192682970 1029362391 /nfs/dbraw/zinc/36/23/91/1029362391.db2.gz JXAGIUWJKOGBJE-LJQANCHMSA-N 2 0 342.483 4.167 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+]([C@H](C)c2ncc(-c3ccccc3)o2)CC1 ZINC000524991501 1029385066 /nfs/dbraw/zinc/38/50/66/1029385066.db2.gz ZRVDTETYGCHDMI-QGZVFWFLSA-N 2 0 341.499 4.455 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+][C@H]3CCCc4occc43)CC2)c1 ZINC000192783859 1029386365 /nfs/dbraw/zinc/38/63/65/1029386365.db2.gz KIJZSSPPYCHPAX-SFHVURJKSA-N 2 0 330.497 4.220 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)CCS2 ZINC000343507362 1029396291 /nfs/dbraw/zinc/39/62/91/1029396291.db2.gz OSBHINNBIIFORX-LJQANCHMSA-N 2 0 348.556 4.334 20 0 EIADRP Cc1ccc2[nH]c(C[NH2+]C[C@@H]3CC[N@H+](Cc4ccccc4)C3)cc2c1C ZINC000475225763 1029447955 /nfs/dbraw/zinc/44/79/55/1029447955.db2.gz VJEQLMXRAWTJLB-FQEVSTJZSA-N 2 0 347.506 4.396 20 0 EIADRP C[C@@H]1[C@H]([NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C[C@@H]1c1ccccc1 ZINC000475278835 1029484836 /nfs/dbraw/zinc/48/48/36/1029484836.db2.gz XFRGCHVCJFGVPL-UZVYXBEXSA-N 2 0 334.507 4.290 20 0 EIADRP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)CS1 ZINC000475291259 1029503999 /nfs/dbraw/zinc/50/39/99/1029503999.db2.gz NRATXTNUWIULCC-QRVBRYPASA-N 2 0 332.557 4.018 20 0 EIADRP C[C@@H]1C[C@@H](NCc2cc(Cl)ccc2OC2CCCC2)CC[N@@H+]1C ZINC000525207850 1029513937 /nfs/dbraw/zinc/51/39/37/1029513937.db2.gz RFDBKVYVIQJXKK-PBHICJAKSA-N 2 0 336.907 4.234 20 0 EIADRP C[C@H]1CC([N@H+](C)CC2CC(F)(F)C2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168063901 1029617172 /nfs/dbraw/zinc/61/71/72/1029617172.db2.gz NUYPBONUNMUUME-HOTGVXAUSA-N 2 0 336.470 4.405 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2ncc(-c3ccccc3F)o2)CC1 ZINC000525633536 1029716031 /nfs/dbraw/zinc/71/60/31/1029716031.db2.gz ZUMQIYBLVDESFT-UHFFFAOYSA-N 2 0 345.462 4.035 20 0 EIADRP CC[NH+]1CCC(Nc2cc(C)[nH+]c3ccc(OC(F)F)cc23)CC1 ZINC000301377936 1029720419 /nfs/dbraw/zinc/72/04/19/1029720419.db2.gz XBQXMCLMMLNBGZ-UHFFFAOYSA-N 2 0 335.398 4.041 20 0 EIADRP CCc1cc(NC2CC[NH+](CCOC(C)C)CC2)c2ccccc2[nH+]1 ZINC000301779372 1029807493 /nfs/dbraw/zinc/80/74/93/1029807493.db2.gz ICZBFCRFMCYCQK-UHFFFAOYSA-N 2 0 341.499 4.099 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCc2ccc(F)cc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000089552503 1029854635 /nfs/dbraw/zinc/85/46/35/1029854635.db2.gz BKFSJGVMIRCNBW-YCRPNKLZSA-N 2 0 342.458 4.104 20 0 EIADRP FCC1(CF)CC([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)C1 ZINC000657860657 1029858256 /nfs/dbraw/zinc/85/82/56/1029858256.db2.gz BNWHJXUXMZIVOX-UHFFFAOYSA-N 2 0 336.470 4.240 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000091335687 1029884559 /nfs/dbraw/zinc/88/45/59/1029884559.db2.gz FZTJSTWUJDVXQW-CXAGYDPISA-N 2 0 326.406 4.088 20 0 EIADRP FC(F)c1ccc(C[NH2+]C[C@@H]2CCCN2Cc2ccccc2)cc1 ZINC000390550048 1029957635 /nfs/dbraw/zinc/95/76/35/1029957635.db2.gz BUNJQLSWNZDWGS-IBGZPJMESA-N 2 0 330.422 4.378 20 0 EIADRP C[C@@H](CCc1ccco1)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447522308 1030118358 /nfs/dbraw/zinc/11/83/58/1030118358.db2.gz QDISWBXQPROLSE-WJMWBRGCSA-N 2 0 338.495 4.386 20 0 EIADRP COc1ccc2oc([C@H](C)[NH2+]CC3CC[NH+](C4CC4)CC3)c(C)c2c1 ZINC000447570920 1030154740 /nfs/dbraw/zinc/15/47/40/1030154740.db2.gz IDSPDRCFNIEKOA-HNNXBMFYSA-N 2 0 342.483 4.275 20 0 EIADRP Clc1cccc2c1OCCC[C@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447574759 1030161170 /nfs/dbraw/zinc/16/11/70/1030161170.db2.gz WPXMBVXIOCSOJZ-GOSISDBHSA-N 2 0 334.891 4.018 20 0 EIADRP C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+][C@H]1CCCSCC1 ZINC000657886229 1030205424 /nfs/dbraw/zinc/20/54/24/1030205424.db2.gz DAPARUZNSYJASG-IBGZPJMESA-N 2 0 344.524 4.287 20 0 EIADRP C[C@H](c1ccc(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cc1)C(F)(F)F ZINC000451066192 1030220136 /nfs/dbraw/zinc/22/01/36/1030220136.db2.gz BTWDZOIDUNLJKO-QAPCUYQASA-N 2 0 340.433 4.270 20 0 EIADRP C[NH+](C)CCC1CC[NH+](CCCc2c(F)cccc2Cl)CC1 ZINC000447735130 1030312295 /nfs/dbraw/zinc/31/22/95/1030312295.db2.gz BSOCOBHTJZRKNX-UHFFFAOYSA-N 2 0 326.887 4.075 20 0 EIADRP COc1cc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)ccc1C ZINC000447820569 1030341278 /nfs/dbraw/zinc/34/12/78/1030341278.db2.gz GNDNPUKBGYWRIA-UHFFFAOYSA-N 2 0 344.524 4.067 20 0 EIADRP Cn1cncc1CC[NH2+][C@@H](c1ccc(F)cc1)c1ccccc1Cl ZINC000530407242 1030379756 /nfs/dbraw/zinc/37/97/56/1030379756.db2.gz HQWGSLWKQFATRS-IBGZPJMESA-N 2 0 343.833 4.134 20 0 EIADRP FCC1CC[NH+](Cc2ccccc2C[NH+]2CCC(CF)CC2)CC1 ZINC000451394832 1030462714 /nfs/dbraw/zinc/46/27/14/1030462714.db2.gz PMSDIDPUEDSALU-UHFFFAOYSA-N 2 0 336.470 4.050 20 0 EIADRP C[NH+]1CCC2(CCC[N@@H+]2Cc2cnc(C3CCCCC3)s2)CC1 ZINC000530547860 1030524516 /nfs/dbraw/zinc/52/45/16/1030524516.db2.gz NGWGJUAWXYZJII-UHFFFAOYSA-N 2 0 333.545 4.251 20 0 EIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1 ZINC000527232756 1030587634 /nfs/dbraw/zinc/58/76/34/1030587634.db2.gz NULCXCHTZSDAFQ-ZWKOTPCHSA-N 2 0 344.543 4.431 20 0 EIADRP Cc1c([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)cnn1C(C)C ZINC000191391665 1030622842 /nfs/dbraw/zinc/62/28/42/1030622842.db2.gz DAJDFODZCODJPB-QHGAOEGBSA-N 2 0 346.563 4.466 20 0 EIADRP C[C@@H]([NH2+]CCCCOc1ccccc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000527354934 1030664483 /nfs/dbraw/zinc/66/44/83/1030664483.db2.gz OAFPUEYSCGKFCQ-MOPGFXCFSA-N 2 0 330.516 4.088 20 0 EIADRP Cc1cc(F)ccc1C[NH2+][C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000398051034 1030694242 /nfs/dbraw/zinc/69/42/42/1030694242.db2.gz XSMZPGYZINEKAE-UWJYYQICSA-N 2 0 326.459 4.134 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H]2CCC[C@H](c3ccccc3)CC2)CC1 ZINC000527652802 1030811871 /nfs/dbraw/zinc/81/18/71/1030811871.db2.gz LGZYZEVBYSWGAM-LEWJYISDSA-N 2 0 344.543 4.193 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)[C@H]1CCCC[C@H]1C ZINC000658164165 1030860056 /nfs/dbraw/zinc/86/00/56/1030860056.db2.gz MUAAOPDCAGWDCV-OPYAIIAOSA-N 2 0 329.532 4.098 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(C)cc1 ZINC000658166872 1030863378 /nfs/dbraw/zinc/86/33/78/1030863378.db2.gz QJKYHQZQQQYOLX-JOCHJYFZSA-N 2 0 337.511 4.343 20 0 EIADRP C[C@@H]1CCc2ccccc2[C@H]1[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658167695 1030864022 /nfs/dbraw/zinc/86/40/22/1030864022.db2.gz SZIMGQNHDXHXBD-JPYJTQIMSA-N 2 0 349.522 4.207 20 0 EIADRP CC(C)[C@@H]1CCCC[C@H]1[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658168344 1030866736 /nfs/dbraw/zinc/86/67/36/1030866736.db2.gz WFJMFANYZRDFMI-LEWJYISDSA-N 2 0 329.532 4.098 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c2ccccc21 ZINC000658168413 1030866806 /nfs/dbraw/zinc/86/68/06/1030866806.db2.gz WVNFJHVNUUIYHA-VGSWGCGISA-N 2 0 335.495 4.132 20 0 EIADRP c1ccc([C@@H](C[C@@H]2CCOC2)[NH2+]CCCCC[NH+]2CCCCC2)cc1 ZINC000166594972 1030884641 /nfs/dbraw/zinc/88/46/41/1030884641.db2.gz VMAXPOIJGGTOKK-RBBKRZOGSA-N 2 0 344.543 4.400 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC[C@]2(C)CC2(F)F)CC1 ZINC000658220208 1030884970 /nfs/dbraw/zinc/88/49/70/1030884970.db2.gz KNETZZVOTAPNIG-QFBILLFUSA-N 2 0 336.470 4.107 20 0 EIADRP Cc1ccncc1[C@H](C)[NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2 ZINC000658320002 1030979400 /nfs/dbraw/zinc/97/94/00/1030979400.db2.gz LPPXBLLDTCDEFJ-PZJWPPBQSA-N 2 0 349.522 4.343 20 0 EIADRP c1ccc(C[N@H+]2C[C@H](C[NH2+][C@@H]3CCCSCC3)C3(CCC3)C2)cc1 ZINC000658318856 1030981559 /nfs/dbraw/zinc/98/15/59/1030981559.db2.gz SYJIGFXSIYEVLD-VQTJNVASSA-N 2 0 344.568 4.164 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](CC)CC1)c1ccc(Br)cc1 ZINC000044517274 1031111113 /nfs/dbraw/zinc/11/11/13/1031111113.db2.gz CVJFACUMDHNPKS-QGZVFWFLSA-N 2 0 339.321 4.222 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(OCc3ccccc3)cc2)[C@H](C)C1 ZINC000532459606 1031111293 /nfs/dbraw/zinc/11/12/93/1031111293.db2.gz MDFXGJZBQIDVMJ-GCJKJVERSA-N 2 0 338.495 4.086 20 0 EIADRP CCCC[N@H+](C)CC1CCN(Cc2cccnc2C(F)(F)F)CC1 ZINC000528356362 1031428296 /nfs/dbraw/zinc/42/82/96/1031428296.db2.gz QWKDMOVGMKFCJS-UHFFFAOYSA-N 2 0 343.437 4.044 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CC[NH+]1CCC(c2nc3ccccc3s2)CC1 ZINC000531614317 1031430054 /nfs/dbraw/zinc/43/00/54/1031430054.db2.gz BSAZSHKFOBXINT-KRWDZBQOSA-N 2 0 343.540 4.350 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@H]2CCOC3(CCC3)C2)cc1 ZINC000449080391 1031434238 /nfs/dbraw/zinc/43/42/38/1031434238.db2.gz VTTAYHOTQNXRDC-RXVVDRJESA-N 2 0 342.527 4.252 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2CCCOc3c(Cl)cccc32)c1 ZINC000123616297 1031474239 /nfs/dbraw/zinc/47/42/39/1031474239.db2.gz ORRVCZDDZQUFDO-LJQANCHMSA-N 2 0 344.886 4.405 20 0 EIADRP C[C@H](NC1(C[NH2+][C@@H]2CCOC3(CCC3)C2)CCCC1)c1ccccc1 ZINC000449154730 1031485289 /nfs/dbraw/zinc/48/52/89/1031485289.db2.gz JJLDQHRMQUNESO-AZUAARDMSA-N 2 0 342.527 4.341 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](CN[C@@H](C)c2sccc2Br)C1 ZINC000531702765 1031488677 /nfs/dbraw/zinc/48/86/77/1031488677.db2.gz WGUHFPFAIGUXIU-STQMWFEESA-N 2 0 345.350 4.282 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)cc1C ZINC000531705041 1031489012 /nfs/dbraw/zinc/48/90/12/1031489012.db2.gz WNMDKGRFIDXMOF-IBGZPJMESA-N 2 0 340.511 4.485 20 0 EIADRP C[C@@H](Cc1ccncc1)[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449171455 1031491566 /nfs/dbraw/zinc/49/15/66/1031491566.db2.gz KOCXTUILDTVHOL-KRWDZBQOSA-N 2 0 331.548 4.281 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]Cc1ccc(OC2CCCCC2)cc1 ZINC000531708617 1031493396 /nfs/dbraw/zinc/49/33/96/1031493396.db2.gz VUPLVKCBIUSEEW-CBGDNZLLSA-N 2 0 330.516 4.216 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCCc3cc(OC)ccc32)c1 ZINC000123983373 1031496708 /nfs/dbraw/zinc/49/67/08/1031496708.db2.gz REQCLAOAXXXZQI-QFIPXVFZSA-N 2 0 338.495 4.314 20 0 EIADRP c1ccc(C[NH+]2CCC(OCCC[NH2+]C[C@H]3CC=CCC3)CC2)cc1 ZINC000124300078 1031519660 /nfs/dbraw/zinc/51/96/60/1031519660.db2.gz WJQXPXYHXLXDGB-FQEVSTJZSA-N 2 0 342.527 4.004 20 0 EIADRP C[C@@H](Cc1coc2ccccc12)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000449185277 1031523686 /nfs/dbraw/zinc/52/36/86/1031523686.db2.gz NPPBJYBNMSJUCB-INIZCTEOSA-N 2 0 326.484 4.360 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1cc(-c2ccccc2)nn1C ZINC000453067203 1031530601 /nfs/dbraw/zinc/53/06/01/1031530601.db2.gz YVKUSOHWJMQNMW-ZWKOTPCHSA-N 2 0 342.531 4.248 20 0 EIADRP C[C@H]([NH2+]C1CCC(OC2CCCC2)CC1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000449231326 1031562443 /nfs/dbraw/zinc/56/24/43/1031562443.db2.gz DGUQYEXVNBSWJX-KHKYRLRFSA-N 2 0 348.575 4.499 20 0 EIADRP C[C@H](Cc1coc2ccccc12)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000449253700 1031569414 /nfs/dbraw/zinc/56/94/14/1031569414.db2.gz ULRHAEYMOANIKG-QGZVFWFLSA-N 2 0 349.478 4.265 20 0 EIADRP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)CCCc2cccnc2)c1 ZINC000453098349 1031593249 /nfs/dbraw/zinc/59/32/49/1031593249.db2.gz XHIGYEBIOYJSFV-IBGZPJMESA-N 2 0 339.527 4.423 20 0 EIADRP CCOc1ccccc1C[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000065976617 1031638933 /nfs/dbraw/zinc/63/89/33/1031638933.db2.gz FPMNZFZFAMXKGL-UHFFFAOYSA-N 2 0 326.484 4.215 20 0 EIADRP c1ccc2c(c1)SC[C@@H]2C[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000449366932 1031661050 /nfs/dbraw/zinc/66/10/50/1031661050.db2.gz SZXGDHGISHSKSK-INIZCTEOSA-N 2 0 330.541 4.263 20 0 EIADRP CC(C)c1nn(-c2ccccc2)cc1C[NH2+]C(C)(C)CCC[NH+](C)C ZINC000449526197 1031823684 /nfs/dbraw/zinc/82/36/84/1031823684.db2.gz DEBOVGFQJBRCJY-UHFFFAOYSA-N 2 0 342.531 4.206 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)C1CCOCC1 ZINC000531947152 1031858629 /nfs/dbraw/zinc/85/86/29/1031858629.db2.gz HNGSHGJGTZTUDG-PGRDOPGGSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@H](C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C)c1c(Cl)cccc1Cl ZINC000531963662 1031884285 /nfs/dbraw/zinc/88/42/85/1031884285.db2.gz LNNLFEFSMYYNES-LMOYCYGVSA-N 2 0 329.315 4.415 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453389396 1031898223 /nfs/dbraw/zinc/89/82/23/1031898223.db2.gz CGRHHUOIUCUYQA-AWEZNQCLSA-N 2 0 328.422 4.100 20 0 EIADRP CCC[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000531972394 1031908773 /nfs/dbraw/zinc/90/87/73/1031908773.db2.gz OBLIUZGOOVTXOM-WMLDXEAASA-N 2 0 328.422 4.478 20 0 EIADRP CCC[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000531972392 1031909948 /nfs/dbraw/zinc/90/99/48/1031909948.db2.gz OBLIUZGOOVTXOM-PBHICJAKSA-N 2 0 328.422 4.478 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1cc(F)c(F)c(F)c1 ZINC000531973137 1031911891 /nfs/dbraw/zinc/91/18/91/1031911891.db2.gz TTWNDXNLNODWES-CQSZACIVSA-N 2 0 328.422 4.411 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2ccc(Br)cc2)CC1 ZINC000531980675 1031924800 /nfs/dbraw/zinc/92/48/00/1031924800.db2.gz SGPUQZZOAWTDCJ-CQSZACIVSA-N 2 0 339.321 4.222 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]C[C@@H](Cc1ccccc1)c1ccccc1 ZINC000531993769 1031959998 /nfs/dbraw/zinc/95/99/98/1031959998.db2.gz LEIBZYUZJOKJCW-NNLJWKLDSA-N 2 0 336.523 4.331 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000453393766 1031960237 /nfs/dbraw/zinc/96/02/37/1031960237.db2.gz GHAMIVATZACCES-AEGPPILISA-N 2 0 326.937 4.358 20 0 EIADRP C[C@H]1CCCC[C@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000531994306 1031962592 /nfs/dbraw/zinc/96/25/92/1031962592.db2.gz UPQSPABHJAUTHG-SIKLNZKXSA-N 2 0 344.543 4.226 20 0 EIADRP COc1ccc2oc([C@H](C)[NH2+]CCCC[N@H+](C)C3CC3)c(C)c2c1 ZINC000453419328 1031975013 /nfs/dbraw/zinc/97/50/13/1031975013.db2.gz YUHNVSKYXOPYOG-HNNXBMFYSA-N 2 0 330.472 4.275 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(Br)cc1F ZINC000453420112 1031976367 /nfs/dbraw/zinc/97/63/67/1031976367.db2.gz ZDVMRTBSCIFKOC-GFCCVEGCSA-N 2 0 343.284 4.113 20 0 EIADRP Clc1ccc2c(c1Cl)CC[C@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000152482440 1031986558 /nfs/dbraw/zinc/98/65/58/1031986558.db2.gz VEJXYTHYOAXBBJ-MEDUHNTESA-N 2 0 325.283 4.055 20 0 EIADRP Cc1ccc(CC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)nc1 ZINC000453433703 1031986601 /nfs/dbraw/zinc/98/66/01/1031986601.db2.gz TWGGWNKCNJDGKF-UHFFFAOYSA-N 2 0 331.548 4.201 20 0 EIADRP C[N@H+](CCCC[NH2+]Cc1ccc(Cl)c(Br)c1)C1CC1 ZINC000453590076 1032035473 /nfs/dbraw/zinc/03/54/73/1032035473.db2.gz AGTXOHHNFYJICZ-UHFFFAOYSA-N 2 0 345.712 4.067 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cc(Cl)ccc2O)cc1 ZINC000236919937 1033412164 /nfs/dbraw/zinc/41/21/64/1033412164.db2.gz CIBDUBJWAFCUOG-UHFFFAOYSA-N 2 0 332.875 4.177 20 0 EIADRP CSCCCC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000512633898 1033571466 /nfs/dbraw/zinc/57/14/66/1033571466.db2.gz AWGPDSDOTGQSFS-XUVXKRRUSA-N 2 0 332.557 4.020 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)s2)C1 ZINC000512848748 1034068353 /nfs/dbraw/zinc/06/83/53/1034068353.db2.gz JDDDYIBUQDHLRE-AWEZNQCLSA-N 2 0 334.916 4.500 20 0 EIADRP Cc1cc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)ccc1F ZINC000397551479 1034286138 /nfs/dbraw/zinc/28/61/38/1034286138.db2.gz VBNLRMXCTTVUME-UHFFFAOYSA-N 2 0 326.459 4.136 20 0 EIADRP CC(C)Oc1ccc2ccccc2c1C[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000647794943 1034549576 /nfs/dbraw/zinc/54/95/76/1034549576.db2.gz GJNAFHMFWFIEIB-GBESFXJTSA-N 2 0 338.495 4.105 20 0 EIADRP c1ccc(C(CC[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)c2ccccc2)cc1 ZINC000246525033 1034720304 /nfs/dbraw/zinc/72/03/04/1034720304.db2.gz KVWMXYLAHDLPIP-VXKWHMMOSA-N 2 0 334.507 4.425 20 0 EIADRP c1cc2cccc(C[N@H+]3CCC[C@H](C[NH+]4CCCCCC4)C3)c2[nH]1 ZINC000513425170 1034927264 /nfs/dbraw/zinc/92/72/64/1034927264.db2.gz QNJNNRMDJGNJHA-GOSISDBHSA-N 2 0 325.500 4.256 20 0 EIADRP CCC(CC)[C@H]1C[C@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)CCO1 ZINC000513414550 1034933379 /nfs/dbraw/zinc/93/33/79/1034933379.db2.gz OHAVKTNDUUTKGT-TZIWHRDSSA-N 2 0 336.564 4.357 20 0 EIADRP Cc1ccccc1[C@@H](CC(C)C)[NH2+]CCCN1CC[NH+](C(C)C)CC1 ZINC000501056784 1035362322 /nfs/dbraw/zinc/36/23/22/1035362322.db2.gz UNQNALNTWUPTIO-JOCHJYFZSA-N 2 0 345.575 4.088 20 0 EIADRP C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501070250 1035368312 /nfs/dbraw/zinc/36/83/12/1035368312.db2.gz SDWTYXJEDBOMFJ-HNNXBMFYSA-N 2 0 345.437 4.269 20 0 EIADRP C[NH2+]CCC1CC[NH+](Cc2nc(-c3ccccc3Cl)cs2)CC1 ZINC000420307482 1035504474 /nfs/dbraw/zinc/50/44/74/1035504474.db2.gz MJSQJPPKXVOPSD-UHFFFAOYSA-N 2 0 349.931 4.285 20 0 EIADRP Clc1ccc2oc(C3CC[NH+](CC[C@H]4CCC[NH2+]C4)CC3)nc2c1 ZINC000420319221 1035511370 /nfs/dbraw/zinc/51/13/70/1035511370.db2.gz OYNSKWFMPCFRQC-CQSZACIVSA-N 2 0 347.890 4.050 20 0 EIADRP Clc1ccccc1-c1csc(C[NH+]2CCC3(CC[NH2+]C3)CC2)n1 ZINC000420329371 1035528471 /nfs/dbraw/zinc/52/84/71/1035528471.db2.gz GMNVVTMZRWJMIT-UHFFFAOYSA-N 2 0 347.915 4.039 20 0 EIADRP CC(C)c1ccc([C@H](C)[NH+]2CCC([C@@H]3C[C@H]([NH3+])CCO3)CC2)cc1 ZINC000420388971 1035565326 /nfs/dbraw/zinc/56/53/26/1035565326.db2.gz LUDVXPYYDYPUPK-DQLDELGASA-N 2 0 330.516 4.089 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(Br)s2)CC1 ZINC000501787135 1035591829 /nfs/dbraw/zinc/59/18/29/1035591829.db2.gz VEQMBROHHHGXAE-UHFFFAOYSA-N 2 0 345.350 4.064 20 0 EIADRP COCc1cc([C@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)ccc1OC ZINC000158192644 1035664141 /nfs/dbraw/zinc/66/41/41/1035664141.db2.gz ZLAQEOHPSXYPEH-SFHVURJKSA-N 2 0 348.531 4.004 20 0 EIADRP c1ccc(OCCC[N@@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000491057669 1035797622 /nfs/dbraw/zinc/79/76/22/1035797622.db2.gz FBNYDSHTQQGEBX-HXUWFJFHSA-N 2 0 330.516 4.044 20 0 EIADRP C[C@H]([NH2+][C@H]1CCc2ccc(F)cc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000485257789 1035801368 /nfs/dbraw/zinc/80/13/68/1035801368.db2.gz HADPKMFKABLZFO-BPXKWBHBSA-N 2 0 338.470 4.313 20 0 EIADRP C[NH+]1CCC(CC[NH2+]Cc2ccc(-c3c(F)cccc3F)o2)CC1 ZINC000237157951 1036054057 /nfs/dbraw/zinc/05/40/57/1036054057.db2.gz PQOXMDZCVXLFSH-UHFFFAOYSA-N 2 0 334.410 4.046 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000502420480 1036203790 /nfs/dbraw/zinc/20/37/90/1036203790.db2.gz YNLNPXISQLMMLZ-GBAJDQEWSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(-c2cnco2)cc1)c1cccc(C[NH+](C)C)c1 ZINC000906523925 1036314481 /nfs/dbraw/zinc/31/44/81/1036314481.db2.gz AHDFCXSYUZFZDZ-INIZCTEOSA-N 2 0 335.451 4.254 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2ccc(-c3cccc(F)c3F)o2)CC1 ZINC000421368601 1036314421 /nfs/dbraw/zinc/31/44/21/1036314421.db2.gz GOYNMTNSBOPXAF-UHFFFAOYSA-N 2 0 334.410 4.187 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C[C@@H]2CC23CCSCC3)CC1 ZINC000421374815 1036322235 /nfs/dbraw/zinc/32/22/35/1036322235.db2.gz HLHMZNUQORXVSD-AOIWGVFYSA-N 2 0 336.589 4.152 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2nc(-c3ccsc3)oc2C)CC1 ZINC000588708161 1036416894 /nfs/dbraw/zinc/41/68/94/1036416894.db2.gz BJPQATITBUKYHU-UHFFFAOYSA-N 2 0 347.528 4.265 20 0 EIADRP C[C@@H](NCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502683276 1036500649 /nfs/dbraw/zinc/50/06/49/1036500649.db2.gz IPBDNSKAWDHTIS-FGTMMUONSA-N 2 0 332.536 4.017 20 0 EIADRP COCC[C@H]1CCC[C@@H]1[NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1 ZINC000502696681 1036511939 /nfs/dbraw/zinc/51/19/39/1036511939.db2.gz LIEJEAAXIPKRNQ-YADHBBJMSA-N 2 0 344.543 4.357 20 0 EIADRP CSc1ccccc1[C@H]1CCC[N@@H+]1C1CC[NH+](CC2CC2)CC1 ZINC001168389175 1036735279 /nfs/dbraw/zinc/73/52/79/1036735279.db2.gz KWXGLFMONBVRRY-LJQANCHMSA-N 2 0 330.541 4.420 20 0 EIADRP C[C@H](CSC(C)(C)C)[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000165313602 1036773457 /nfs/dbraw/zinc/77/34/57/1036773457.db2.gz PINRHQNEEJFJCZ-IEBWSBKVSA-N 2 0 334.573 4.061 20 0 EIADRP CCc1onc(C)c1C[NH+]1CCC(CC[N@@H+](CC)CC(C)C)CC1 ZINC001168413865 1036779949 /nfs/dbraw/zinc/77/99/49/1036779949.db2.gz LIWWCKILFPXVAF-UHFFFAOYSA-N 2 0 335.536 4.125 20 0 EIADRP Fc1ccc2cc(C[NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)[nH]c2c1 ZINC000486700700 1036820864 /nfs/dbraw/zinc/82/08/64/1036820864.db2.gz JSRBQZWIBROFFQ-UHFFFAOYSA-N 2 0 337.442 4.193 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Br)cs1 ZINC000421883481 1036832558 /nfs/dbraw/zinc/83/25/58/1036832558.db2.gz SVJNDOKPQNNHMR-PKSQDBQZSA-N 2 0 331.323 4.034 20 0 EIADRP C/C(=C/c1cccc(C(F)(F)F)c1)C[N@H+](C)CC1CC[NH+](C)CC1 ZINC000572849123 1036843667 /nfs/dbraw/zinc/84/36/67/1036843667.db2.gz HJSZLDZBDSSWJK-PTNGSMBKSA-N 2 0 340.433 4.382 20 0 EIADRP CC(C)C[NH2+]C[C@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000503043717 1036883780 /nfs/dbraw/zinc/88/37/80/1036883780.db2.gz HDLPTYWMRGXHNR-NVXWUHKLSA-N 2 0 328.422 4.334 20 0 EIADRP CC1CC[NH+](CCCC[NH2+]Cc2cccc(OC(F)(F)F)c2)CC1 ZINC000590301573 1037036493 /nfs/dbraw/zinc/03/64/93/1037036493.db2.gz MHJWTKHMDIISCW-UHFFFAOYSA-N 2 0 344.421 4.187 20 0 EIADRP C(=C\c1ccncc1)\C[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000487266435 1037081836 /nfs/dbraw/zinc/08/18/36/1037081836.db2.gz OSXMJCGNYOZSEH-FPLPWBNLSA-N 2 0 335.495 4.261 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)COC2)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000272691536 1037268742 /nfs/dbraw/zinc/26/87/42/1037268742.db2.gz PQQGJUYLHSHXRI-LZLYRXPVSA-N 2 0 328.500 4.020 20 0 EIADRP CCOCCC1(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CCC1 ZINC000272711310 1037275443 /nfs/dbraw/zinc/27/54/43/1037275443.db2.gz COBHMDYZFCHCLH-CTNGQTDRSA-N 2 0 344.543 4.084 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc3ccc(F)cc3[nH]2)CC1 ZINC000488335971 1037524154 /nfs/dbraw/zinc/52/41/54/1037524154.db2.gz YRIJAMSHPOBVPI-UHFFFAOYSA-N 2 0 331.479 4.251 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cc(Cl)cc3cccnc32)CC1 ZINC000488325945 1037528653 /nfs/dbraw/zinc/52/86/53/1037528653.db2.gz QJFGFBPQBFSNAT-UHFFFAOYSA-N 2 0 345.918 4.442 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H](c2ccccc2)C2CCC2)cc1 ZINC000591699430 1037551742 /nfs/dbraw/zinc/55/17/42/1037551742.db2.gz UHFHAHKAKGJFKG-JOCHJYFZSA-N 2 0 338.495 4.258 20 0 EIADRP C[NH+]1CCC(C[NH2+]Cc2cn(Cc3ccccc3)c3ccccc23)CC1 ZINC000591711897 1037556921 /nfs/dbraw/zinc/55/69/21/1037556921.db2.gz CBBFHAVNWQAPRI-UHFFFAOYSA-N 2 0 347.506 4.121 20 0 EIADRP c1sc(C2CCCCC2)nc1C[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000573497380 1037569556 /nfs/dbraw/zinc/56/95/56/1037569556.db2.gz XJIWWWTYHJCQNP-IAGOWNOFSA-N 2 0 333.545 4.012 20 0 EIADRP CC(C)[C@H]1C[C@@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)CS1 ZINC000488412616 1037581076 /nfs/dbraw/zinc/58/10/76/1037581076.db2.gz OZIFVYLVFCZPIW-SJLPKXTDSA-N 2 0 338.586 4.080 20 0 EIADRP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)CS1 ZINC000488434577 1037592095 /nfs/dbraw/zinc/59/20/95/1037592095.db2.gz JEAZSXIEQXQFOE-AQNXPRMDSA-N 2 0 346.584 4.061 20 0 EIADRP [NH3+]C[C@H]1CC[N@H+](Cc2ccccc2Oc2ccc(F)cc2Cl)C1 ZINC000414649870 1037662350 /nfs/dbraw/zinc/66/23/50/1037662350.db2.gz COMMKEKLYZXLFH-CYBMUJFWSA-N 2 0 334.822 4.052 20 0 EIADRP Cc1ccc(CCC[N@@H+]2CCC[C@@H](c3ncc4n3CCCC4)C2)cc1 ZINC000503410484 1037743746 /nfs/dbraw/zinc/74/37/46/1037743746.db2.gz BBAHWPBLWJNGMX-HXUWFJFHSA-N 2 0 337.511 4.340 20 0 EIADRP c1ccc2cc(C[NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)ccc2c1 ZINC000422700361 1037801586 /nfs/dbraw/zinc/80/15/86/1037801586.db2.gz GRGCRDWYRJSXEZ-JTHBVZDNSA-N 2 0 344.458 4.185 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](CC(F)(F)F)c1ccccc1 ZINC000422705265 1037801777 /nfs/dbraw/zinc/80/17/77/1037801777.db2.gz BOICMLMFKGXFJN-GUYCJALGSA-N 2 0 337.389 4.193 20 0 EIADRP C(CC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1)CCOC1CCCCC1 ZINC000422704252 1037802848 /nfs/dbraw/zinc/80/28/48/1037802848.db2.gz KEHVASLDUXZZMN-PWRODBHTSA-N 2 0 336.564 4.406 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1Cl ZINC000422689324 1037807147 /nfs/dbraw/zinc/80/71/47/1037807147.db2.gz FENXJWULJPDBFY-DCPHZVHLSA-N 2 0 342.870 4.247 20 0 EIADRP CC[C@H](C[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1 ZINC000422718436 1037813082 /nfs/dbraw/zinc/81/30/82/1037813082.db2.gz PQZPWPJFTNGKOH-PIPMEXSNSA-N 2 0 336.479 4.026 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)CC(C)(C)c1ccccc1 ZINC000422716080 1037813403 /nfs/dbraw/zinc/81/34/03/1037813403.db2.gz MWNOALAHMZTHCX-JKSUJKDBSA-N 2 0 325.500 4.256 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@H](C)C[C@@H](C)[NH3+])ccc1OCc1ccccc1 ZINC000422717333 1037813572 /nfs/dbraw/zinc/81/35/72/1037813572.db2.gz KQLDEQYVZVUOHS-ZACQAIPSSA-N 2 0 342.483 4.051 20 0 EIADRP CCc1ccc([C@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1 ZINC000422741916 1037821598 /nfs/dbraw/zinc/82/15/98/1037821598.db2.gz FPGMCERHCOVOBM-AQKFKSFVSA-N 2 0 336.479 4.156 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cc2ccccc2o1 ZINC000422768511 1037829441 /nfs/dbraw/zinc/82/94/41/1037829441.db2.gz NZUULJMBPZZYBU-LZFQIVBZSA-N 2 0 348.446 4.339 20 0 EIADRP CC[C@@H]([NH2+][C@H](C)c1ccc(C[NH3+])nc1C)C(C)(C)c1ccccc1 ZINC000422784781 1037832427 /nfs/dbraw/zinc/83/24/27/1037832427.db2.gz OOGXLQYJNQUZEW-OXQOHEQNSA-N 2 0 325.500 4.256 20 0 EIADRP c1cncc(-c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)cc2)c1 ZINC000422804314 1037838616 /nfs/dbraw/zinc/83/86/16/1037838616.db2.gz HJFFSRGAKQNWDR-BHIFYINESA-N 2 0 335.495 4.149 20 0 EIADRP COc1ccc([C@H](C)CC[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)cc1 ZINC000422791224 1037839767 /nfs/dbraw/zinc/83/97/67/1037839767.db2.gz YIAXPBMXMQFHRH-UMSONDCASA-N 2 0 330.516 4.089 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)cc1C ZINC000422792025 1037839979 /nfs/dbraw/zinc/83/99/79/1037839979.db2.gz ZABIKJFVKNZBET-XJABCFGWSA-N 2 0 336.479 4.210 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CN[C@@H]2C[C@H]([NH3+])c3ccccc32)cc1 ZINC000422863317 1037848210 /nfs/dbraw/zinc/84/82/10/1037848210.db2.gz OOGSDHXIGRQNMG-MQNAVGNWSA-N 2 0 349.522 4.295 20 0 EIADRP c1ccc(-c2nc3c(s2)[C@H]([NH2+]C2C[C@H]4CC[C@@H](C2)[NH2+]4)CCC3)cc1 ZINC000422862275 1037849107 /nfs/dbraw/zinc/84/91/07/1037849107.db2.gz POZLBWHDVKXKKG-FCLJQHQZSA-N 2 0 339.508 4.060 20 0 EIADRP COc1cc([C@H](C)[NH2+]C2CCC(C[NH3+])CC2)ccc1OC1CCCC1 ZINC000422882530 1037852970 /nfs/dbraw/zinc/85/29/70/1037852970.db2.gz SMZMHINROZZPFB-HJOIGYKYSA-N 2 0 346.515 4.185 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)c1cccc(OC(C)C)c1 ZINC000422886716 1037854782 /nfs/dbraw/zinc/85/47/82/1037854782.db2.gz XFOGUDIKXRNXHB-GJZGRUSLSA-N 2 0 327.472 4.048 20 0 EIADRP c1ccc(OC2CCC2)c(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000422910825 1037866103 /nfs/dbraw/zinc/86/61/03/1037866103.db2.gz JMFIHXQXMFEYBW-HSALFYBXSA-N 2 0 328.500 4.018 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C1CCC([NH3+])CC1 ZINC000422910386 1037866389 /nfs/dbraw/zinc/86/63/89/1037866389.db2.gz HZMQLXBKTYBOII-LMWSTFAQSA-N 2 0 333.476 4.178 20 0 EIADRP c1sc(CC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)nc1C1CCCCC1 ZINC000422914466 1037867800 /nfs/dbraw/zinc/86/78/00/1037867800.db2.gz UHXUVEMTMONYPW-KSZLIROESA-N 2 0 347.572 4.244 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+][C@@H](C)CCCC[NH3+] ZINC000422914652 1037869077 /nfs/dbraw/zinc/86/90/77/1037869077.db2.gz VIFLAKUHTLFSES-QWHCGFSZSA-N 2 0 335.492 4.426 20 0 EIADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CC2c3ccccc3C1c1ccccc12 ZINC000422940097 1037875624 /nfs/dbraw/zinc/87/56/24/1037875624.db2.gz IQFUVVLLNSOVOM-KGUTZJKHSA-N 2 0 332.491 4.001 20 0 EIADRP COc1cccc(C[C@@H]([NH2+][C@H](C)CCCC[NH3+])c2ccccc2)c1 ZINC000422941951 1037875690 /nfs/dbraw/zinc/87/56/90/1037875690.db2.gz OZWMWSOMPMQKST-DYESRHJHSA-N 2 0 326.484 4.086 20 0 EIADRP [NH3+]C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CC2c3ccccc3C1c1ccccc12 ZINC000422940095 1037875892 /nfs/dbraw/zinc/87/58/92/1037875892.db2.gz IQFUVVLLNSOVOM-CLBPNALQSA-N 2 0 332.491 4.001 20 0 EIADRP Brc1ccc([C@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C2CCC2)cc1 ZINC000422944397 1037877673 /nfs/dbraw/zinc/87/76/73/1037877673.db2.gz MGLJXQRBYDZJAN-UJJTZGENSA-N 2 0 349.316 4.163 20 0 EIADRP Brc1ccc([C@@H]([NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)C2CCC2)cc1 ZINC000422944411 1037877925 /nfs/dbraw/zinc/87/79/25/1037877925.db2.gz MGLJXQRBYDZJAN-WFFDWFOESA-N 2 0 349.316 4.163 20 0 EIADRP Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422974246 1037893171 /nfs/dbraw/zinc/89/31/71/1037893171.db2.gz QQCCNPFJCGUWQA-KSSFIOAISA-N 2 0 327.472 4.114 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1nc(-c2cc3ccccc3o2)cs1 ZINC000423048766 1037913438 /nfs/dbraw/zinc/91/34/38/1037913438.db2.gz IRYFCPPBMGIDHV-ZDUSSCGKSA-N 2 0 329.469 4.163 20 0 EIADRP Cc1oc2ccccc2c1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423044933 1037925221 /nfs/dbraw/zinc/92/52/21/1037925221.db2.gz CHQWWVLWCQWXAJ-DENIHFKCSA-N 2 0 348.446 4.087 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc(-c2ccco2)cc1F ZINC000423086806 1037951170 /nfs/dbraw/zinc/95/11/70/1037951170.db2.gz OFDGTCQCZXSOIJ-CYBMUJFWSA-N 2 0 339.414 4.099 20 0 EIADRP Fc1cc(F)cc([C@H]2C[C@H]([NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)C2)c1 ZINC000423098299 1037957208 /nfs/dbraw/zinc/95/72/08/1037957208.db2.gz SALGPRMYZOHUGD-QOOKETHRSA-N 2 0 334.454 4.111 20 0 EIADRP c1ccc([C@H](C[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C2CC2)cc1 ZINC000423121288 1037970561 /nfs/dbraw/zinc/97/05/61/1037970561.db2.gz APESPKYRCWDBOE-XJUOHMSHSA-N 2 0 348.490 4.026 20 0 EIADRP FC(F)(F)[C@H](CC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCC[NH2+]1)c1ccccc1 ZINC000423127236 1037976965 /nfs/dbraw/zinc/97/69/65/1037976965.db2.gz BRDAWSJFZUXFKW-MLHJIOFPSA-N 2 0 340.433 4.233 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1C[C@@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423127848 1037978331 /nfs/dbraw/zinc/97/83/31/1037978331.db2.gz PSHKXABLJGFXBU-QZNHQXDQSA-N 2 0 348.490 4.218 20 0 EIADRP CC[N@H+](Cc1cnc(-c2ccc(C)cc2)s1)[C@H]1CCC[NH2+]CC1 ZINC000414718366 1037981914 /nfs/dbraw/zinc/98/19/14/1037981914.db2.gz RLSVYADJCFVCTD-KRWDZBQOSA-N 2 0 329.513 4.083 20 0 EIADRP FC(F)(F)c1cccc([C@H]([NH2+][C@@H]2CCC[NH2+]CC2)C2CCC2)c1 ZINC000423107103 1037985326 /nfs/dbraw/zinc/98/53/26/1037985326.db2.gz PGOSBYKHDLFFOF-IAGOWNOFSA-N 2 0 326.406 4.278 20 0 EIADRP Cc1ccccc1[C@H]1C[C@H]([NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423106921 1037985698 /nfs/dbraw/zinc/98/56/98/1037985698.db2.gz RSEYBTJBHDUMIO-PGCKSFNISA-N 2 0 348.490 4.087 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(C2CC2)c1 ZINC000423148173 1037994919 /nfs/dbraw/zinc/99/49/19/1037994919.db2.gz USLLWUMKLJOGQG-POCHDABASA-N 2 0 348.490 4.471 20 0 EIADRP Cc1cc([C@@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)ccc1F ZINC000423146632 1037996244 /nfs/dbraw/zinc/99/62/44/1037996244.db2.gz PUVDPGSUIITNAQ-QFIXIFRTSA-N 2 0 340.442 4.041 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(C2CC2)c1 ZINC000423148172 1037998196 /nfs/dbraw/zinc/99/81/96/1037998196.db2.gz USLLWUMKLJOGQG-JFJYTDJESA-N 2 0 348.490 4.471 20 0 EIADRP [NH3+][C@@H]1C[C@@H]([NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)c2ccccc21 ZINC000423140109 1038014923 /nfs/dbraw/zinc/01/49/23/1038014923.db2.gz XHYHTQUZEGSOTH-RCCFBDPRSA-N 2 0 334.385 4.457 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+]C2CCC([NH3+])CC2)c(OCCC)c1 ZINC000423208117 1038038857 /nfs/dbraw/zinc/03/88/57/1038038857.db2.gz DAWXOSXGRAZZOP-GTPINHCMSA-N 2 0 334.504 4.185 20 0 EIADRP C[NH2+]CCC[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423200038 1038051586 /nfs/dbraw/zinc/05/15/86/1038051586.db2.gz LMPBIFXHFLRUJG-AWEZNQCLSA-N 2 0 335.904 4.040 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423203929 1038054394 /nfs/dbraw/zinc/05/43/94/1038054394.db2.gz CXTUSQOTRUBZMR-AEFFLSMTSA-N 2 0 342.458 4.055 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H]2CCCCc3ccc(Br)cc32)CC1 ZINC000423229874 1038069130 /nfs/dbraw/zinc/06/91/30/1038069130.db2.gz ICAYTDVWQMXUIY-DQPZFDDXSA-N 2 0 337.305 4.076 20 0 EIADRP Fc1ccc([C@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2ccccc2Cl)cc1 ZINC000423248552 1038080726 /nfs/dbraw/zinc/08/07/26/1038080726.db2.gz NIDLYUCAVUZDIU-KUHUBIRLSA-N 2 0 332.850 4.158 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423254151 1038083892 /nfs/dbraw/zinc/08/38/92/1038083892.db2.gz XHHXQJVTGGWNGZ-ZBFHGGJFSA-N 2 0 329.513 4.077 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423257119 1038084070 /nfs/dbraw/zinc/08/40/70/1038084070.db2.gz HNQFKYWJORQMMD-UKRRQHHQSA-N 2 0 347.503 4.298 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423257443 1038084607 /nfs/dbraw/zinc/08/46/07/1038084607.db2.gz JKCRYWZIPAHXKD-HIFRSBDPSA-N 2 0 347.503 4.298 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423257118 1038085010 /nfs/dbraw/zinc/08/50/10/1038085010.db2.gz HNQFKYWJORQMMD-HIFRSBDPSA-N 2 0 347.503 4.298 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CC[C@@H]1CC[NH2+]C1 ZINC000423254150 1038085205 /nfs/dbraw/zinc/08/52/05/1038085205.db2.gz XHHXQJVTGGWNGZ-HOCLYGCPSA-N 2 0 329.513 4.077 20 0 EIADRP c1ccc([C@H]([NH2+]CC[C@@H]2CCC[NH2+]C2)c2ccc3ccccc3n2)cc1 ZINC000423256076 1038085559 /nfs/dbraw/zinc/08/55/59/1038085559.db2.gz DJHRUZRDIMJYQK-MBSDFSHPSA-N 2 0 345.490 4.304 20 0 EIADRP CSC[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1ccc(C(F)(F)F)cc1 ZINC000423256463 1038085902 /nfs/dbraw/zinc/08/59/02/1038085902.db2.gz FFNYWDAPQLLFTI-CJNGLKHVSA-N 2 0 346.462 4.089 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2cccc3c2OC(C)(C)C3)C1 ZINC000606469274 1038092777 /nfs/dbraw/zinc/09/27/77/1038092777.db2.gz FHBXMVFUNYHYOV-KRWDZBQOSA-N 2 0 330.516 4.002 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)CCS2 ZINC000423291669 1038094476 /nfs/dbraw/zinc/09/44/76/1038094476.db2.gz JIERSUAHDIZLHN-UGSOOPFHSA-N 2 0 328.481 4.042 20 0 EIADRP CCC[C@@H]([NH2+]C(C)C)C(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000489514572 1038094832 /nfs/dbraw/zinc/09/48/32/1038094832.db2.gz UVFSVOJTQCPTAK-HXUWFJFHSA-N 2 0 345.531 4.168 20 0 EIADRP C[C@H]([NH3+])c1ccc(CNC2CC[NH+](C(C)(C)CC(C)(C)C)CC2)cc1 ZINC000423291470 1038095844 /nfs/dbraw/zinc/09/58/44/1038095844.db2.gz IKOCHZXUNGLNJB-KRWDZBQOSA-N 2 0 345.575 4.475 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCc3c2cccc3Br)cc1 ZINC000423293480 1038096265 /nfs/dbraw/zinc/09/62/65/1038096265.db2.gz RMIRBKIBTIKEHS-KZULUSFZSA-N 2 0 345.284 4.246 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000423290810 1038096543 /nfs/dbraw/zinc/09/65/43/1038096543.db2.gz FODDJEPMBCTEFR-HOTGVXAUSA-N 2 0 334.467 4.051 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C[C@H]2CCOC2)c2ccc(F)cc2)cc1 ZINC000423292957 1038100168 /nfs/dbraw/zinc/10/01/68/1038100168.db2.gz PBRKOOZFGZIPKU-XPIZARPCSA-N 2 0 342.458 4.103 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423321519 1038118052 /nfs/dbraw/zinc/11/80/52/1038118052.db2.gz GHHUJMJUCWJRSB-KUHUBIRLSA-N 2 0 329.513 4.159 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]CC1=CC[NH2+]CC1 ZINC000423345052 1038134815 /nfs/dbraw/zinc/13/48/15/1038134815.db2.gz NNAVAUOSXALOGL-GFCCVEGCSA-N 2 0 347.915 4.342 20 0 EIADRP CC1(C[NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC[NH2+]CC1 ZINC000423325385 1038140495 /nfs/dbraw/zinc/14/04/95/1038140495.db2.gz JOAINQIHQNTFRI-WBVHZDCISA-N 2 0 340.433 4.321 20 0 EIADRP CCOc1ccc([C@@H]([NH2+]CCCC[NH3+])c2ccccc2Cl)cc1 ZINC000423331329 1038141282 /nfs/dbraw/zinc/14/12/82/1038141282.db2.gz PXFJPROMFOICMO-LJQANCHMSA-N 2 0 332.875 4.157 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423340187 1038154534 /nfs/dbraw/zinc/15/45/34/1038154534.db2.gz VLPGAOILGKWTMT-YJYMSZOUSA-N 2 0 347.503 4.298 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423366799 1038182308 /nfs/dbraw/zinc/18/23/08/1038182308.db2.gz QMPBLYIDGFZABJ-BLLLJJGKSA-N 2 0 333.476 4.050 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000423371583 1038190485 /nfs/dbraw/zinc/19/04/85/1038190485.db2.gz GPPDKPJQFKLHQT-XKQJLSEDSA-N 2 0 329.513 4.347 20 0 EIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@H]3CCC[C@H]([NH3+])C3)s2)cc1 ZINC000423370196 1038190832 /nfs/dbraw/zinc/19/08/32/1038190832.db2.gz FHXMZZHHMOTRTQ-RCBQFDQVSA-N 2 0 345.512 4.048 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]C2CCC(c3cccc(C(F)(F)F)c3)CC2)CC[NH2+]1 ZINC000423377830 1038191428 /nfs/dbraw/zinc/19/14/28/1038191428.db2.gz KNWHUARWQYUTEW-DKVDKTFMSA-N 2 0 340.433 4.462 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[NH2+]C[C@@H]1C ZINC000423392764 1038199295 /nfs/dbraw/zinc/19/92/95/1038199295.db2.gz MACWNAVUTASONN-MQIPJXDCSA-N 2 0 349.931 4.421 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[NH2+]C[C@H]1C)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423396363 1038202476 /nfs/dbraw/zinc/20/24/76/1038202476.db2.gz NSSWVROZIWJJNO-VWKPWSFCSA-N 2 0 342.458 4.053 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000423417126 1038221574 /nfs/dbraw/zinc/22/15/74/1038221574.db2.gz DYBWVXRPLHZGDD-ARILJUKYSA-N 2 0 326.937 4.248 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000423434441 1038234896 /nfs/dbraw/zinc/23/48/96/1038234896.db2.gz XZEXGDDIUBCDSC-RBSFLKMASA-N 2 0 344.421 4.043 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1C[C@H](C)c2c1cccc2Br ZINC000423434069 1038236341 /nfs/dbraw/zinc/23/63/41/1038236341.db2.gz NSOWKIZRPTYTGW-YWPYICTPSA-N 2 0 325.294 4.105 20 0 EIADRP CSC[C@H]([NH2+][C@@H](C)CCCC[NH3+])c1ccc(C(F)(F)F)cc1 ZINC000423439064 1038238087 /nfs/dbraw/zinc/23/80/87/1038238087.db2.gz SDWSWXLTGWBAQJ-WFASDCNBSA-N 2 0 334.451 4.217 20 0 EIADRP CC[C@@H]([NH2+][C@@H](C)CCC[NH3+])c1ccc(Br)cc1Cl ZINC000423456855 1038239545 /nfs/dbraw/zinc/23/95/45/1038239545.db2.gz OHYYSHOECMKUNP-IINYFYTJSA-N 2 0 333.701 4.271 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423467246 1038244758 /nfs/dbraw/zinc/24/47/58/1038244758.db2.gz BIAHKUZYPOHTHJ-HIFRSBDPSA-N 2 0 347.503 4.440 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC[C@H]([NH3+])C2)c2cccc(Br)c21 ZINC000423469711 1038245212 /nfs/dbraw/zinc/24/52/12/1038245212.db2.gz VPAQAOGINBUYOS-FOCJUVANSA-N 2 0 337.305 4.105 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H]2CCCc3nc(-c4ccccc4)sc32)C1 ZINC000423467911 1038245740 /nfs/dbraw/zinc/24/57/40/1038245740.db2.gz UPDCDSVKNBJSLC-DJIMGWMZSA-N 2 0 341.524 4.295 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1cc(Cl)ccc1OC(F)F ZINC000423472796 1038246572 /nfs/dbraw/zinc/24/65/72/1038246572.db2.gz NHHJCJCIKPHKPY-LOWVWBTDSA-N 2 0 332.822 4.110 20 0 EIADRP CSC[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccc(C(F)(F)F)cc1 ZINC000423480506 1038252764 /nfs/dbraw/zinc/25/27/64/1038252764.db2.gz NJUGFOXPQQYSSJ-HZPDHXFCSA-N 2 0 346.462 4.231 20 0 EIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cnn(Cc2ccccc2)c1 ZINC000423498593 1038255690 /nfs/dbraw/zinc/25/56/90/1038255690.db2.gz IHASLSNIJFDTAJ-PGRDOPGGSA-N 2 0 348.494 4.062 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)CCS2 ZINC000423503168 1038257552 /nfs/dbraw/zinc/25/75/52/1038257552.db2.gz FLWHCTGYZJUSLW-RBUKOAKNSA-N 2 0 342.508 4.302 20 0 EIADRP CC[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1ccc(Br)cc1 ZINC000423484937 1038260514 /nfs/dbraw/zinc/26/05/14/1038260514.db2.gz RJSCFFGKYUPBAJ-JKSUJKDBSA-N 2 0 325.294 4.022 20 0 EIADRP COc1ccc([C@@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)c2ccc(F)cc2)cc1 ZINC000423487924 1038260588 /nfs/dbraw/zinc/26/05/88/1038260588.db2.gz UUZUYZZFOOALKS-FPOVZHCZSA-N 2 0 342.458 4.046 20 0 EIADRP CC[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1ccccc1Br ZINC000423487797 1038261833 /nfs/dbraw/zinc/26/18/33/1038261833.db2.gz URGOQUVSLKEHSA-CJNGLKHVSA-N 2 0 325.294 4.022 20 0 EIADRP FC(F)(F)c1cccc([C@@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)C2CC2)c1 ZINC000423487686 1038262275 /nfs/dbraw/zinc/26/22/75/1038262275.db2.gz UOCNFQPJYNJUNY-IRXDYDNUSA-N 2 0 326.406 4.278 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000423492251 1038265543 /nfs/dbraw/zinc/26/55/43/1038265543.db2.gz MIQVJLMHJZBEMH-ZOBUZTSGSA-N 2 0 328.431 4.396 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccc(F)cc2)c2ccccc2Cl)C1 ZINC000423519999 1038274882 /nfs/dbraw/zinc/27/48/82/1038274882.db2.gz VTUJVVITMJSKSM-VVFCZOMOSA-N 2 0 332.850 4.286 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccc(F)cc2)c2ccccc2Cl)C1 ZINC000423519997 1038276170 /nfs/dbraw/zinc/27/61/70/1038276170.db2.gz VTUJVVITMJSKSM-AZOIQLNYSA-N 2 0 332.850 4.286 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1 ZINC000423538344 1038284845 /nfs/dbraw/zinc/28/48/45/1038284845.db2.gz GDYYBKPREZUORG-GRZALLJUSA-N 2 0 340.433 4.004 20 0 EIADRP Cc1ccsc1[C@@H](Cc1ccccc1)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423536195 1038287361 /nfs/dbraw/zinc/28/73/61/1038287361.db2.gz HAHWQTYPWUTDAO-LJQANCHMSA-N 2 0 326.509 4.240 20 0 EIADRP FC(F)(F)c1ccc([C@H]2CCC[C@@H]2[NH2+]CCC2=CC[NH2+]CC2)cc1 ZINC000423544174 1038289637 /nfs/dbraw/zinc/28/96/37/1038289637.db2.gz VZTQAPPWSQYDMZ-MSOLQXFVSA-N 2 0 338.417 4.241 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@@H](c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000490157857 1038363654 /nfs/dbraw/zinc/36/36/54/1038363654.db2.gz OSQSXKUBUFMIHJ-IBGZPJMESA-N 2 0 348.437 4.309 20 0 EIADRP CC(C)[C@@H](CSc1ccccc1)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000490159821 1038363784 /nfs/dbraw/zinc/36/37/84/1038363784.db2.gz ZQAXAZMFWVBBHV-HXUWFJFHSA-N 2 0 332.557 4.267 20 0 EIADRP CC[N@@H+]1CC[C@@H](CN[C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000490168565 1038366815 /nfs/dbraw/zinc/36/68/15/1038366815.db2.gz XJWDOVWJSQMGBJ-MGPUTAFESA-N 2 0 346.877 4.500 20 0 EIADRP c1cc2c(s1)CC[NH+](CCCCC[N@@H+]1CCc3sccc3C1)C2 ZINC000607150565 1038390766 /nfs/dbraw/zinc/39/07/66/1038390766.db2.gz AORYDGBADFZHAU-UHFFFAOYSA-N 2 0 346.565 4.396 20 0 EIADRP COc1cccc2c1CC[C@@H]2[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000480778575 1038803952 /nfs/dbraw/zinc/80/39/52/1038803952.db2.gz IRLZZGHBUBCCAV-NRFANRHFSA-N 2 0 338.495 4.313 20 0 EIADRP CCC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1)C1CCCCC1 ZINC000539065068 1038817538 /nfs/dbraw/zinc/81/75/38/1038817538.db2.gz KJWIOUIBIRLRCX-HBMCJLEFSA-N 2 0 336.564 4.093 20 0 EIADRP CCC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)C1CCCCC1 ZINC000539065063 1038818182 /nfs/dbraw/zinc/81/81/82/1038818182.db2.gz KJWIOUIBIRLRCX-ACRUOGEOSA-N 2 0 336.564 4.093 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(Cl)c(F)c1 ZINC000539072297 1038821678 /nfs/dbraw/zinc/82/16/78/1038821678.db2.gz PJLGDIXAFNPVBJ-KFWWJZLASA-N 2 0 342.886 4.019 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccc(F)cc1Cl ZINC000539072155 1038822025 /nfs/dbraw/zinc/82/20/25/1038822025.db2.gz VEDDCVFJGJBYBI-QLFBSQMISA-N 2 0 342.886 4.019 20 0 EIADRP C[NH+](C)C1CCC([NH+]2CCC(c3noc4cc(F)ccc43)CC2)CC1 ZINC001168319814 1038837458 /nfs/dbraw/zinc/83/74/58/1038837458.db2.gz ZPASDMDCEHDGDF-UHFFFAOYSA-N 2 0 345.462 4.019 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2C[C@@H](C)c3c2cccc3C)[C@H](C)C1 ZINC000504921121 1038843988 /nfs/dbraw/zinc/84/39/88/1038843988.db2.gz QXKPVXUODWIJDB-RMVXJAJNSA-N 2 0 344.543 4.270 20 0 EIADRP CC[NH+]1CCC(C[NH2+]C/C(C)=C\c2cccc(C(F)(F)F)c2)CC1 ZINC000557500846 1038864738 /nfs/dbraw/zinc/86/47/38/1038864738.db2.gz YCKCKKCJXGINHF-PTNGSMBKSA-N 2 0 340.433 4.430 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+]CC[C@H]2CCCC[N@@H+]2C)cc1OC ZINC000539252278 1038896116 /nfs/dbraw/zinc/89/61/16/1038896116.db2.gz ILKJDAFIPRPSJX-FUHWJXTLSA-N 2 0 334.504 4.009 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H](CCc2ccccc2)Cc2ccccc2)CCN1C ZINC000462104370 1038907784 /nfs/dbraw/zinc/90/77/84/1038907784.db2.gz JONLIIFIIAHOBE-WTIAFYNJSA-N 2 0 336.523 4.303 20 0 EIADRP C[NH+](C)C1CCC([N@@H+]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC001168328139 1038937267 /nfs/dbraw/zinc/93/72/67/1038937267.db2.gz XCHGYKVUVIIETQ-FAEJEUNOSA-N 2 0 340.433 4.368 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc3cc(OC)ccc3c2)C1 ZINC000481023373 1038958665 /nfs/dbraw/zinc/95/86/65/1038958665.db2.gz NDLRMRVNLVIEHW-DLBZAZTESA-N 2 0 326.484 4.231 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCCC[C@@H]2c2ccc(OC)c(F)c2)C1 ZINC000481039927 1038987022 /nfs/dbraw/zinc/98/70/22/1038987022.db2.gz QINATYYIUFKGPW-YVWKXTFCSA-N 2 0 348.506 4.182 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+]Cc2cc(C(F)(F)F)ccc2F)cc1 ZINC000414806685 1039017867 /nfs/dbraw/zinc/01/78/67/1039017867.db2.gz HYRQWISRGVBLTC-NSHDSACASA-N 2 0 326.337 4.154 20 0 EIADRP Fc1ccc(-c2nc3c(s2)[C@@H]([NH2+][C@@H]2CCC[NH2+]CC2)CCC3)cc1 ZINC000643522393 1039035675 /nfs/dbraw/zinc/03/56/75/1039035675.db2.gz MLKXBJDLBMRLCJ-CVEARBPZSA-N 2 0 345.487 4.058 20 0 EIADRP C[C@@H]1CCC[C@@H](C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)C1 ZINC000539377634 1039036858 /nfs/dbraw/zinc/03/68/58/1039036858.db2.gz SZXSLKAHBDHRKG-QWFCFKBJSA-N 2 0 342.527 4.391 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2cc(F)cc(C(F)(F)F)c2)cc1 ZINC000414810791 1039055454 /nfs/dbraw/zinc/05/54/54/1039055454.db2.gz OJEOSAVKSBPLGG-LLVKDONJSA-N 2 0 326.337 4.154 20 0 EIADRP CCOc1cccc(CN(C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000552059529 1039077699 /nfs/dbraw/zinc/07/76/99/1039077699.db2.gz IQRPXOKIBSBCEU-OAQYLSRUSA-N 2 0 338.495 4.039 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccc3c(c2)OCO3)cc1 ZINC000120580800 1039180197 /nfs/dbraw/zinc/18/01/97/1039180197.db2.gz SIBHEUWRDCFCLN-MRXNPFEDSA-N 2 0 340.467 4.108 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1cccc(OC(F)F)c1 ZINC000477916066 1039226960 /nfs/dbraw/zinc/22/69/60/1039226960.db2.gz QEJZWSOOOGWSOY-AWEZNQCLSA-N 2 0 326.431 4.061 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](C)c2cccc(OCc3ccccc3)c2)C1 ZINC000481294926 1039231594 /nfs/dbraw/zinc/23/15/94/1039231594.db2.gz MZQGGPMAXWLLAT-QUCCMNQESA-N 2 0 338.495 4.258 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](Cc2ccccc2)c2sccc2C)C1 ZINC000481314188 1039284680 /nfs/dbraw/zinc/28/46/80/1039284680.db2.gz BNPWDZBOPYSXCH-OALUTQOASA-N 2 0 328.525 4.272 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](CC)c2cccc(C)c2)[C@H](C)C1 ZINC000552244527 1039312245 /nfs/dbraw/zinc/31/22/45/1039312245.db2.gz DEYJCPYKLAQTFD-NRSPTQNISA-N 2 0 332.532 4.173 20 0 EIADRP COC(C)(C)C[C@H](C)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000552244437 1039312580 /nfs/dbraw/zinc/31/25/80/1039312580.db2.gz AHHRXHYIHVNDAN-KKXNLOMOSA-N 2 0 332.532 4.223 20 0 EIADRP C[C@H]1C[C@@H](N(C)Cc2ccc(Cl)o2)CC[N@@H+]1Cc1ccccc1 ZINC000552256657 1039316973 /nfs/dbraw/zinc/31/69/73/1039316973.db2.gz WJTLDRFBMCGRFR-RDJZCZTQSA-N 2 0 332.875 4.418 20 0 EIADRP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C[C@H]1CC[N@H+](CC)C1 ZINC000481339690 1039320167 /nfs/dbraw/zinc/32/01/67/1039320167.db2.gz QZXOQCIGDRZKGU-ZBFHGGJFSA-N 2 0 326.937 4.142 20 0 EIADRP C[N@H+](CCC[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1)C1CCCCC1 ZINC000534351246 1039338040 /nfs/dbraw/zinc/33/80/40/1039338040.db2.gz TWLFGMAGANENQH-KNQAVFIVSA-N 2 0 344.543 4.399 20 0 EIADRP C[N@@H+]1CCC[C@@]2(CC[NH+](CCCOc3cccc4ccccc43)C2)C1 ZINC000555598027 1039420470 /nfs/dbraw/zinc/42/04/70/1039420470.db2.gz MTZRHORSVDBKEY-JOCHJYFZSA-N 2 0 338.495 4.026 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1cc(C)ccc1OC ZINC000093371652 1039673112 /nfs/dbraw/zinc/67/31/12/1039673112.db2.gz DCPHHIDSZGTJSH-FQEVSTJZSA-N 2 0 326.484 4.306 20 0 EIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000481649445 1039684153 /nfs/dbraw/zinc/68/41/53/1039684153.db2.gz FEZQCEPIQWHHSY-HPUBIQBYSA-N 2 0 342.449 4.346 20 0 EIADRP C[C@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(Cl)c(Cl)c1Cl ZINC000643534417 1039715324 /nfs/dbraw/zinc/71/53/24/1039715324.db2.gz UOVYNYDQMACZFR-CABZTGNLSA-N 2 0 333.690 4.440 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CC12CC[NH2+]CC2)c1ccc(Cl)c(Cl)c1Cl ZINC000643534416 1039716464 /nfs/dbraw/zinc/71/64/64/1039716464.db2.gz UOVYNYDQMACZFR-BXKDBHETSA-N 2 0 333.690 4.440 20 0 EIADRP CCC[NH+]1CCC([NH2+]CC[C@H](c2ccccc2)C(F)(F)F)CC1 ZINC000550857226 1039787638 /nfs/dbraw/zinc/78/76/38/1039787638.db2.gz OREIXNBBBSICAK-QGZVFWFLSA-N 2 0 328.422 4.187 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1cc(F)cc(F)c1 ZINC000123038337 1039854662 /nfs/dbraw/zinc/85/46/62/1039854662.db2.gz ZJKJYMWHPYYKPI-HNNXBMFYSA-N 2 0 330.422 4.411 20 0 EIADRP C(=C\c1ccc(OCc2ccccc2)cc1)\C[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000666955511 1039867622 /nfs/dbraw/zinc/86/76/22/1039867622.db2.gz SMVPJOZWEJENII-VWTGBZJHSA-N 2 0 348.490 4.011 20 0 EIADRP Cc1nc([C@H](C)[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cs1 ZINC000552920135 1039868065 /nfs/dbraw/zinc/86/80/65/1039868065.db2.gz SSSAPUUFJWJSTJ-BXWFABGCSA-N 2 0 343.540 4.403 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1ccc(SCC(F)(F)F)cc1 ZINC000481944210 1039899165 /nfs/dbraw/zinc/89/91/65/1039899165.db2.gz HJMNUCDAGDIAMV-CYBMUJFWSA-N 2 0 334.451 4.333 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)Cc2ccccc2C(F)(F)F)C1 ZINC000481925959 1039899942 /nfs/dbraw/zinc/89/99/42/1039899942.db2.gz NPJTUSBBKCEGNF-HOTGVXAUSA-N 2 0 342.449 4.346 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2csc(-c3ccccc3)n2)CC1 ZINC000123256255 1039982974 /nfs/dbraw/zinc/98/29/74/1039982974.db2.gz WISFOHHXSBXJIC-UHFFFAOYSA-N 2 0 343.540 4.364 20 0 EIADRP Fc1ccccc1[C@@H]1CC[C@@H]([NH2+]C2CCN(c3ccccn3)CC2)C1 ZINC000482074514 1039983974 /nfs/dbraw/zinc/98/39/74/1039983974.db2.gz WHXVLYNKSMJYNE-SJLPKXTDSA-N 2 0 339.458 4.115 20 0 EIADRP CSc1ccc(CC[NH2+][C@@H]2CCN(C)[C@@H](c3ccccc3)C2)cc1 ZINC000551174779 1040018391 /nfs/dbraw/zinc/01/83/91/1040018391.db2.gz DAIKOORIQDXPQY-TZIWHRDSSA-N 2 0 340.536 4.376 20 0 EIADRP CC(C)(C[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccccc1F ZINC000482140093 1040031300 /nfs/dbraw/zinc/03/13/00/1040031300.db2.gz WBDISJSHESMWLC-UHFFFAOYSA-N 2 0 332.507 4.490 20 0 EIADRP C[C@H]([NH2+]CCc1ccc2[nH]ccc2c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000514633512 1040067046 /nfs/dbraw/zinc/06/70/46/1040067046.db2.gz GARKPRQOZDCAPG-PGRDOPGGSA-N 2 0 347.506 4.211 20 0 EIADRP CCc1ccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)cc1 ZINC000551227564 1040069564 /nfs/dbraw/zinc/06/95/64/1040069564.db2.gz LYNNZVAZOLIVCR-UHFFFAOYSA-N 2 0 338.495 4.012 20 0 EIADRP Cc1cccnc1C(C)(C)C[NH2+]C1CC[NH+]([C@@H]2CCC[C@H](C)C2)CC1 ZINC000514637711 1040072779 /nfs/dbraw/zinc/07/27/79/1040072779.db2.gz SLUWKGAHGLSIGF-FXAWDEMLSA-N 2 0 343.559 4.300 20 0 EIADRP Cc1cc(CC[NH2+]C2CC[NH+]([C@H]3CCC[C@H](C)C3)CC2)cc(C)c1O ZINC000470139392 1040097832 /nfs/dbraw/zinc/09/78/32/1040097832.db2.gz BQGAQMGWRZTGCI-KKSFZXQISA-N 2 0 344.543 4.184 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cccc(C(F)(F)F)c2)C1 ZINC000482336222 1040184108 /nfs/dbraw/zinc/18/41/08/1040184108.db2.gz RVECHZWGPGIUIM-CABCVRRESA-N 2 0 328.422 4.476 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](CN[C@@H](C)c2ccccc2Br)C1 ZINC000482362200 1040202285 /nfs/dbraw/zinc/20/22/85/1040202285.db2.gz VSZBVVZWTSTGKC-LSDHHAIUSA-N 2 0 339.321 4.220 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@@H](C[NH2+][C@H](Cc3ccccc3)C3CC3)C2)cc1 ZINC000482452126 1040261944 /nfs/dbraw/zinc/26/19/44/1040261944.db2.gz ABHIMGHYFMWALQ-LADGPHEKSA-N 2 0 348.534 4.162 20 0 EIADRP CC(C)CCC[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1ccccc1 ZINC000482509704 1040306943 /nfs/dbraw/zinc/30/69/43/1040306943.db2.gz MUDBKJXJNXZADO-RBBKRZOGSA-N 2 0 345.575 4.027 20 0 EIADRP CC(C)CCC[C@@H]([NH2+]C[C@@H](C)CN1CC[NH+](C)CC1)c1ccccc1 ZINC000482509702 1040308022 /nfs/dbraw/zinc/30/80/22/1040308022.db2.gz MUDBKJXJNXZADO-IFMALSPDSA-N 2 0 345.575 4.027 20 0 EIADRP C[C@H](C[NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000666993719 1040365823 /nfs/dbraw/zinc/36/58/23/1040365823.db2.gz GIUWQYBUYCFZFX-CJNGLKHVSA-N 2 0 326.406 4.073 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(OC)c1 ZINC000479461732 1040366354 /nfs/dbraw/zinc/36/63/54/1040366354.db2.gz DLJDMMGEBSUECV-KNQAVFIVSA-N 2 0 338.495 4.258 20 0 EIADRP c1ccc(C[C@H]([NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C2CC2)cc1 ZINC000479462203 1040370862 /nfs/dbraw/zinc/37/08/62/1040370862.db2.gz FPIKYDSQQWXYQU-GMAHTHKFSA-N 2 0 334.507 4.119 20 0 EIADRP FC(F)(F)c1cccc(CCCC[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)c1 ZINC000666993940 1040375070 /nfs/dbraw/zinc/37/50/70/1040375070.db2.gz VGKZWZIJALXOTR-QGZVFWFLSA-N 2 0 340.433 4.292 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)CN1CC[NH+](C)CC1)c1ccc(C2CCCCC2)cc1 ZINC000482630968 1040396188 /nfs/dbraw/zinc/39/61/88/1040396188.db2.gz QZTUAYIBYVYIDI-RBUKOAKNSA-N 2 0 343.559 4.021 20 0 EIADRP C[C@@H]([NH2+]CCOCCC[NH3+])c1ccc(-c2ccccc2Cl)s1 ZINC000629536806 1040434152 /nfs/dbraw/zinc/43/41/52/1040434152.db2.gz HORUIUNIILARCT-CYBMUJFWSA-N 2 0 338.904 4.085 20 0 EIADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(-c2ccc(F)cc2)s1 ZINC000539507849 1040501854 /nfs/dbraw/zinc/50/18/54/1040501854.db2.gz QMANIGYGNLUUIW-AWEZNQCLSA-N 2 0 330.472 4.467 20 0 EIADRP CC(C)(C[NH2+][C@@H]1CN(Cc2ccccc2)C(C)(C)C1)C(F)(F)F ZINC000669830617 1040509855 /nfs/dbraw/zinc/50/98/55/1040509855.db2.gz OADLARAKDSRJLO-HNNXBMFYSA-N 2 0 328.422 4.218 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000482894182 1040555134 /nfs/dbraw/zinc/55/51/34/1040555134.db2.gz RVKYCRROCPPJAX-FXAWDEMLSA-N 2 0 338.495 4.008 20 0 EIADRP CC[N@H+](Cc1cc2ccncc2s1)Cc1ccc(C[NH+](C)C)cc1 ZINC000668161368 1040583637 /nfs/dbraw/zinc/58/36/37/1040583637.db2.gz ZTPBNNBOUXSOLL-UHFFFAOYSA-N 2 0 339.508 4.380 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000515251343 1040586721 /nfs/dbraw/zinc/58/67/21/1040586721.db2.gz SKDVFUZDRNBXJA-UHFFFAOYSA-N 2 0 328.422 4.259 20 0 EIADRP CC(C)[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000551811869 1040623852 /nfs/dbraw/zinc/62/38/52/1040623852.db2.gz IHMORPFLQLZPOW-SFTDATJTSA-N 2 0 330.516 4.074 20 0 EIADRP Cc1ccccc1[C@@H](CC(C)C)[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000483199008 1040756948 /nfs/dbraw/zinc/75/69/48/1040756948.db2.gz NGWMSJMHMOTFDK-SIKLNZKXSA-N 2 0 344.543 4.173 20 0 EIADRP Fc1cccc(-c2ccc(CN3CC[C@H](C[NH+]4CCCC4)C3)o2)c1F ZINC000483263688 1040799266 /nfs/dbraw/zinc/79/92/66/1040799266.db2.gz PGAPSOMFZZCLCB-OAHLLOKOSA-N 2 0 346.421 4.143 20 0 EIADRP CC(C)(C)OC(=O)c1cccc(C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c1 ZINC000479950420 1040816116 /nfs/dbraw/zinc/81/61/16/1040816116.db2.gz QWFVUCBSPTWKKL-UHFFFAOYSA-N 2 0 346.515 4.041 20 0 EIADRP CN(C/C=C\c1ccc(F)cc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000539834039 1040828579 /nfs/dbraw/zinc/82/85/79/1040828579.db2.gz WFTRWPXVSWSNQU-HUCIYCNJSA-N 2 0 338.470 4.293 20 0 EIADRP Cc1ccncc1[C@H](C)[NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C ZINC000537881519 1040870294 /nfs/dbraw/zinc/87/02/94/1040870294.db2.gz NZHAJUAUGYBCJP-QRVBRYPASA-N 2 0 337.511 4.197 20 0 EIADRP FC(F)(F)c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167960331 1040884781 /nfs/dbraw/zinc/88/47/81/1040884781.db2.gz YBKOOTLWBGFCDA-AYHJJNSGSA-N 2 0 338.417 4.200 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1cncc(F)c1 ZINC000537939341 1040901964 /nfs/dbraw/zinc/90/19/64/1040901964.db2.gz MBVYCCPJRSHGJZ-ZIFCJYIRSA-N 2 0 341.474 4.172 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1cncc(F)c1 ZINC000537939338 1040902237 /nfs/dbraw/zinc/90/22/37/1040902237.db2.gz MBVYCCPJRSHGJZ-AOIWGVFYSA-N 2 0 341.474 4.172 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1cncs1 ZINC000537941599 1040904580 /nfs/dbraw/zinc/90/45/80/1040904580.db2.gz XLEMBIUWVDPEBJ-SOLBZPMBSA-N 2 0 329.513 4.094 20 0 EIADRP c1cn(CCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)c2ccccc12 ZINC000480081383 1040910482 /nfs/dbraw/zinc/91/04/82/1040910482.db2.gz KOJFFVZRXLAODY-UHFFFAOYSA-N 2 0 339.527 4.418 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCC[C@H]([C@H]3CCOC3)C2)c1 ZINC000462793865 1040943405 /nfs/dbraw/zinc/94/34/05/1040943405.db2.gz SLRAWFINJPZSQV-FDFHNCONSA-N 2 0 344.543 4.213 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]([C@H]3CCOC3)C2)c1 ZINC000462793864 1040944650 /nfs/dbraw/zinc/94/46/50/1040944650.db2.gz SLRAWFINJPZSQV-BHIFYINESA-N 2 0 344.543 4.213 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000462796983 1040949913 /nfs/dbraw/zinc/94/99/13/1040949913.db2.gz ALEGNUVKWCEITL-BVYCBKJFSA-N 2 0 344.543 4.212 20 0 EIADRP COc1ccc([C@H]2CCCC[C@H]2[NH2+]C2CC[NH+](C(C)C)CC2)cc1F ZINC000537972462 1040974619 /nfs/dbraw/zinc/97/46/19/1040974619.db2.gz LIWVJHFMFGQGDU-UYAOXDASSA-N 2 0 348.506 4.323 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@@H]2[NH2+]C2CC[NH+](C(C)C)CC2)cc1F ZINC000537972460 1040977441 /nfs/dbraw/zinc/97/74/41/1040977441.db2.gz LIWVJHFMFGQGDU-ICSRJNTNSA-N 2 0 348.506 4.323 20 0 EIADRP C[N@@H+]1CCCC[C@H]1CCN1CCC(c2nc3c(s2)CCCC3)CC1 ZINC000425503116 1041017214 /nfs/dbraw/zinc/01/72/14/1041017214.db2.gz INJYSRSJDPJFIH-KRWDZBQOSA-N 2 0 347.572 4.076 20 0 EIADRP C[C@H]([NH2+]CCC[NH+]1CCCC1)c1ccc(SCC(F)(F)F)cc1 ZINC000480160683 1041017514 /nfs/dbraw/zinc/01/75/14/1041017514.db2.gz PJRZWWHRYKWHMH-AWEZNQCLSA-N 2 0 346.462 4.478 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC000436273521 1041045348 /nfs/dbraw/zinc/04/53/48/1041045348.db2.gz KALTWRXRZGUPOK-CTNGQTDRSA-N 2 0 338.495 4.053 20 0 EIADRP C[C@@H]([NH2+]CC[C@H]1CCCC[N@@H+]1C)c1ccc(OCC(F)(F)F)cc1 ZINC000538163077 1041107124 /nfs/dbraw/zinc/10/71/24/1041107124.db2.gz PVHRFOXCJHKESP-GDBMZVCRSA-N 2 0 344.421 4.153 20 0 EIADRP CCCC[C@H](CCC)C[NH2+][C@@H]1CCN(Cc2ccccn2)C[C@@H]1C ZINC000484306403 1041191551 /nfs/dbraw/zinc/19/15/51/1041191551.db2.gz WPXAPDOBMHOKAL-IRFCIJBXSA-N 2 0 331.548 4.488 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3cc4c(cccc4F)[nH]3)CC2)CC1 ZINC000436399983 1041203021 /nfs/dbraw/zinc/20/30/21/1041203021.db2.gz HBGHIQWTBHZKGR-UHFFFAOYSA-N 2 0 343.490 4.440 20 0 EIADRP [NH2+]=C(NC1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)C12CC3CC(CC(C3)C1)C2 ZINC001167960809 1041258630 /nfs/dbraw/zinc/25/86/30/1041258630.db2.gz DMKNJCWUAHNOGR-UXVFMDBASA-N 2 0 341.543 4.175 20 0 EIADRP CC1(c2ccccc2)CC([NH2+]CC2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000436470038 1041270474 /nfs/dbraw/zinc/27/04/74/1041270474.db2.gz GVABZJTZCAIUCU-UHFFFAOYSA-N 2 0 335.495 4.008 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(F)c(Br)c1 ZINC000484481751 1041272768 /nfs/dbraw/zinc/27/27/68/1041272768.db2.gz AEMUEQBZBVNVCM-UBHSHLNASA-N 2 0 343.284 4.112 20 0 EIADRP CSc1ccccc1[C@H](C)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000194892393 1041279435 /nfs/dbraw/zinc/27/94/35/1041279435.db2.gz GPROTJUGOILSIT-AWEZNQCLSA-N 2 0 332.488 4.460 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](c2ccccc2OC)C2CCCC2)CC1 ZINC000540259933 1041324902 /nfs/dbraw/zinc/32/49/02/1041324902.db2.gz WIHZEGODTLULNA-OAQYLSRUSA-N 2 0 330.516 4.391 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](c2ccc(C(F)(F)F)cc2)C(C)C)C1 ZINC000540258971 1041325314 /nfs/dbraw/zinc/32/53/14/1041325314.db2.gz KLUZKOPAYWHPDU-YOEHRIQHSA-N 2 0 328.422 4.334 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](c2ccc(C(F)(F)F)cc2)C(C)C)C1 ZINC000540258967 1041327168 /nfs/dbraw/zinc/32/71/68/1041327168.db2.gz KLUZKOPAYWHPDU-RHSMWYFYSA-N 2 0 328.422 4.334 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]Cc2cccc(OCC3CCCCC3)c2)CC[N@@H+]1C ZINC000538411212 1041329061 /nfs/dbraw/zinc/32/90/61/1041329061.db2.gz XUYZHNNVBKUPNU-PXNSSMCTSA-N 2 0 330.516 4.218 20 0 EIADRP CC(C)[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000540302934 1041355922 /nfs/dbraw/zinc/35/59/22/1041355922.db2.gz WMRLMJXLVNKPBE-PBHICJAKSA-N 2 0 328.422 4.334 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000463141468 1041374660 /nfs/dbraw/zinc/37/46/60/1041374660.db2.gz ZDONDTLABANVOK-VWPQPMDRSA-N 2 0 345.575 4.140 20 0 EIADRP Cc1ccc(CC[C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1 ZINC000538502530 1041382076 /nfs/dbraw/zinc/38/20/76/1041382076.db2.gz YBQFIHXHLPZWER-QGZVFWFLSA-N 2 0 328.475 4.307 20 0 EIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+]CCC1CC[NH+](C)CC1 ZINC000516119840 1041407823 /nfs/dbraw/zinc/40/78/23/1041407823.db2.gz XJTWSMJDVBRXMH-FYWRMAATSA-N 2 0 338.442 4.013 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH+]2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc1 ZINC000667706284 1041421372 /nfs/dbraw/zinc/42/13/72/1041421372.db2.gz WBQTYGYDSJMMNF-OALUTQOASA-N 2 0 341.524 4.035 20 0 EIADRP COc1cc(C)c([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1OC ZINC000480611637 1041422586 /nfs/dbraw/zinc/42/25/86/1041422586.db2.gz OPJGOJUXXAZOIY-WMZOPIPTSA-N 2 0 348.531 4.175 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1CC[C@@H](c2ccccc2)C[C@H]1C ZINC000467554510 1041422984 /nfs/dbraw/zinc/42/29/84/1041422984.db2.gz OHSINPYAQIJJAL-YLJYHZDGSA-N 2 0 346.478 4.344 20 0 EIADRP COc1ccc(OC)c([C@@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)c1 ZINC000480617988 1041426977 /nfs/dbraw/zinc/42/69/77/1041426977.db2.gz VRBMIILHSPLWRZ-DLBZAZTESA-N 2 0 334.504 4.009 20 0 EIADRP Cc1cccc(COc2ccc(C[NH2+][C@@H]3CC[N@@H+](C)C[C@H]3C)cc2)c1 ZINC000480753976 1041509094 /nfs/dbraw/zinc/50/90/94/1041509094.db2.gz COSKOHGXJMVQEU-XMSQKQJNSA-N 2 0 338.495 4.004 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)c2cccc(F)c2)cc1 ZINC000480739389 1041511725 /nfs/dbraw/zinc/51/17/25/1041511725.db2.gz SHZRMQDGXXDRJN-QGZVFWFLSA-N 2 0 344.474 4.397 20 0 EIADRP Cc1ccncc1[C@H](C)[NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000539040710 1041616353 /nfs/dbraw/zinc/61/63/53/1041616353.db2.gz PLDSAIMJORKVFZ-DYXWJJEUSA-N 2 0 337.511 4.341 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(c3ccc(C(F)(F)F)cc3)CC2)[C@H](C)C1 ZINC000437073869 1041625094 /nfs/dbraw/zinc/62/50/94/1041625094.db2.gz HOMIJMQEDIWFMD-PBHICJAKSA-N 2 0 340.433 4.057 20 0 EIADRP CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000437101888 1041660471 /nfs/dbraw/zinc/66/04/71/1041660471.db2.gz FDFOUSWFXFQUTM-YOEHRIQHSA-N 2 0 346.437 4.255 20 0 EIADRP C[N@H+](CCCc1ccsc1)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000541202343 1041845134 /nfs/dbraw/zinc/84/51/34/1041845134.db2.gz GWDTWORJVJDZBA-UHFFFAOYSA-N 2 0 343.540 4.314 20 0 EIADRP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC000467365300 1042021371 /nfs/dbraw/zinc/02/13/71/1042021371.db2.gz PDSUALYQBJGFJS-KBRIMQKVSA-N 2 0 328.422 4.099 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)C1 ZINC000438087600 1042039826 /nfs/dbraw/zinc/03/98/26/1042039826.db2.gz LXNMXOLEXHIJNW-VVLHAWIVSA-N 2 0 334.470 4.455 20 0 EIADRP C[N@H+](CCc1ccccc1Cl)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464845988 1042194245 /nfs/dbraw/zinc/19/42/45/1042194245.db2.gz HZWWFSBSVWPXCV-IBGZPJMESA-N 2 0 342.914 4.336 20 0 EIADRP C[C@@H]1CCCC[C@H]1OCC[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464847133 1042194330 /nfs/dbraw/zinc/19/43/30/1042194330.db2.gz UTUIURPIHCXRCE-CEMLEFRQSA-N 2 0 344.543 4.036 20 0 EIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](CCCOc3ccc(F)cc3)C2)CC1 ZINC000302998427 1042231359 /nfs/dbraw/zinc/23/13/59/1042231359.db2.gz HIOGYLUKGIXUTF-LJQANCHMSA-N 2 0 348.506 4.039 20 0 EIADRP Cc1ccc(CN(C)C2CC[NH+](C(C)C)CC2)cc1Br ZINC000506340893 1042327071 /nfs/dbraw/zinc/32/70/71/1042327071.db2.gz NICWUOLKAQSAAS-UHFFFAOYSA-N 2 0 339.321 4.062 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+]CCC1CC[NH+](C)CC1 ZINC000438831616 1042373586 /nfs/dbraw/zinc/37/35/86/1042373586.db2.gz SEXWXDZVGZZFDU-HXUWFJFHSA-N 2 0 325.500 4.175 20 0 EIADRP CCc1cccc(C[NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)c1 ZINC000518197230 1042405923 /nfs/dbraw/zinc/40/59/23/1042405923.db2.gz FUPVMZXHKDLZDY-UHFFFAOYSA-N 2 0 338.495 4.012 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414972325 1042444056 /nfs/dbraw/zinc/44/40/56/1042444056.db2.gz XPHCJSLIHZKEHY-RHSMWYFYSA-N 2 0 328.422 4.148 20 0 EIADRP CCC[NH+]1CCC(C[NH2+]Cc2ccc(-c3ccccc3F)o2)CC1 ZINC000518275675 1042449089 /nfs/dbraw/zinc/44/90/89/1042449089.db2.gz ZOOBALHFMGCLPT-UHFFFAOYSA-N 2 0 330.447 4.297 20 0 EIADRP CSc1ccc([C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1 ZINC000173419269 1042572055 /nfs/dbraw/zinc/57/20/55/1042572055.db2.gz PRRYGVLLWGTNDY-CQSZACIVSA-N 2 0 332.488 4.460 20 0 EIADRP C[C@@H](NC1(C[NH2+][C@@H](C)c2ccccc2)CCOCC1)c1ccccc1 ZINC000173434148 1042572652 /nfs/dbraw/zinc/57/26/52/1042572652.db2.gz MIIUGACFOAMCMQ-RBUKOAKNSA-N 2 0 338.495 4.237 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1)c1ccncc1 ZINC000173927430 1042629401 /nfs/dbraw/zinc/62/94/01/1042629401.db2.gz HHOBQLUNJLYZFJ-OTWHNJEPSA-N 2 0 337.511 4.410 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]C[C@H](C)C[NH+]2CCCCC2)C1 ZINC000467388693 1042716655 /nfs/dbraw/zinc/71/66/55/1042716655.db2.gz IFNWEZXRBMULOV-DFQSSKMNSA-N 2 0 329.532 4.128 20 0 EIADRP Clc1ccc(CNC2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c(Cl)c1 ZINC001167964877 1042717285 /nfs/dbraw/zinc/71/72/85/1042717285.db2.gz ZGZHQFUHXSKBBY-ALOPSCKCSA-N 2 0 339.310 4.488 20 0 EIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000439789395 1042768479 /nfs/dbraw/zinc/76/84/79/1042768479.db2.gz PKXGRTPVRGANEF-NRFANRHFSA-N 2 0 344.543 4.036 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cn(C)nc2C2CCCCC2)CC1 ZINC000542465054 1042811106 /nfs/dbraw/zinc/81/11/06/1042811106.db2.gz QEBWQHXTLLUNIH-UHFFFAOYSA-N 2 0 346.563 4.020 20 0 EIADRP c1ccc(CSCCC[N@@H+]2CC[C@@H](C[NH+]3CCCCC3)C2)cc1 ZINC000536382713 1042817090 /nfs/dbraw/zinc/81/70/90/1042817090.db2.gz NEUBRQROERRPBU-FQEVSTJZSA-N 2 0 332.557 4.118 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCCC(F)(F)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310236031 1042831876 /nfs/dbraw/zinc/83/18/76/1042831876.db2.gz KSFFZNFLYDVSOF-YTQUADARSA-N 2 0 336.470 4.312 20 0 EIADRP COc1ccc(C)cc1[C@H](C)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310970369 1042848878 /nfs/dbraw/zinc/84/88/78/1042848878.db2.gz DDQQVYWGAWSCGW-ICSRJNTNSA-N 2 0 338.495 4.176 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1OC ZINC000310985597 1042849370 /nfs/dbraw/zinc/84/93/70/1042849370.db2.gz GTHDBFODEHWHDM-TZIWHRDSSA-N 2 0 338.495 4.258 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)[C@H](C)C2 ZINC000493235791 1042854008 /nfs/dbraw/zinc/85/40/08/1042854008.db2.gz YTENCBLNNYGOJV-VGSWGCGISA-N 2 0 335.495 4.130 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@H](C)c1ccsc1 ZINC000178132267 1042859590 /nfs/dbraw/zinc/85/95/90/1042859590.db2.gz YENZUBPKCYZDOP-MRXNPFEDSA-N 2 0 332.513 4.320 20 0 EIADRP C[N@H+](C1CC[NH+](C2CCCCC2)CC1)[C@H]1CCc2cc(F)ccc2C1 ZINC001168448844 1042859914 /nfs/dbraw/zinc/85/99/14/1042859914.db2.gz QGSQIIBYUBMARV-QFIPXVFZSA-N 2 0 344.518 4.412 20 0 EIADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1nc(-c2ccccc2)cs1 ZINC000178748165 1042873855 /nfs/dbraw/zinc/87/38/55/1042873855.db2.gz ABCCZLXBPZNXHN-OAHLLOKOSA-N 2 0 329.513 4.193 20 0 EIADRP CC[C@H]1C[C@H](C[NH+]2CCC(C[N@H+](C)Cc3ccccc3)CC2)CCO1 ZINC000507784921 1042935074 /nfs/dbraw/zinc/93/50/74/1042935074.db2.gz UERKNUIPWHBCQB-YADHBBJMSA-N 2 0 344.543 4.036 20 0 EIADRP CC[C@@H]1C[C@@H](C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)CCO1 ZINC000507791856 1042974857 /nfs/dbraw/zinc/97/48/57/1042974857.db2.gz DEELGINHOSLZLF-HLAWJBBLSA-N 2 0 336.564 4.168 20 0 EIADRP CCOc1cccc2cc([C@H](C)[NH2+][C@@H](C)C3CC[NH+](C)CC3)oc21 ZINC000161858389 1043050781 /nfs/dbraw/zinc/05/07/81/1043050781.db2.gz JXGFLDPLDOCLTP-GJZGRUSLSA-N 2 0 330.472 4.212 20 0 EIADRP CC(C)[NH+](CCNC1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1)C(C)C ZINC001168008700 1043078097 /nfs/dbraw/zinc/07/80/97/1043078097.db2.gz FTKIJGFLVGKRGX-WOJBJXKFSA-N 2 0 345.575 4.136 20 0 EIADRP CC1CC[NH+](CCCC[NH2+][C@@H](c2ccco2)c2ccccc2)CC1 ZINC000542477207 1043119432 /nfs/dbraw/zinc/11/94/32/1043119432.db2.gz WFYBSAVMJAAHGB-OAQYLSRUSA-N 2 0 326.484 4.471 20 0 EIADRP Cc1nc(-c2ccc(CC[NH2+][C@@H](C)C3CC[NH+](C)CC3)s2)cs1 ZINC000164482555 1043151228 /nfs/dbraw/zinc/15/12/28/1043151228.db2.gz WPVARWUJFMLDTL-ZDUSSCGKSA-N 2 0 349.569 4.042 20 0 EIADRP CC1CC[NH+](Cc2ccc(C[NH2+]Cc3cc(O)cc(F)c3)cc2)CC1 ZINC000185456137 1043185310 /nfs/dbraw/zinc/18/53/10/1043185310.db2.gz DYKWROLRBATSPB-UHFFFAOYSA-N 2 0 342.458 4.053 20 0 EIADRP CCSc1cccc(C[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)c1 ZINC000185538001 1043196804 /nfs/dbraw/zinc/19/68/04/1043196804.db2.gz XRFLYQXPUDLPSB-UHFFFAOYSA-N 2 0 332.488 4.289 20 0 EIADRP [NH3+]C1(C[NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CCCC1 ZINC000665247088 1043230079 /nfs/dbraw/zinc/23/00/79/1043230079.db2.gz VMUXGPNZTJSSIV-ZBFHGGJFSA-N 2 0 326.406 4.203 20 0 EIADRP Brc1ccc2c(c1)[C@H]([NH2+][C@H]1CC[N@@H+]3CCC[C@@H]3C1)CCC2 ZINC000356682445 1043253320 /nfs/dbraw/zinc/25/33/20/1043253320.db2.gz SDWNQWRLVNSSAD-LZLYRXPVSA-N 2 0 349.316 4.043 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+]CC2CCC(C(F)(F)F)CC2)c1 ZINC000186584017 1043293564 /nfs/dbraw/zinc/29/35/64/1043293564.db2.gz MPZLQMNVUFOYFU-UHFFFAOYSA-N 2 0 328.422 4.207 20 0 EIADRP CSCCCCC[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12 ZINC000186772668 1043308031 /nfs/dbraw/zinc/30/80/31/1043308031.db2.gz SZBDANACFHFKGN-HSALFYBXSA-N 2 0 332.557 4.020 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+]C2(c3cccc(Cl)c3)CC2)cc1 ZINC000077467849 1043325313 /nfs/dbraw/zinc/32/53/13/1043325313.db2.gz OFPUGLURNMRHSJ-UHFFFAOYSA-N 2 0 344.886 4.059 20 0 EIADRP FC1(F)C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cccc(C[NH+]2CCCCC2)c1 ZINC000625679673 1043334521 /nfs/dbraw/zinc/33/45/21/1043334521.db2.gz UJNZIEZXUPAZIL-KDURUIRLSA-N 2 0 334.454 4.435 20 0 EIADRP C[C@H]([NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C)C1CCSCC1 ZINC000187305591 1043341188 /nfs/dbraw/zinc/34/11/88/1043341188.db2.gz RXKYLTVZANMGKX-KURKYZTESA-N 2 0 346.584 4.264 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3F)s2)C1 ZINC000520943398 1043444335 /nfs/dbraw/zinc/44/43/35/1043444335.db2.gz AIFQFQQUGVCRPX-OAHLLOKOSA-N 2 0 332.488 4.376 20 0 EIADRP CCc1nc(C)c(CN(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)o1 ZINC000428242689 1043462427 /nfs/dbraw/zinc/46/24/27/1043462427.db2.gz WEBWELBOWQSTNO-QFBILLFUSA-N 2 0 341.499 4.030 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccnn1-c1ccccc1 ZINC000467363818 1043577686 /nfs/dbraw/zinc/57/76/86/1043577686.db2.gz GBQFDCAWLNURDZ-OALUTQOASA-N 2 0 340.515 4.035 20 0 EIADRP CCc1ccc(C(C)(C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000674376140 1043649399 /nfs/dbraw/zinc/64/93/99/1043649399.db2.gz LQUUBJKGBVCIFH-UHFFFAOYSA-N 2 0 340.511 4.214 20 0 EIADRP CC(C)[NH+]1CCC([NH2+]CC[C@@H](c2ccccc2)C(F)(F)F)CC1 ZINC000521281553 1043680099 /nfs/dbraw/zinc/68/00/99/1043680099.db2.gz RHHWTHMBHCRDMX-KRWDZBQOSA-N 2 0 328.422 4.185 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)Cc1ccc(C(C)C)cc1 ZINC000544347085 1043726420 /nfs/dbraw/zinc/72/64/20/1043726420.db2.gz DVJBMIYSGUGKKB-UHFFFAOYSA-N 2 0 334.467 4.331 20 0 EIADRP COCCCCC[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000521477538 1043787699 /nfs/dbraw/zinc/78/76/99/1043787699.db2.gz RLFSCTLNDBHCCU-BHDDXSALSA-N 2 0 344.543 4.084 20 0 EIADRP Cc1c([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cnn1C(C)(C)C ZINC000191178413 1043789214 /nfs/dbraw/zinc/78/92/14/1043789214.db2.gz XVXXDQCIOXZNSA-IRXDYDNUSA-N 2 0 334.552 4.109 20 0 EIADRP Cc1c([C@@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)cnn1C(C)C ZINC000191179505 1043793268 /nfs/dbraw/zinc/79/32/68/1043793268.db2.gz CLDQIXNBMIJRJN-FGTMMUONSA-N 2 0 334.552 4.181 20 0 EIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3ccc4[nH]ccc4c3)CC2)C1 ZINC000442796126 1043842900 /nfs/dbraw/zinc/84/29/00/1043842900.db2.gz FSNUNKJFDWQNQO-LAUBAEHRSA-N 2 0 339.527 4.343 20 0 EIADRP FC(F)(F)c1cccc(CCCC[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c1 ZINC000192469806 1043926660 /nfs/dbraw/zinc/92/66/60/1043926660.db2.gz FDGSUYVDSVKXJP-MRXNPFEDSA-N 2 0 340.433 4.102 20 0 EIADRP C[C@H]1CCc2ccccc2[C@@H]1[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658167691 1043946964 /nfs/dbraw/zinc/94/69/64/1043946964.db2.gz SZIMGQNHDXHXBD-FDDCHVKYSA-N 2 0 349.522 4.207 20 0 EIADRP C[C@@H]([NH2+]CCc1ccc(F)cc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000428271199 1044063849 /nfs/dbraw/zinc/06/38/49/1044063849.db2.gz YHMKTQBJKAQMKQ-GDBMZVCRSA-N 2 0 338.898 4.264 20 0 EIADRP CC1(C)Cc2cc(C[NH2+]CCCCC[NH+]3CCCCC3)ccc2O1 ZINC000733326457 1044195138 /nfs/dbraw/zinc/19/51/38/1044195138.db2.gz DUVDUFBGQSWPJB-UHFFFAOYSA-N 2 0 330.516 4.146 20 0 EIADRP COc1ccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cc1Cl ZINC000174312974 1044260583 /nfs/dbraw/zinc/26/05/83/1044260583.db2.gz VKYWPJQSTKJYBO-UHFFFAOYSA-N 2 0 346.902 4.479 20 0 EIADRP Cc1cc(N2CCC([NH+]3CCCCC3)CC2)c2cc(F)ccc2[nH+]1 ZINC000443440312 1044288563 /nfs/dbraw/zinc/28/85/63/1044288563.db2.gz IKBNPEVRGAGWOZ-UHFFFAOYSA-N 2 0 327.447 4.137 20 0 EIADRP C[C@@H](Cc1cccc(F)c1)[NH2+]CC1CC[NH+](CC2CCCC2)CC1 ZINC001168470485 1044295182 /nfs/dbraw/zinc/29/51/82/1044295182.db2.gz ZAHMZEYAILNXSO-KRWDZBQOSA-N 2 0 332.507 4.249 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000474051434 1044305048 /nfs/dbraw/zinc/30/50/48/1044305048.db2.gz CKNOFKDDSDOAAA-NRFANRHFSA-N 2 0 342.527 4.414 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3ncccc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168020343 1044380181 /nfs/dbraw/zinc/38/01/81/1044380181.db2.gz MHNNIWZKHMIXGR-KQZHTCIUSA-N 2 0 349.522 4.490 20 0 EIADRP CC[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1cccc(Br)c1 ZINC000227495296 1044450108 /nfs/dbraw/zinc/45/01/08/1044450108.db2.gz LWUUGZISUZBIAT-INIZCTEOSA-N 2 0 339.321 4.222 20 0 EIADRP CC[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(Br)cc1 ZINC000227497439 1044452825 /nfs/dbraw/zinc/45/28/25/1044452825.db2.gz AKECKVKCYJWOKB-MRXNPFEDSA-N 2 0 339.321 4.222 20 0 EIADRP C[C@@H]1CC(n2ncc3c2cccc3C[NH3+])C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168021936 1044460038 /nfs/dbraw/zinc/46/00/38/1044460038.db2.gz RINSYHCZVPXDHM-IAGOWNOFSA-N 2 0 348.494 4.109 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCCc2cccnc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168021952 1044462703 /nfs/dbraw/zinc/46/27/03/1044462703.db2.gz RNPFEWYOJVVLOG-HATOLVCRSA-N 2 0 337.511 4.045 20 0 EIADRP CC(C)CCC[C@@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1ccccc1 ZINC000675742422 1044471799 /nfs/dbraw/zinc/47/17/99/1044471799.db2.gz OZBWIYHYPYQBAU-OAQYLSRUSA-N 2 0 345.575 4.170 20 0 EIADRP C[C@@H]([NH2+]CCCOc1ccc(Cl)cc1Cl)C1CC[NH+](C)CC1 ZINC000675787955 1044498876 /nfs/dbraw/zinc/49/88/76/1044498876.db2.gz QSAFZSNELAROLA-CYBMUJFWSA-N 2 0 345.314 4.082 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CC[C@@H](c2cc(C)cc(C)c2)C1 ZINC000543412783 1044554744 /nfs/dbraw/zinc/55/47/44/1044554744.db2.gz OAVUYJDJTGYWTG-LJQANCHMSA-N 2 0 346.478 4.182 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](Cc1ccccc1)c1ccccc1)C1CC[NH+](C)CC1 ZINC000675928065 1044583137 /nfs/dbraw/zinc/58/31/37/1044583137.db2.gz QUTIDUFFNRMXEG-AUSIDOKSSA-N 2 0 336.523 4.333 20 0 EIADRP C[C@H]([NH2+]C[C@H](Cc1ccccc1)c1ccccc1)C1CC[NH+](C)CC1 ZINC000675928066 1044584315 /nfs/dbraw/zinc/58/43/15/1044584315.db2.gz QUTIDUFFNRMXEG-CVDCTZTESA-N 2 0 336.523 4.333 20 0 EIADRP C[C@@H](Cc1cccc(F)c1)[NH+]1CCC([NH3+])(c2ccc(Cl)cc2)CC1 ZINC001168475295 1044586993 /nfs/dbraw/zinc/58/69/93/1044586993.db2.gz XJIPEGSBZHVSNB-HNNXBMFYSA-N 2 0 346.877 4.360 20 0 EIADRP C[C@H]1CC([NH2+]CCOC2CCCCC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168024251 1044606983 /nfs/dbraw/zinc/60/69/83/1044606983.db2.gz CVCIEVNMCLJBMT-OALUTQOASA-N 2 0 344.543 4.367 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccc3ocnc3c2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168024330 1044611959 /nfs/dbraw/zinc/61/19/59/1044611959.db2.gz FDDAYYRGGPFLSR-XEMDLRDOSA-N 2 0 349.478 4.359 20 0 EIADRP C[C@H]1CC([NH2+]Cc2ccc3ncoc3c2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168024417 1044614559 /nfs/dbraw/zinc/61/45/59/1044614559.db2.gz GHGCMILFAAYWFE-IRXDYDNUSA-N 2 0 349.478 4.359 20 0 EIADRP C[NH+]1CCC([C@@H]2CC[N@H+](Cc3csc(-c4cccs4)n3)C2)CC1 ZINC000550573288 1044695714 /nfs/dbraw/zinc/69/57/14/1044695714.db2.gz BNUPBSXUKKYVGQ-OAHLLOKOSA-N 2 0 347.553 4.035 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc(N)cc1 ZINC001168028546 1044746263 /nfs/dbraw/zinc/74/62/63/1044746263.db2.gz PGIKSLUUXRPRBE-WYADAEROSA-N 2 0 337.511 4.361 20 0 EIADRP Cc1nn(C(C)(C)C)c(C)c1C[NH2+]C1CCC(C)([NH+]2CCCC2)CC1 ZINC000922504429 1044790521 /nfs/dbraw/zinc/79/05/21/1044790521.db2.gz NHDZAPUZLAJROZ-UHFFFAOYSA-N 2 0 346.563 4.142 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2nc3ccc(F)cc3s2)C1 ZINC000428878593 1044809941 /nfs/dbraw/zinc/80/99/41/1044809941.db2.gz AMMLCHQRAQRDSW-GASCZTMLSA-N 2 0 349.519 4.283 20 0 EIADRP C[C@@H]1CC([NH2+][C@@H]2CCCc3ccncc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168032459 1044840055 /nfs/dbraw/zinc/84/00/55/1044840055.db2.gz GIVAUBMIBKHGGC-PMAPCBKXSA-N 2 0 349.522 4.490 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+]CC(C)(C)C[NH+](C)C)cc1 ZINC000237323214 1044853607 /nfs/dbraw/zinc/85/36/07/1044853607.db2.gz BTMLWVLVOVSEDX-UHFFFAOYSA-N 2 0 326.484 4.040 20 0 EIADRP Clc1cccc2c1C[C@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001168735394 1044980191 /nfs/dbraw/zinc/98/01/91/1044980191.db2.gz SDIDRTWYDFKIIE-QZTJIDSGSA-N 2 0 332.919 4.148 20 0 EIADRP Clc1cccc2c1C[C@@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001168735395 1044980801 /nfs/dbraw/zinc/98/08/01/1044980801.db2.gz SDIDRTWYDFKIIE-ROUUACIJSA-N 2 0 332.919 4.148 20 0 EIADRP COc1ccc(CC[C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1 ZINC000766006057 1045034992 /nfs/dbraw/zinc/03/49/92/1045034992.db2.gz LUKXOQLQTSMDKI-MRXNPFEDSA-N 2 0 344.474 4.007 20 0 EIADRP S=c1ccn(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)c2ccccc12 ZINC000738271546 1045049352 /nfs/dbraw/zinc/04/93/52/1045049352.db2.gz NLNRZMKYIPGWMK-QGZVFWFLSA-N 2 0 341.524 4.279 20 0 EIADRP CCN(Cc1ccc(C[NH+](C)C)cc1)[C@@H](C)c1nc(C(C)(C)C)no1 ZINC000626062537 1045165649 /nfs/dbraw/zinc/16/56/49/1045165649.db2.gz WESXYHBEGPJFHD-HNNXBMFYSA-N 2 0 344.503 4.012 20 0 EIADRP c1coc(C[NH2+]CCCC[NH+]2CCC(Cc3ccccc3)CC2)c1 ZINC000236697570 1045363115 /nfs/dbraw/zinc/36/31/15/1045363115.db2.gz XEOFDLABOPRVHF-UHFFFAOYSA-N 2 0 326.484 4.104 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)CCc1ccc(O)cc1 ZINC000236916699 1045370380 /nfs/dbraw/zinc/37/03/80/1045370380.db2.gz VYLFSMIFOCQDIY-GOSISDBHSA-N 2 0 340.511 4.345 20 0 EIADRP C[C@H](c1cccc(C(F)(F)F)c1)[N@H+](CC1CC[NH2+]CC1)C1CC1 ZINC000237441553 1045385688 /nfs/dbraw/zinc/38/56/88/1045385688.db2.gz LGVMMCLYPWNYCV-CYBMUJFWSA-N 2 0 326.406 4.230 20 0 EIADRP Clc1ccsc1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000397512579 1045597810 /nfs/dbraw/zinc/59/78/10/1045597810.db2.gz PMQCKHFZJCBMCP-UHFFFAOYSA-N 2 0 334.916 4.403 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCSc1ccccc1 ZINC000397977360 1045818754 /nfs/dbraw/zinc/81/87/54/1045818754.db2.gz KZLAHAZGPLXGSG-GHTZIAJQSA-N 2 0 340.536 4.279 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@@H]1CCCCC1(F)F ZINC000398023824 1045823127 /nfs/dbraw/zinc/82/31/27/1045823127.db2.gz LEWJMHBYEPLOIJ-NEWSRXKRSA-N 2 0 336.470 4.312 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1CCCCC1(F)F ZINC000398023826 1045824118 /nfs/dbraw/zinc/82/41/18/1045824118.db2.gz LEWJMHBYEPLOIJ-QRQLOZEOSA-N 2 0 336.470 4.312 20 0 EIADRP C[C@H](N[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1nc(-c2ccccc2)cs1 ZINC000246813608 1045831448 /nfs/dbraw/zinc/83/14/48/1045831448.db2.gz AVBIPIAMXGBBRG-XIRDDKMYSA-N 2 0 327.497 4.088 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](CC)c2ccc(F)cc2)[C@H](C)C1 ZINC000246825186 1045833629 /nfs/dbraw/zinc/83/36/29/1045833629.db2.gz ADSMFFUVCAJAEV-UXPWSPDFSA-N 2 0 336.495 4.003 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@@H](C)C1)c1cncc(F)c1 ZINC000247004129 1045837196 /nfs/dbraw/zinc/83/71/96/1045837196.db2.gz KVWHHRTWTGHHJN-IAGOWNOFSA-N 2 0 341.474 4.303 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(-n2ccnc2)cc1 ZINC000247123254 1045840768 /nfs/dbraw/zinc/84/07/68/1045840768.db2.gz RFTIWVPMOVTUCU-RTBURBONSA-N 2 0 340.515 4.178 20 0 EIADRP Cc1nc2c(s1)[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C3CCC3)C1)CCC2 ZINC000248392815 1045868107 /nfs/dbraw/zinc/86/81/07/1045868107.db2.gz DHDHOQQKKDMISZ-JLJPHGGASA-N 2 0 333.545 4.072 20 0 EIADRP Cc1cncc([C@H](C)[NH2+]C[C@H]2CCCN(C)[C@H]2c2cccs2)c1 ZINC000248770284 1045883583 /nfs/dbraw/zinc/88/35/83/1045883583.db2.gz XWSXSZJHONLGCA-FRQCXROJSA-N 2 0 329.513 4.185 20 0 EIADRP C[NH+](C)CCCCCCC[NH2+]Cc1c(F)cccc1Br ZINC000792943604 1046102199 /nfs/dbraw/zinc/10/21/99/1046102199.db2.gz VGDWMGNGHLVHQH-UHFFFAOYSA-N 2 0 345.300 4.190 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[N@H+](C)C[C@H]1CCC[NH2+]C1 ZINC000261932084 1046166181 /nfs/dbraw/zinc/16/61/81/1046166181.db2.gz LROFGFGVTRBGQM-SJORKVTESA-N 2 0 343.540 4.419 20 0 EIADRP C[NH2+]C[C@@H]1CCC[N@H+](CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000262052729 1046173780 /nfs/dbraw/zinc/17/37/80/1046173780.db2.gz ZVFWEQXMRAYNRA-INIZCTEOSA-N 2 0 344.449 4.028 20 0 EIADRP CCC(C)(C)[NH2+][C@H](C)C(=O)Nc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000476006309 1046196490 /nfs/dbraw/zinc/19/64/90/1046196490.db2.gz BCSIFLTXAXHIBN-DLBZAZTESA-N 2 0 345.531 4.166 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2N(C)C)c1 ZINC000123976467 1046209543 /nfs/dbraw/zinc/20/95/43/1046209543.db2.gz KLTJIGWBZVBNRL-MRXNPFEDSA-N 2 0 343.490 4.194 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(SCC(F)F)cc1 ZINC000126178379 1046453069 /nfs/dbraw/zinc/45/30/69/1046453069.db2.gz WFIORBFRWOKFJM-ZDUSSCGKSA-N 2 0 328.472 4.036 20 0 EIADRP COCc1ccccc1/C=C(\C)CN(C)CC[C@@H]1CCCC[N@@H+]1C ZINC000508742996 1046493115 /nfs/dbraw/zinc/49/31/15/1046493115.db2.gz IOKVETOHESQPCX-RHYRFBSLSA-N 2 0 330.516 4.043 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000536652413 1046595160 /nfs/dbraw/zinc/59/51/60/1046595160.db2.gz JHVSRCXGPOCXNW-UHFFFAOYSA-N 2 0 339.321 4.001 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cc(C)c(C)cc2OC(F)F)C[C@@H]1C ZINC000536662080 1046632477 /nfs/dbraw/zinc/63/24/77/1046632477.db2.gz NSCXMZUIAFZNCO-DOTOQJQBSA-N 2 0 340.458 4.209 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cc(C)c(Br)s2)C[C@@H]1C ZINC000536662003 1046633607 /nfs/dbraw/zinc/63/36/07/1046633607.db2.gz JXYWTJNXUBXDQY-QWHCGFSZSA-N 2 0 345.350 4.124 20 0 EIADRP CC(C)[C@H](Cc1ccc(F)cc1)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459417492 1046642411 /nfs/dbraw/zinc/64/24/11/1046642411.db2.gz HPAYKBJELRXCIL-NRFANRHFSA-N 2 0 341.474 4.046 20 0 EIADRP FC(F)(F)C1CCC(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)CC1 ZINC000459430988 1046665403 /nfs/dbraw/zinc/66/54/03/1046665403.db2.gz YJVHTXVBZQWNKG-UHFFFAOYSA-N 2 0 341.421 4.009 20 0 EIADRP C[N@H+]1CC=C(C[NH2+]C/C=C/c2ccc(OCc3ccccc3)cc2)CC1 ZINC000459459374 1046699140 /nfs/dbraw/zinc/69/91/40/1046699140.db2.gz HKMIXVYQPAXEBN-VMPITWQZSA-N 2 0 348.490 4.130 20 0 EIADRP Cc1cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)cc(C)c1O ZINC000379615156 1046700797 /nfs/dbraw/zinc/70/07/97/1046700797.db2.gz AFXKGXWHSUNYHN-NQIIRXRSSA-N 2 0 338.495 4.152 20 0 EIADRP C[N@H+](C[C@@H]1C[C@H]1c1ccccc1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000459474218 1046720297 /nfs/dbraw/zinc/72/02/97/1046720297.db2.gz CKMOOIORDNYPOK-UNMCSNQZSA-N 2 0 335.495 4.034 20 0 EIADRP Clc1cc2c(s1)CC[C@@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459558012 1046776584 /nfs/dbraw/zinc/77/65/84/1046776584.db2.gz FYQPGUXOFAEAAV-HNNXBMFYSA-N 2 0 333.888 4.042 20 0 EIADRP C[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)c(Cl)c1 ZINC000536827804 1046797172 /nfs/dbraw/zinc/79/71/72/1046797172.db2.gz ROLMGRDBTRYARV-AWEZNQCLSA-N 2 0 347.865 4.441 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cc1 ZINC000536833506 1046809779 /nfs/dbraw/zinc/80/97/79/1046809779.db2.gz PTOCXSMJNMKQNP-QYZOEREBSA-N 2 0 332.532 4.145 20 0 EIADRP C/C=C\COc1ccc(CC[C@@H](C)[NH2+]C2CC[NH+](C(C)C)CC2)cc1 ZINC000536856370 1046825794 /nfs/dbraw/zinc/82/57/94/1046825794.db2.gz GCLZODXEFNJSOS-SFFCAUCYSA-N 2 0 344.543 4.425 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(F)c(Cl)c1 ZINC000536860578 1046828769 /nfs/dbraw/zinc/82/87/69/1046828769.db2.gz YXDMWRCWYDDBLW-RBSFLKMASA-N 2 0 342.886 4.019 20 0 EIADRP CC(C)CCC[C@@H](C)[NH2+][C@H]1CC[C@H]([NH+]2CCN(CC3CC3)CC2)CC1 ZINC001170063874 1046865943 /nfs/dbraw/zinc/86/59/43/1046865943.db2.gz ILTIBLXJFOHICE-CEMLEFRQSA-N 2 0 349.607 4.130 20 0 EIADRP Cc1cc(NC2CC[NH+](Cc3ccccc3)CC2)ccc1C[NH+](C)C ZINC000459762729 1046874930 /nfs/dbraw/zinc/87/49/30/1046874930.db2.gz NNENKVOHOZBDBT-UHFFFAOYSA-N 2 0 337.511 4.133 20 0 EIADRP COc1ccc([C@H]([NH2+]CCCC[N@@H+]2CCCC[C@H]2C)C2CC2)cc1 ZINC000536947126 1046877001 /nfs/dbraw/zinc/87/70/01/1046877001.db2.gz KCKJLLIOMZRTIG-DYESRHJHSA-N 2 0 330.516 4.391 20 0 EIADRP COc1ccc([C@@H]([NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)C2CC2)cc1 ZINC000536946957 1046877490 /nfs/dbraw/zinc/87/74/90/1046877490.db2.gz BRUZMNDYWFAMTK-UWJYYQICSA-N 2 0 330.516 4.248 20 0 EIADRP Cc1c([C@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)cnn1C(C)C ZINC000786915881 1046881405 /nfs/dbraw/zinc/88/14/05/1046881405.db2.gz OHWFPQKUHZSLAQ-IVMQYODDSA-N 2 0 332.536 4.220 20 0 EIADRP COc1cccc(CC2([NH3+])CC[NH+]([C@H](C)CCCC(C)C)CC2)c1 ZINC001170072219 1047001025 /nfs/dbraw/zinc/00/10/25/1047001025.db2.gz ZDIGTCAYRHCVOP-GOSISDBHSA-N 2 0 332.532 4.246 20 0 EIADRP CCCC1CCC(C[NH+]2CCN(C3CC[NH+](C(C)C)CC3)CC2)CC1 ZINC000537203269 1047036324 /nfs/dbraw/zinc/03/63/24/1047036324.db2.gz UODOFBBPOXKPAC-UHFFFAOYSA-N 2 0 349.607 4.083 20 0 EIADRP CC(C)[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc(F)cn1 ZINC000497868098 1047140717 /nfs/dbraw/zinc/14/07/17/1047140717.db2.gz NCHZGTDXJKDSPA-FUHIMQAGSA-N 2 0 335.511 4.266 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CCC2(F)CCC2)ccc1OC ZINC000806175665 1047161812 /nfs/dbraw/zinc/16/18/12/1047161812.db2.gz DYECWSBECGZBOI-MRXNPFEDSA-N 2 0 336.495 4.470 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CCC2(F)CCC2)ccc1OC ZINC000806175649 1047162200 /nfs/dbraw/zinc/16/22/00/1047162200.db2.gz DYECWSBECGZBOI-INIZCTEOSA-N 2 0 336.495 4.470 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1cc[nH]c(=O)c1 ZINC000788525003 1047199987 /nfs/dbraw/zinc/19/99/87/1047199987.db2.gz AEIGLMZUEHZTQM-IAGOWNOFSA-N 2 0 339.483 4.012 20 0 EIADRP c1ccc2c(c1)OC1(CCCCC1)C[C@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000129754739 1047502328 /nfs/dbraw/zinc/50/23/28/1047502328.db2.gz ZVDGAYLDCXNRIA-YLJYHZDGSA-N 2 0 340.511 4.287 20 0 EIADRP C[NH+](C)C1CCC([NH2+]C(C)(C)c2ccccc2Br)CC1 ZINC001168300173 1047704590 /nfs/dbraw/zinc/70/45/90/1047704590.db2.gz QDCXOJKQGMTGEG-UHFFFAOYSA-N 2 0 339.321 4.147 20 0 EIADRP Cc1ccc([C@H](O)C[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)cc1 ZINC000763432481 1047753025 /nfs/dbraw/zinc/75/30/25/1047753025.db2.gz MBSRKARZGUVNEJ-DENIHFKCSA-N 2 0 344.543 4.005 20 0 EIADRP CC[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(Br)cc1 ZINC000130630735 1047757437 /nfs/dbraw/zinc/75/74/37/1047757437.db2.gz XUKJOKUTTCUMQS-KRWDZBQOSA-N 2 0 339.321 4.222 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000556590218 1047830899 /nfs/dbraw/zinc/83/08/99/1047830899.db2.gz TWXKLECJMUBYKM-MOXQZVSFSA-N 2 0 344.543 4.289 20 0 EIADRP C[N@@H+](Cc1ccc(Cl)cn1)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001136930383 1047912553 /nfs/dbraw/zinc/91/25/53/1047912553.db2.gz PENSUWMSXLHBKB-UHFFFAOYSA-N 2 0 343.902 4.079 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171065228 1047928390 /nfs/dbraw/zinc/92/83/90/1047928390.db2.gz WBTBOSRLCZPNMU-INIZCTEOSA-N 2 0 341.326 4.315 20 0 EIADRP Cc1cc(C[NH2+]C(C)(C)CCC[NH+](C)C)cc(C)c1OC(F)F ZINC000824914530 1047981848 /nfs/dbraw/zinc/98/18/48/1047981848.db2.gz UEQYNXKHBBRTIF-UHFFFAOYSA-N 2 0 328.447 4.115 20 0 EIADRP Cc1ccc2c(C[N@@H+]3CCCC[C@H]3CC[NH+]3CCCC3)c[nH]c2c1 ZINC001136973101 1048016542 /nfs/dbraw/zinc/01/65/42/1048016542.db2.gz MGYQAXVHZNRHQX-IBGZPJMESA-N 2 0 325.500 4.317 20 0 EIADRP COc1ccc(C[N@H+](C(C)C)C2CCN(C)CC2)cc1C(F)(F)F ZINC001143646287 1048134597 /nfs/dbraw/zinc/13/45/97/1048134597.db2.gz MEOSVJWIPNOGKC-UHFFFAOYSA-N 2 0 344.421 4.019 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1Cl)c1ccc(OCC[NH+](C)C)cc1 ZINC000132409075 1048287818 /nfs/dbraw/zinc/28/78/18/1048287818.db2.gz DVPICHCJDUXHFQ-HNNXBMFYSA-N 2 0 332.875 4.131 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(Cl)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000132521003 1048335293 /nfs/dbraw/zinc/33/52/93/1048335293.db2.gz VYNDGZMCSBXFPT-OAHLLOKOSA-N 2 0 332.875 4.131 20 0 EIADRP Fc1ccc(CN[C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(F)c1 ZINC000499147321 1048349482 /nfs/dbraw/zinc/34/94/82/1048349482.db2.gz PALLXCNVDKDQCY-ACDBMABISA-N 2 0 342.433 4.250 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCOC2CCCCC2)C3)cc1 ZINC000499147824 1048355605 /nfs/dbraw/zinc/35/56/05/1048355605.db2.gz QTWSIFAEBHATIJ-WKCHPHFGSA-N 2 0 342.527 4.121 20 0 EIADRP C[N@H+](C1CCC([NH3+])CC1)[C@@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171143553 1048444600 /nfs/dbraw/zinc/44/46/00/1048444600.db2.gz IQYDDNQYRZURMP-YMAMQOFZSA-N 2 0 327.299 4.052 20 0 EIADRP CCCCc1ccc([C@@H](C)[NH2+]C2CC[NH+](C[C@@H]3CCOC3)CC2)cc1 ZINC000132796739 1048499663 /nfs/dbraw/zinc/49/96/63/1048499663.db2.gz MAFKPMIZKIMRNM-QUCCMNQESA-N 2 0 344.543 4.181 20 0 EIADRP CC(C)Oc1ccc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000809738632 1048509608 /nfs/dbraw/zinc/50/96/08/1048509608.db2.gz CJWPNAAIINEGPR-UHFFFAOYSA-N 2 0 326.484 4.167 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2ccc(OCC3CC3)cc2)cc1 ZINC000809738715 1048510500 /nfs/dbraw/zinc/51/05/00/1048510500.db2.gz GIYYCRZFZIWWSG-UHFFFAOYSA-N 2 0 338.495 4.169 20 0 EIADRP Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3cc[nH+]cc3C(F)(F)F)c2c1 ZINC001171169918 1048622134 /nfs/dbraw/zinc/62/21/34/1048622134.db2.gz SLEBRERAKYUBDD-LBPRGKRZSA-N 2 0 333.357 4.242 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CC[C@]2(C)C[C@]2(F)Cl)CC1 ZINC000846030933 1048798518 /nfs/dbraw/zinc/79/85/18/1048798518.db2.gz GGJQATBDRDJMCF-BZZMCLGOSA-N 2 0 330.919 4.324 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCN(Cc2cc(Cl)cc3cccnc32)C1 ZINC000076000868 1048834173 /nfs/dbraw/zinc/83/41/73/1048834173.db2.gz XPPIQCCUVHFTCX-HNNXBMFYSA-N 2 0 331.891 4.052 20 0 EIADRP [NH3+]CCCCCC[N@@H+]1CCC[C@H]1c1ccc(Br)s1 ZINC000846223928 1048843756 /nfs/dbraw/zinc/84/37/56/1048843756.db2.gz QLNWOGBLEMYBTG-LBPRGKRZSA-N 2 0 331.323 4.167 20 0 EIADRP Cc1cc2cc(C[NH2+]CCCC[NH+]3C[C@@H](C)O[C@H](C)C3)oc2cc1C ZINC000237404054 1048938605 /nfs/dbraw/zinc/93/86/05/1048938605.db2.gz ZBQHAZJUHAPWKJ-QZTJIDSGSA-N 2 0 344.499 4.029 20 0 EIADRP Cc1cc2cc(C[NH2+]CCCC[NH+]3C[C@H](C)O[C@@H](C)C3)oc2cc1C ZINC000237609333 1048967756 /nfs/dbraw/zinc/96/77/56/1048967756.db2.gz ZBQHAZJUHAPWKJ-ROUUACIJSA-N 2 0 344.499 4.029 20 0 EIADRP C[C@@H]([NH2+][C@H]1CCCc2sccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000134971085 1049048670 /nfs/dbraw/zinc/04/86/70/1049048670.db2.gz LVMVZDGGLLXSBL-BEFAXECRSA-N 2 0 344.524 4.417 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](c1ccccc1)c1ccc2c(c1)CCCO2 ZINC000817912799 1049057781 /nfs/dbraw/zinc/05/77/81/1049057781.db2.gz XXUJGAVYBGSQDB-VGSWGCGISA-N 2 0 338.495 4.208 20 0 EIADRP CC[NH+]1CCC(C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C)CC1 ZINC001146792998 1049058392 /nfs/dbraw/zinc/05/83/92/1049058392.db2.gz SLCZFEJXFYAFEO-UHFFFAOYSA-N 2 0 342.508 4.304 20 0 EIADRP Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)CCS2 ZINC000817949447 1049063518 /nfs/dbraw/zinc/06/35/18/1049063518.db2.gz QXPOPEABAKGWPE-IBGZPJMESA-N 2 0 326.509 4.131 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1ccc(OC(F)F)cc1 ZINC000817948288 1049064715 /nfs/dbraw/zinc/06/47/15/1049064715.db2.gz WQBSDDBMNQOLBS-GOSISDBHSA-N 2 0 334.410 4.030 20 0 EIADRP COc1ccccc1[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)C1CCCC1 ZINC000817947678 1049064934 /nfs/dbraw/zinc/06/49/34/1049064934.db2.gz FMRJIGRQWZMIFI-JOCHJYFZSA-N 2 0 338.495 4.218 20 0 EIADRP COc1ccc2oc([C@@H](C)[NH2+]Cc3ccc(CC[NH3+])cc3)c(C)c2c1 ZINC000817950277 1049065081 /nfs/dbraw/zinc/06/50/81/1049065081.db2.gz XQKLEEASEOIXLS-OAHLLOKOSA-N 2 0 338.451 4.102 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000817981664 1049076753 /nfs/dbraw/zinc/07/67/53/1049076753.db2.gz MHHRQTKWSKLLQJ-PVXIVEMSSA-N 2 0 326.456 4.096 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+](C)C)c(F)c1)c1ccc(F)cc1F ZINC000135299139 1049108177 /nfs/dbraw/zinc/10/81/77/1049108177.db2.gz OTZZIOSOQIAUBF-IBGZPJMESA-N 2 0 336.401 4.406 20 0 EIADRP Cc1cc[nH+]c(N([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)c1C ZINC001170644711 1049275829 /nfs/dbraw/zinc/27/58/29/1049275829.db2.gz UGCSPYAEPJVKJG-NSKBAKJYSA-N 2 0 335.495 4.331 20 0 EIADRP Fc1cc(F)c2c(c1)C[C@@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CC2 ZINC001171353229 1049509142 /nfs/dbraw/zinc/50/91/42/1049509142.db2.gz FOJVKMLDZUMMSZ-SFHVURJKSA-N 2 0 348.481 4.209 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1OCC1CC1)c1cccc(C[NH+](C)C)c1 ZINC000820811760 1049553292 /nfs/dbraw/zinc/55/32/92/1049553292.db2.gz VWUHBQBJTXBKPG-KRWDZBQOSA-N 2 0 338.495 4.388 20 0 EIADRP CCCC[NH+]1CCC([N@H+](C)[C@@H]2CCc3c(F)cc(F)cc3C2)CC1 ZINC001171382822 1049579763 /nfs/dbraw/zinc/57/97/63/1049579763.db2.gz NCBIFYMSGSSTNA-GOSISDBHSA-N 2 0 336.470 4.018 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCc3ccccc3OC2)CC1 ZINC000511007818 1049620557 /nfs/dbraw/zinc/62/05/57/1049620557.db2.gz CMXYHWUMGOULEM-QMMLZNLJSA-N 2 0 342.527 4.013 20 0 EIADRP C[C@@]12CC3([NH3+])CC([NH2+][C@H]4CCc5c(F)cccc5C4)(C1)C[C@](C)(C3)C2 ZINC001171408164 1049637181 /nfs/dbraw/zinc/63/71/81/1049637181.db2.gz KQXUSCGIHSTTJC-DIFKXBQNSA-N 2 0 342.502 4.103 20 0 EIADRP C[NH+](C)CCC1CC[NH+](CCOc2c(Cl)cccc2Cl)CC1 ZINC000615464067 1049696411 /nfs/dbraw/zinc/69/64/11/1049696411.db2.gz KCAQQKSDFVPBAJ-UHFFFAOYSA-N 2 0 345.314 4.036 20 0 EIADRP CC1(C[NH2+][C@@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)CC(F)(F)C1 ZINC000716691667 1049701754 /nfs/dbraw/zinc/70/17/54/1049701754.db2.gz JICNGSHUMMIDBZ-KSZLIROESA-N 2 0 334.454 4.065 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(Cl)c3cccnc23)[C@@H](C)C1 ZINC000245426610 1049720919 /nfs/dbraw/zinc/72/09/19/1049720919.db2.gz LMOVSLVEFVKZSF-KSSFIOAISA-N 2 0 331.891 4.050 20 0 EIADRP CCC(CC)[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2cccc(F)c2C1 ZINC001170975624 1049729862 /nfs/dbraw/zinc/72/98/62/1049729862.db2.gz YEASFUVOIWDTJE-BHIYHBOVSA-N 2 0 332.507 4.444 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171474685 1049729650 /nfs/dbraw/zinc/72/96/50/1049729650.db2.gz WMENWROHLKUGRM-KURKYZTESA-N 2 0 336.470 4.065 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171474684 1049730127 /nfs/dbraw/zinc/73/01/27/1049730127.db2.gz WMENWROHLKUGRM-BZSNNMDCSA-N 2 0 336.470 4.065 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC2(C1)CC[NH2+]CC2)c1ccc(Br)s1 ZINC001246175149 1049749765 /nfs/dbraw/zinc/74/97/65/1049749765.db2.gz HEEZEHVLTQOUQU-NWDGAFQWSA-N 2 0 343.334 4.084 20 0 EIADRP Cc1cccc2c1CC[C@@H]([N@H+](CC(C)(C)C)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171557401 1049755262 /nfs/dbraw/zinc/75/52/62/1049755262.db2.gz APYGVZYFYLSYRR-VAMGGRTRSA-N 2 0 328.544 4.470 20 0 EIADRP Cc1cccc2c1CC[C@@H]([NH2+]C1CC[NH+](C[C@H]3CC=CCC3)CC1)C2 ZINC001171563777 1049756932 /nfs/dbraw/zinc/75/69/32/1049756932.db2.gz MJMSILRNFOCPAX-SIKLNZKXSA-N 2 0 338.539 4.263 20 0 EIADRP Cc1ccccc1OC1CC[NH+](C2CC(C)(C)[NH+](C)C(C)(C)C2)CC1 ZINC001171628715 1049762694 /nfs/dbraw/zinc/76/26/94/1049762694.db2.gz HNOHBWDKFVKOND-UHFFFAOYSA-N 2 0 344.543 4.490 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CCCOc2ccc(Cl)cc2)CC1(C)C ZINC001171619049 1049766635 /nfs/dbraw/zinc/76/66/35/1049766635.db2.gz FVXJYXYXQXSTCW-UHFFFAOYSA-N 2 0 338.923 4.350 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@H]2CCc3ccc(Cl)cc3C2)CC1(C)C ZINC001171624833 1049768150 /nfs/dbraw/zinc/76/81/50/1049768150.db2.gz ZIFPUZRZTOENIV-KRWDZBQOSA-N 2 0 334.935 4.438 20 0 EIADRP COc1ccc([C@H]2CCC[N@@H+]2C2CC(C)(C)[NH+](C)C(C)(C)C2)cc1 ZINC001171637892 1049778936 /nfs/dbraw/zinc/77/89/36/1049778936.db2.gz RFFPGFWIMOVNKM-LJQANCHMSA-N 2 0 330.516 4.484 20 0 EIADRP C[C@H]1C[C@@H](n2cc(CCC[NH3+])c3ccccc32)C[N@@H+]1Cc1ccccc1 ZINC001171724897 1049784697 /nfs/dbraw/zinc/78/46/97/1049784697.db2.gz DWJZEQKCPYGLPQ-GHTZIAJQSA-N 2 0 347.506 4.368 20 0 EIADRP C[NH2+]Cc1ccc2c(ccn2[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC001171744481 1049789533 /nfs/dbraw/zinc/78/95/33/1049789533.db2.gz HARYVHNJWSHJRN-UWJYYQICSA-N 2 0 333.479 4.196 20 0 EIADRP CCO[C@@H](CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)C ZINC000245652586 1049812736 /nfs/dbraw/zinc/81/27/36/1049812736.db2.gz CWXFAGRQCRRPFQ-LRSLUSHPSA-N 2 0 344.543 4.223 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CCC[NH+]1CCCCC1 ZINC001171960266 1049823271 /nfs/dbraw/zinc/82/32/71/1049823271.db2.gz UJBZOTSUXHKMAV-HNNXBMFYSA-N 2 0 328.422 4.102 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CCCc2ccncc2)CC[N@@H+]1Cc1ccccc1 ZINC001171965607 1049826740 /nfs/dbraw/zinc/82/67/40/1049826740.db2.gz IJYUGEAMADSSQJ-NRFANRHFSA-N 2 0 337.511 4.047 20 0 EIADRP CCCC[N@H+](CC)CCN[C@@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171967848 1049827536 /nfs/dbraw/zinc/82/75/36/1049827536.db2.gz NOUADJDYHAGQCJ-OAQYLSRUSA-N 2 0 345.575 4.141 20 0 EIADRP COc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)cc1 ZINC001171969230 1049833903 /nfs/dbraw/zinc/83/39/03/1049833903.db2.gz UOYVCPCSIIQBEJ-FQEVSTJZSA-N 2 0 338.495 4.228 20 0 EIADRP CC1(C)C[C@H]([NH2+]CCCCCCCCO)CC[N@@H+]1Cc1ccccc1 ZINC001171974587 1049835805 /nfs/dbraw/zinc/83/58/05/1049835805.db2.gz IAQCLUDBHGWDBE-OAQYLSRUSA-N 2 0 346.559 4.352 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@@H]2CCCc3ccncc32)CC[N@@H+]1Cc1ccccc1 ZINC001171978816 1049838763 /nfs/dbraw/zinc/83/87/63/1049838763.db2.gz LXYKHVYJZMYIQL-IFMALSPDSA-N 2 0 349.522 4.492 20 0 EIADRP CC1(C)C[C@H](n2ncc3cccc(C[NH3+])c32)CC[N@@H+]1Cc1ccccc1 ZINC001171982086 1049839259 /nfs/dbraw/zinc/83/92/59/1049839259.db2.gz HCNRTDDKFHTOLZ-HXUWFJFHSA-N 2 0 348.494 4.111 20 0 EIADRP CCSCC[C@@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245737328 1049842370 /nfs/dbraw/zinc/84/23/70/1049842370.db2.gz QZQGFFKAEDZWGR-AFYVEPGGSA-N 2 0 332.557 4.303 20 0 EIADRP Oc1ccc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC001172060688 1049842415 /nfs/dbraw/zinc/84/24/15/1049842415.db2.gz BJISDRZABXJWFJ-WKCHPHFGSA-N 2 0 336.479 4.068 20 0 EIADRP CCCO[C@@H]1CC[N@@H+]([C@@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)C1 ZINC001172076487 1049844145 /nfs/dbraw/zinc/84/41/45/1049844145.db2.gz ZOQFPJVFVLRDEC-CIAFKFPVSA-N 2 0 342.527 4.073 20 0 EIADRP C[N@H+](CCc1ccccn1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172080070 1049846767 /nfs/dbraw/zinc/84/67/67/1049846767.db2.gz SSKHAOUFIRGTJI-NUNAXRQHSA-N 2 0 349.522 4.142 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccncc1 ZINC001172066625 1049851183 /nfs/dbraw/zinc/85/11/83/1049851183.db2.gz JPPHKUJKYSZQNR-CIQXWFTPSA-N 2 0 335.495 4.318 20 0 EIADRP FC1(F)C[C@@H]2C[N@@H+]([C@H]3C[C@H]4CCC[C@@H](C3)[NH+]4Cc3ccccc3)C[C@@H]21 ZINC001172068506 1049853140 /nfs/dbraw/zinc/85/31/40/1049853140.db2.gz JFWVPBFSZWNNEP-SLHNCBLASA-N 2 0 346.465 4.159 20 0 EIADRP CCCC(O)(CCC)C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245777046 1049853146 /nfs/dbraw/zinc/85/31/46/1049853146.db2.gz YGWYMWBIMYDRSF-MZADTFQBSA-N 2 0 344.543 4.103 20 0 EIADRP C[N@H+](Cc1cc(Cl)cc(Cl)c1)[C@@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172134763 1049854373 /nfs/dbraw/zinc/85/43/73/1049854373.db2.gz ZHYKRJWUDAJQBJ-BJWYYQGGSA-N 2 0 327.299 4.441 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+]C3C[C@H]4CC[C@@H](C3)O4)[C@@H](C)C2)CC[C@H]1[NH3+] ZINC001172224584 1049867793 /nfs/dbraw/zinc/86/77/93/1049867793.db2.gz UJKCPLPHUNDJIV-XDZWNRBWSA-N 2 0 348.575 4.244 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCC2)[C@@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171024668 1049869270 /nfs/dbraw/zinc/86/92/70/1049869270.db2.gz GCKYUOWWTVTAOQ-KBAYOESNSA-N 2 0 332.919 4.322 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@@H]2CSc3ccccc3C2)CC1 ZINC001172200074 1049869404 /nfs/dbraw/zinc/86/94/04/1049869404.db2.gz GGSULAYCOMXABS-WDSOQIARSA-N 2 0 330.541 4.218 20 0 EIADRP Clc1cccc2c1CC[C@@H]([NH2+]CC1CC[NH+](C3CCC3)CC1)C2 ZINC001171031225 1049875866 /nfs/dbraw/zinc/87/58/66/1049875866.db2.gz UCEGSOANAHVMJD-QGZVFWFLSA-N 2 0 332.919 4.051 20 0 EIADRP CC[C@@H](C)OCC[C@@H](C)[NH2+]CCC1CC[NH+](Cc2ccccc2)CC1 ZINC001172317868 1049876657 /nfs/dbraw/zinc/87/66/57/1049876657.db2.gz VRWCRZSNOPQFKV-WOJBJXKFSA-N 2 0 346.559 4.472 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[N@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172338327 1049887607 /nfs/dbraw/zinc/88/76/07/1049887607.db2.gz YITITDVMSAJPDY-QIJZPMMNSA-N 2 0 332.532 4.352 20 0 EIADRP CC[C@@H](C)OCC[C@@H](C)[N@H+](Cc1ccccc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172338329 1049887787 /nfs/dbraw/zinc/88/77/87/1049887787.db2.gz YITITDVMSAJPDY-VURPSTOHSA-N 2 0 332.532 4.352 20 0 EIADRP CC[C@H](CC(C)C)[NH+]1CCC2(CC1)C[N@H+](Cc1ccccc1)CCO2 ZINC001172398020 1049906745 /nfs/dbraw/zinc/90/67/45/1049906745.db2.gz MTKKZRKVMGGYMO-OAQYLSRUSA-N 2 0 344.543 4.178 20 0 EIADRP CC(C)OCC[C@@H](C)[N@H+]([C@@H]1C[C@H]1c1ccccc1)C1CCC([NH3+])CC1 ZINC001172439234 1049912332 /nfs/dbraw/zinc/91/23/32/1049912332.db2.gz AFGPMKKDASSXIK-XUWGEKFYSA-N 2 0 344.543 4.318 20 0 EIADRP Cc1ccccc1C[N@@H+]([C@@H](C)CCOC(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172445805 1049914177 /nfs/dbraw/zinc/91/41/77/1049914177.db2.gz UDMHMQMOYQQXPX-JBACZVJFSA-N 2 0 332.532 4.271 20 0 EIADRP CCCCCC[C@H](CCCC)[NH+]1CCC(N2CC[NH+](C)CC2)CC1 ZINC001172511985 1049926864 /nfs/dbraw/zinc/92/68/64/1049926864.db2.gz BEJMXGKRSXVTFA-FQEVSTJZSA-N 2 0 337.596 4.227 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@H]1CCC[N@H+](C)CC1 ZINC001172576997 1049932658 /nfs/dbraw/zinc/93/26/58/1049932658.db2.gz QLAKXGGTKDLWKQ-OCCSQVGLSA-N 2 0 330.850 4.013 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000246252180 1049937413 /nfs/dbraw/zinc/93/74/13/1049937413.db2.gz WKDZRVQOBNPRSP-CABCVRRESA-N 2 0 326.406 4.184 20 0 EIADRP C[C@@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000246252185 1049937714 /nfs/dbraw/zinc/93/77/14/1049937714.db2.gz WKDZRVQOBNPRSP-GJZGRUSLSA-N 2 0 326.406 4.184 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH+]1CCC(C[NH+](C)C)CC1 ZINC001172574676 1049941556 /nfs/dbraw/zinc/94/15/56/1049941556.db2.gz SBFOXIAPHYVQQN-ZDUSSCGKSA-N 2 0 344.877 4.213 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]CCc2nc(C3CCCCC3)cs2)[C@@H](C)C1 ZINC000246263800 1049942129 /nfs/dbraw/zinc/94/21/29/1049942129.db2.gz AADPSAOILARXLX-DOTOQJQBSA-N 2 0 335.561 4.053 20 0 EIADRP Cc1c[nH+]ccc1N1CC[NH+]([C@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172548689 1049948133 /nfs/dbraw/zinc/94/81/33/1049948133.db2.gz HNIGAXJHIFJNKM-RTWAWAEBSA-N 2 0 335.495 4.238 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC001172578993 1049951677 /nfs/dbraw/zinc/95/16/77/1049951677.db2.gz TYZPFXSKYOZBLH-YUELXQCFSA-N 2 0 344.877 4.402 20 0 EIADRP Clc1ccc2c(c1)C[C@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001172716990 1049963813 /nfs/dbraw/zinc/96/38/13/1049963813.db2.gz CQOYCAKNRKWRDN-WOJBJXKFSA-N 2 0 332.919 4.148 20 0 EIADRP Clc1ccc2c(c1)C[C@@H]([NH2+]C1CC[NH+](C[C@H]3CC=CCC3)CC1)C2 ZINC001172717002 1049963899 /nfs/dbraw/zinc/96/38/99/1049963899.db2.gz VAZPHKHLLIUKTF-KKSFZXQISA-N 2 0 344.930 4.218 20 0 EIADRP CC(C)[N@H+](C)Cc1nn(C2CCC3(CCCC3)CC2)c2c1CC[NH2+]C2 ZINC001172726098 1049966682 /nfs/dbraw/zinc/96/66/82/1049966682.db2.gz KQVLIOKGJWRCFM-UHFFFAOYSA-N 2 0 344.547 4.045 20 0 EIADRP C[N@H+](C1CCOCC1)C1CC[NH+](C2CCC3(CCCC3)CC2)CC1 ZINC001172730095 1049969035 /nfs/dbraw/zinc/96/90/35/1049969035.db2.gz VLZLGCHQSPFQMJ-UHFFFAOYSA-N 2 0 334.548 4.065 20 0 EIADRP CC(C)OC(=O)CC[C@H](C)[N@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172750808 1049970834 /nfs/dbraw/zinc/97/08/34/1049970834.db2.gz GFCIBTMYAMZHNG-LNLFQRSKSA-N 2 0 338.536 4.011 20 0 EIADRP CC[C@@H]1C[C@H](C)CC[C@@H]1[NH2+]C1CCN([C@H](C)c2ccncc2)CC1 ZINC000246547244 1049984951 /nfs/dbraw/zinc/98/49/51/1049984951.db2.gz WHFRBBYBBHCZOH-IKVWTGGYSA-N 2 0 329.532 4.411 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+][C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000248410271 1050055133 /nfs/dbraw/zinc/05/51/33/1050055133.db2.gz XWFVSDGZTDXWMT-RMJJICAUSA-N 2 0 344.543 4.430 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)C1 ZINC000249163588 1050093354 /nfs/dbraw/zinc/09/33/54/1050093354.db2.gz ZXQGROWEKLXDSQ-KSZLIROESA-N 2 0 340.433 4.219 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([N@H+](Cc1cccnc1)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828485 1050166605 /nfs/dbraw/zinc/16/66/05/1050166605.db2.gz MOVPGRFNCOBVAM-VABKMULXSA-N 2 0 349.522 4.019 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([N@H+](Cc1ccncc1)[C@H]1CC[C@H]([NH3+])CC1)CC2 ZINC001172828349 1050166807 /nfs/dbraw/zinc/16/68/07/1050166807.db2.gz LDVPTFAARPEPCI-VABKMULXSA-N 2 0 349.522 4.019 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2cc(F)cc(Cl)c2)C1 ZINC001177289364 1050177745 /nfs/dbraw/zinc/17/77/45/1050177745.db2.gz FEIPOJLDYPWTBL-HUUCEWRRSA-N 2 0 326.887 4.327 20 0 EIADRP Cc1cc(C[NH2+]CCCC[N@H+]2CCCC[C@@H]2C)cc2cccnc12 ZINC001177299697 1050179473 /nfs/dbraw/zinc/17/94/73/1050179473.db2.gz ZJVOVDCXQYQILJ-SFHVURJKSA-N 2 0 325.500 4.287 20 0 EIADRP CC(C)c1ccc([C@H](C)[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3O)CC2)cc1 ZINC000090525186 1050181579 /nfs/dbraw/zinc/18/15/79/1050181579.db2.gz CHTSLWUHFDLEHC-HSQYWUDLSA-N 2 0 344.543 4.229 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)[N@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172848088 1050185988 /nfs/dbraw/zinc/18/59/88/1050185988.db2.gz QAXZUNQXGPYOIJ-BPUTZDHNSA-N 2 0 338.898 4.392 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[N@@H+]1CCCC[C@H](CCC[NH3+])C1 ZINC001172860345 1050198410 /nfs/dbraw/zinc/19/84/10/1050198410.db2.gz CMWHILMRNJKCCY-LSDHHAIUSA-N 2 0 326.887 4.251 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)n1cc(CC[NH3+])c2c[nH+]ccc21 ZINC001172860301 1050199242 /nfs/dbraw/zinc/19/92/42/1050199242.db2.gz ZRJMFSSAIDFQAN-GFCCVEGCSA-N 2 0 331.822 4.134 20 0 EIADRP CCCC[NH+]1CCC([NH2+]Cc2ccc(CC(F)(F)F)cc2)CC1 ZINC001177506866 1050231291 /nfs/dbraw/zinc/23/12/91/1050231291.db2.gz VBLTTZFPGDJQKE-UHFFFAOYSA-N 2 0 328.422 4.146 20 0 EIADRP Cc1cc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cnc1Cl ZINC001177561835 1050252661 /nfs/dbraw/zinc/25/26/61/1050252661.db2.gz CFBGFXQCINYKKW-UHFFFAOYSA-N 2 0 349.931 4.107 20 0 EIADRP CC(C)[C@H]1C[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)CCO1 ZINC001177566645 1050255423 /nfs/dbraw/zinc/25/54/23/1050255423.db2.gz YFUUGMVKDJSXQV-FCHUYYIVSA-N 2 0 344.543 4.356 20 0 EIADRP [NH3+][C@H]1CC[N@H+](Cc2ccc(Oc3ccc(Cl)cc3)cc2)CC[C@H]1F ZINC001206187035 1050266832 /nfs/dbraw/zinc/26/68/32/1050266832.db2.gz SPPOBVFIHDKCNA-MOPGFXCFSA-N 2 0 348.849 4.394 20 0 EIADRP CC[C@H]1C[C@@H](C[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)CCO1 ZINC001177743136 1050291876 /nfs/dbraw/zinc/29/18/76/1050291876.db2.gz LRVXUTJKWDYWLV-UNMCSNQZSA-N 2 0 344.543 4.213 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H]2CCO[C@@H](c3ccccc3)C2)CC1 ZINC001173104317 1050304906 /nfs/dbraw/zinc/30/49/06/1050304906.db2.gz MVHBCEZSTFJJOP-GOLJUSPKSA-N 2 0 330.516 4.149 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](c2ccccc2)c2ccccn2)CC1 ZINC001173103488 1050305189 /nfs/dbraw/zinc/30/51/89/1050305189.db2.gz JMZAIMFMBCYIHS-QETWGEEDSA-N 2 0 337.511 4.414 20 0 EIADRP CC[NH+](CC)C1CCC([N@H+](C)Cc2ncccc2C(F)(F)F)CC1 ZINC001173110289 1050306917 /nfs/dbraw/zinc/30/69/17/1050306917.db2.gz QXMXWMHKJKHDDE-UHFFFAOYSA-N 2 0 343.437 4.185 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](C)[C@H](O)c2ccc(Cl)cc2)CC1 ZINC001173107843 1050308291 /nfs/dbraw/zinc/30/82/91/1050308291.db2.gz PILBQJZONHUHNN-QKHJWGRCSA-N 2 0 338.923 4.005 20 0 EIADRP CCCOC1CCC([NH+]2CCC([N@H+](C)Cc3ccccc3)CC2)CC1 ZINC001173099765 1050322606 /nfs/dbraw/zinc/32/26/06/1050322606.db2.gz SFACDBXDMQZTFD-UHFFFAOYSA-N 2 0 344.543 4.321 20 0 EIADRP CC(C)C[NH+]1CCC(C[NH2+]C2CCC(Oc3ccccc3)CC2)CC1 ZINC001173198759 1050341881 /nfs/dbraw/zinc/34/18/81/1050341881.db2.gz FUOFPGMMZHLEPO-UHFFFAOYSA-N 2 0 344.543 4.334 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC[NH2+]C1CCC(Oc2ccccc2)CC1 ZINC001173198161 1050342848 /nfs/dbraw/zinc/34/28/48/1050342848.db2.gz PCWCUJDIATVAOR-JSOIOWGOSA-N 2 0 330.516 4.231 20 0 EIADRP COc1ccc(C[NH2+]C2CC[NH+](C3CCCC3)CC2)c2ccccc12 ZINC001177947794 1050344144 /nfs/dbraw/zinc/34/41/44/1050344144.db2.gz AABYTCMYAIIIMV-UHFFFAOYSA-N 2 0 338.495 4.345 20 0 EIADRP CCSC[C@@H](C)[NH+]1CCC2(CC[N@H+](Cc3cccs3)C2)CC1 ZINC001173303189 1050401826 /nfs/dbraw/zinc/40/18/26/1050401826.db2.gz FKPMXAKRRRHNRG-MRXNPFEDSA-N 2 0 338.586 4.178 20 0 EIADRP CCOc1cc(F)cc(C[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)c1 ZINC001178280865 1050426557 /nfs/dbraw/zinc/42/65/57/1050426557.db2.gz XIKATHCLZHZVEZ-UHFFFAOYSA-N 2 0 348.506 4.357 20 0 EIADRP COc1ccccc1/C=C/C[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC001178280425 1050426994 /nfs/dbraw/zinc/42/69/94/1050426994.db2.gz CDRDTVFGFKCWIF-FNORWQNLSA-N 2 0 342.527 4.341 20 0 EIADRP Fc1ccccc1C[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC001178285382 1050427826 /nfs/dbraw/zinc/42/78/26/1050427826.db2.gz QAXIYOGTYUTDBU-JAXLGGSGSA-N 2 0 338.470 4.216 20 0 EIADRP CCSC[C@@H](C)[N@@H+]1CCC[C@@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001173316898 1050438744 /nfs/dbraw/zinc/43/87/44/1050438744.db2.gz ZXJXFAKGJBTVDR-QUCCMNQESA-N 2 0 332.557 4.116 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2c1CCC2)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001178331335 1050438853 /nfs/dbraw/zinc/43/88/53/1050438853.db2.gz QCNMOXNMEMRELY-XMSQKQJNSA-N 2 0 334.507 4.176 20 0 EIADRP Cc1ccccc1N(C)c1ccc(C[N@H+]2CC[C@@H](F)[C@@H]([NH3+])CC2)cc1 ZINC001206200337 1050454466 /nfs/dbraw/zinc/45/44/66/1050454466.db2.gz RDIFAKHMJAFRJT-UXHICEINSA-N 2 0 341.474 4.024 20 0 EIADRP C[N@H+](C1Cc2cc(F)c(F)cc2C1)C1CC[NH+](C2CCCCC2)CC1 ZINC001173481575 1050461770 /nfs/dbraw/zinc/46/17/70/1050461770.db2.gz MZFZEPMIYUYRPZ-UHFFFAOYSA-N 2 0 348.481 4.161 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC001173539960 1050475410 /nfs/dbraw/zinc/47/54/10/1050475410.db2.gz VDHGRYNDANWJNF-UKRRQHHQSA-N 2 0 329.315 4.246 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC001173544986 1050477137 /nfs/dbraw/zinc/47/71/37/1050477137.db2.gz VDHGRYNDANWJNF-HIFRSBDPSA-N 2 0 329.315 4.246 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+]C3CCc4ccccc4CC3)C2)cc1 ZINC001178609377 1050518574 /nfs/dbraw/zinc/51/85/74/1050518574.db2.gz GKFRPYXKHZZZBR-HXUWFJFHSA-N 2 0 334.507 4.046 20 0 EIADRP C[N@@H+]1CCc2ccc(Nc3cccc(C[NH+]4CCCCC4)c3)cc2C1 ZINC001204128287 1050525633 /nfs/dbraw/zinc/52/56/33/1050525633.db2.gz RQYXNVDQWRZKET-UHFFFAOYSA-N 2 0 335.495 4.404 20 0 EIADRP C[NH+]1CCC2(CC[N@@H+](C3CCC4(CCc5ccccc54)CC3)C2)CC1 ZINC001173689170 1050544460 /nfs/dbraw/zinc/54/44/60/1050544460.db2.gz HGMXHIVWNPIOCQ-UHFFFAOYSA-N 2 0 338.539 4.231 20 0 EIADRP CCC[NH+]1CCN(c2ccccc2C[NH2+][C@@H](C)CC(C)(C)C)CC1 ZINC001178882271 1050576758 /nfs/dbraw/zinc/57/67/58/1050576758.db2.gz VDSPYRLOFICQEI-SFHVURJKSA-N 2 0 331.548 4.133 20 0 EIADRP C[C@H](CCc1ccccc1)C[NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1 ZINC001179015470 1050611344 /nfs/dbraw/zinc/61/13/44/1050611344.db2.gz BFXNBSAUVWDFFI-PTUXOGIPSA-N 2 0 336.523 4.190 20 0 EIADRP COC[C@@H](CC(C)(C)C)[NH2+][C@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC001179034369 1050622136 /nfs/dbraw/zinc/62/21/36/1050622136.db2.gz FCKNKYXZSNDFQU-VQTJNVASSA-N 2 0 344.543 4.224 20 0 EIADRP CCc1nc(C[NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)cs1 ZINC001179278341 1050668458 /nfs/dbraw/zinc/66/84/58/1050668458.db2.gz VFUHMHOEHYUEOX-UHFFFAOYSA-N 2 0 343.540 4.097 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]C1CCc2ccccc2CC1 ZINC001179338363 1050679237 /nfs/dbraw/zinc/67/92/37/1050679237.db2.gz GKMNTOZAAUPNIX-CVDCTZTESA-N 2 0 348.534 4.292 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](C)c1ccccc1N(C)C ZINC000093941674 1050724024 /nfs/dbraw/zinc/72/40/24/1050724024.db2.gz XKMPQMRZSVAAOP-GOSISDBHSA-N 2 0 339.527 4.445 20 0 EIADRP CC[NH+](CC)CC[C@H]([NH2+][C@@H]1CC[C@H]2COCC[C@H]2C1)c1ccccc1 ZINC001179805561 1050784359 /nfs/dbraw/zinc/78/43/59/1050784359.db2.gz KBJKKAICFGUQIW-KJJMTIBFSA-N 2 0 344.543 4.254 20 0 EIADRP C[C@]1(C[N@@H+]2CC[C@]3(C2)CCC[NH+](Cc2ccccc2)C3)CCCS1 ZINC001179864191 1050809536 /nfs/dbraw/zinc/80/95/36/1050809536.db2.gz UUAYLZCESMAYMU-NHCUHLMSSA-N 2 0 344.568 4.260 20 0 EIADRP CC[NH+]1CCC(C[N@H+]2Cc3ccccc3[C@H](c3ccccc3)C2)CC1 ZINC001179969298 1050851643 /nfs/dbraw/zinc/85/16/43/1050851643.db2.gz AFLRUMXUSJPAKG-QHCPKHFHSA-N 2 0 334.507 4.366 20 0 EIADRP CC[N@H+](CC1CC[NH+](CC)CC1)[C@H](Cc1ccc(F)cc1)C(C)C ZINC001180064422 1050870805 /nfs/dbraw/zinc/87/08/05/1050870805.db2.gz IMPGRCSWYQLWCJ-OAQYLSRUSA-N 2 0 334.523 4.447 20 0 EIADRP CC[NH+](CC)CCO[C@@H]1CC[N@H+](C/C=C\c2cc(C)c(C)cc2C)C1 ZINC001180081738 1050876775 /nfs/dbraw/zinc/87/67/75/1050876775.db2.gz NLLAXUWXTMNCQD-FMFFHWJCSA-N 2 0 344.543 4.058 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2ccc(OCC3CC3)cc2)CC1 ZINC001180125420 1050892238 /nfs/dbraw/zinc/89/22/38/1050892238.db2.gz ZCEULUQSKYVMCI-UHFFFAOYSA-N 2 0 344.543 4.419 20 0 EIADRP Fc1cccc(/C=C\C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)c1 ZINC001180125219 1050892618 /nfs/dbraw/zinc/89/26/18/1050892618.db2.gz WFEXFPNTNTWLOY-VURMDHGXSA-N 2 0 330.491 4.427 20 0 EIADRP COc1ccc([C@@H](C)[NH2+][C@H](C)CSC)cc1C[NH+]1CCCCC1 ZINC000182995993 1050926097 /nfs/dbraw/zinc/92/60/97/1050926097.db2.gz RIBHBZONMAPQAY-HZPDHXFCSA-N 2 0 336.545 4.083 20 0 EIADRP Cc1cc(C)cc(CC[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC001180350251 1050964854 /nfs/dbraw/zinc/96/48/54/1050964854.db2.gz WYNODVIKEGDCLT-NZQKXSOJSA-N 2 0 336.523 4.346 20 0 EIADRP CO[C@H](C[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)C1CCCCC1 ZINC001180350278 1050965375 /nfs/dbraw/zinc/96/53/75/1050965375.db2.gz XOTYMGOJWPLFAR-STZQEDGTSA-N 2 0 344.543 4.082 20 0 EIADRP COc1ccc(SCC[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC001180795288 1051080884 /nfs/dbraw/zinc/08/08/84/1051080884.db2.gz UOTZOKJBQUHDPF-IAGOWNOFSA-N 2 0 348.556 4.030 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+]Cc2cccc(OCC3CCCCC3)c2)C1 ZINC000620513429 1051148449 /nfs/dbraw/zinc/14/84/49/1051148449.db2.gz IUZGOKZMODHIKM-HXUWFJFHSA-N 2 0 330.516 4.077 20 0 EIADRP Cc1ccc(CC[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)cc1C ZINC001181314039 1051205411 /nfs/dbraw/zinc/20/54/11/1051205411.db2.gz BWGZBRFXRXATBA-HSZRJFAPSA-N 2 0 336.523 4.348 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]C[C@@H]2CCO[C@@H](C)C2)ccc1OC ZINC000775398525 1051229088 /nfs/dbraw/zinc/22/90/88/1051229088.db2.gz AKWVPSSFMLKQPC-OKZBNKHCSA-N 2 0 348.531 4.003 20 0 EIADRP CC(C)[N@H+](CC[C@H]1CCC[NH+]1C)Cc1cccc(C(F)(F)F)c1 ZINC001190661408 1051235120 /nfs/dbraw/zinc/23/51/20/1051235120.db2.gz SEQDIYCDXGBEJX-QGZVFWFLSA-N 2 0 328.422 4.400 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@H](C)C[C@H]2CCOC2)ccc1OC ZINC000775402069 1051235533 /nfs/dbraw/zinc/23/55/33/1051235533.db2.gz YQIDAHJZTHNQGC-FGTMMUONSA-N 2 0 348.531 4.003 20 0 EIADRP CC(C)(C)[PH+](CCCNC(=O)C12CC[NH+](CC1)CC2)C(C)(C)C ZINC001181554396 1051250928 /nfs/dbraw/zinc/25/09/28/1051250928.db2.gz DTZUSTBNILCUJM-UHFFFAOYSA-N 2 0 340.492 4.058 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)[C@@H]1CCCC[C@H]1C ZINC001181656521 1051271639 /nfs/dbraw/zinc/27/16/39/1051271639.db2.gz SBPXSERFGALTKE-KGVIQGDOSA-N 2 0 344.543 4.464 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cccc(OC(C)(C)C)c2)CC1 ZINC001190818327 1051282966 /nfs/dbraw/zinc/28/29/66/1051282966.db2.gz JMNOAHMPAHTVIL-UHFFFAOYSA-N 2 0 332.532 4.416 20 0 EIADRP C([C@@H]1CCCC12CCOCC2)[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001190827430 1051286267 /nfs/dbraw/zinc/28/62/67/1051286267.db2.gz PJTAUJRJEHNSQW-SFTDATJTSA-N 2 0 348.575 4.171 20 0 EIADRP FC(F)c1ccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000310070914 1051371801 /nfs/dbraw/zinc/37/18/01/1051371801.db2.gz DFNSNYOZLBPBBD-SFHVURJKSA-N 2 0 330.422 4.236 20 0 EIADRP CS[C@H]1CC[N@H+](C[C@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)C1 ZINC001182063340 1051388030 /nfs/dbraw/zinc/38/80/30/1051388030.db2.gz TXTZABLRTDWYBG-PZJWPPBQSA-N 2 0 346.584 4.362 20 0 EIADRP CC[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC001182248656 1051440832 /nfs/dbraw/zinc/44/08/32/1051440832.db2.gz BKFSMQIURFCSLK-KRWDZBQOSA-N 2 0 347.384 4.464 20 0 EIADRP C/C=C\COc1ccc(CC[C@H](C)[NH2+]CC[C@H]2CCC[N@H+](C)C2)cc1 ZINC001182248549 1051441149 /nfs/dbraw/zinc/44/11/49/1051441149.db2.gz ACTTZACVUAOEKS-UINFQJAVSA-N 2 0 344.543 4.284 20 0 EIADRP CCC[N@H+](C)C[C@H]1CC[NH+](CCCOc2cccc3ccccc32)C1 ZINC001191367698 1051443184 /nfs/dbraw/zinc/44/31/84/1051443184.db2.gz TYJIEXNRAVVIMV-LJQANCHMSA-N 2 0 340.511 4.272 20 0 EIADRP COc1ccc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)cc1C ZINC001191550825 1051485872 /nfs/dbraw/zinc/48/58/72/1051485872.db2.gz MNCYHIQYUCQHHO-LJQANCHMSA-N 2 0 344.543 4.480 20 0 EIADRP c1ccc2c(c1)NCCC[C@@H]2[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000774217882 1051515271 /nfs/dbraw/zinc/51/52/71/1051515271.db2.gz NQTYWWKDXQQHFI-NGICGMGXSA-N 2 0 327.516 4.320 20 0 EIADRP CCC(CC)(C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)SC ZINC000775511595 1051659572 /nfs/dbraw/zinc/65/95/72/1051659572.db2.gz DUIDCTFIHDIIPZ-PKOBYXMFSA-N 2 0 334.573 4.408 20 0 EIADRP C[C@H]1[C@H](c2ccccc2)c2ccccc2CC[N@@H+]1CCCn1ccnc1 ZINC001192334253 1051691948 /nfs/dbraw/zinc/69/19/48/1051691948.db2.gz GKCQQYDYDSECCJ-WMZHIEFXSA-N 2 0 345.490 4.352 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc2c(c1)OCCCO2 ZINC000158205508 1051727659 /nfs/dbraw/zinc/72/76/59/1051727659.db2.gz AHPAPAGYUVDYOF-GOSISDBHSA-N 2 0 346.515 4.011 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC(NC[C@@H]2CC[N@@H+]2C2CCCCC2)CC1 ZINC001182918237 1051747337 /nfs/dbraw/zinc/74/73/37/1051747337.db2.gz KMLSZNISQLRKIH-COPCDDAFSA-N 2 0 347.591 4.026 20 0 EIADRP C[C@H]1CC[N@H+](Cc2cccc(C(F)(F)F)c2Cl)CC[C@H]1C[NH3+] ZINC001205602230 1051756818 /nfs/dbraw/zinc/75/68/18/1051756818.db2.gz HUAYSQCOFGMPIQ-RYUDHWBXSA-N 2 0 334.813 4.166 20 0 EIADRP Clc1cc(Cl)cc(CC[NH2+]CC2CC[NH+](CC3CC3)CC2)c1 ZINC001183075183 1051773463 /nfs/dbraw/zinc/77/34/63/1051773463.db2.gz PJGOGTCWORJLEB-UHFFFAOYSA-N 2 0 341.326 4.248 20 0 EIADRP CCCOc1cccc(C[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC001193251619 1051892706 /nfs/dbraw/zinc/89/27/06/1051892706.db2.gz VFFRQDNUKCHGGU-PKOBYXMFSA-N 2 0 330.516 4.218 20 0 EIADRP C[C@H]1CCC[C@H]([NH+]2CCC([NH2+]CC(C)(C)C3CCOCC3)CC2)C1 ZINC001184046472 1051944865 /nfs/dbraw/zinc/94/48/65/1051944865.db2.gz VVWBLVSLFKLBMU-PXNSSMCTSA-N 2 0 336.564 4.072 20 0 EIADRP CC(C)C[C@@H](Cc1cccc(Cl)c1)[NH2+]C[C@@H]1C[NH+]2CCC1CC2 ZINC001184135912 1051953113 /nfs/dbraw/zinc/95/31/13/1051953113.db2.gz XGSRNGFBYKSCGB-QUCCMNQESA-N 2 0 334.935 4.229 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+]C/C=C\c2ccc(OCc3ccccc3)cc2)C1 ZINC000414913742 1051982872 /nfs/dbraw/zinc/98/28/72/1051982872.db2.gz JPUQDRZYYVKOQO-PWEFBKGJSA-N 2 0 336.479 4.138 20 0 EIADRP C[C@H]1CCCC[C@H]1C[N@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176263197 1051987807 /nfs/dbraw/zinc/98/78/07/1051987807.db2.gz QYJJLQWTRJERCO-UVUJQTEASA-N 2 0 326.528 4.267 20 0 EIADRP Cc1cc(C[NH2+]Cc2cccc(C[NH+](C)C)c2)cc(C)c1OC(F)F ZINC000073650530 1052134563 /nfs/dbraw/zinc/13/45/63/1052134563.db2.gz XKGSLLJUVUPXBO-UHFFFAOYSA-N 2 0 348.437 4.256 20 0 EIADRP C[N@@H+]1C[C@]23C[NH+](CCCCc4cccc(Cl)c4)C[C@@]2(C1)CCCC3 ZINC001177015688 1052218099 /nfs/dbraw/zinc/21/80/99/1052218099.db2.gz MRFPSULRWPGVEZ-OYRHEFFESA-N 2 0 346.946 4.471 20 0 EIADRP Cc1nc(C)c(C[NH2+][C@H]2CCN(Cc3ccccc3)CC2(C)C)s1 ZINC000337808668 1052540060 /nfs/dbraw/zinc/54/00/60/1052540060.db2.gz LJNVNHATXNHDIV-IBGZPJMESA-N 2 0 343.540 4.150 20 0 EIADRP Cc1nc(-c2ccc(CC[NH2+][C@H]3CC[N@@H+](C)C(C)(C)C3)s2)cs1 ZINC000623344533 1052627015 /nfs/dbraw/zinc/62/70/15/1052627015.db2.gz RHPJWHUOUSMSEM-AWEZNQCLSA-N 2 0 349.569 4.185 20 0 EIADRP COc1cc([C@H](C)N[C@@H]2CC[N@H+](C)C(C)(C)C2)ccc1OCC(C)C ZINC000623348636 1052629082 /nfs/dbraw/zinc/62/90/82/1052629082.db2.gz FIHOIIMJFARUEN-FUHWJXTLSA-N 2 0 348.531 4.253 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC3c4ccccc4C2c2ccccc23)CC[N@@H+]1C ZINC000177839443 1052691821 /nfs/dbraw/zinc/69/18/21/1052691821.db2.gz HKSRUBZRQXHUFG-SHDPVSIFSA-N 2 0 346.518 4.356 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3cc(F)ccc32)c1 ZINC000177976588 1052695174 /nfs/dbraw/zinc/69/51/74/1052695174.db2.gz TVCWEEAWNAOCIK-NRFANRHFSA-N 2 0 326.459 4.443 20 0 EIADRP C[C@@H]1C[C@H](N[C@@H](COc2ccccc2F)c2ccccc2)CC[N@@H+]1C ZINC000178115355 1052700194 /nfs/dbraw/zinc/70/01/94/1052700194.db2.gz XUHMXRLUOFNMBL-POAQFYNOSA-N 2 0 342.458 4.018 20 0 EIADRP C[C@@H]1C[C@@H](NC(c2ccc(F)cc2)c2ccc(F)cc2)CC[N@@H+]1C ZINC000178606557 1052710209 /nfs/dbraw/zinc/71/02/09/1052710209.db2.gz BVCFPAQWUIFOCA-KUHUBIRLSA-N 2 0 330.422 4.127 20 0 EIADRP CC[C@H](C)c1ccc([C@@H](C)[NH2+]CCCC[NH+]2CCN(CC)CC2)cc1 ZINC000623861781 1052824536 /nfs/dbraw/zinc/82/45/36/1052824536.db2.gz CHJIOPAQVVMQSB-VQTJNVASSA-N 2 0 345.575 4.268 20 0 EIADRP CC(C)c1cccc([C@@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)c1 ZINC000624010427 1052852181 /nfs/dbraw/zinc/85/21/81/1052852181.db2.gz OPODTKZKZPWEFF-GOSISDBHSA-N 2 0 344.543 4.352 20 0 EIADRP Cc1ccc(C(C)(C)C[NH2+]C2CC[NH+]([C@@H]3CCC[C@@H](C)C3)CC2)nc1 ZINC000624112848 1052865907 /nfs/dbraw/zinc/86/59/07/1052865907.db2.gz NHDFNVCOWVQAJD-YLJYHZDGSA-N 2 0 343.559 4.300 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](c2ccccc2)c2ccc(F)cn2)CC1 ZINC000183555016 1052978046 /nfs/dbraw/zinc/97/80/46/1052978046.db2.gz KHKWYBWIVVCDJK-NRFANRHFSA-N 2 0 341.474 4.022 20 0 EIADRP Cc1cc(C[NH2+][C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c2ccccc2n1 ZINC000185694738 1053020560 /nfs/dbraw/zinc/02/05/60/1053020560.db2.gz MEMZAHOUNBGOPK-ROUUACIJSA-N 2 0 337.511 4.286 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1cnn(-c2ccccc2)c1C ZINC000764435669 1053102830 /nfs/dbraw/zinc/10/28/30/1053102830.db2.gz RVLITPUAELMEAF-ZWKOTPCHSA-N 2 0 342.531 4.342 20 0 EIADRP FC1(F)CCCC[C@@H]1C[N@@H+]1C[C@@H]2CC[NH+](Cc3ccccc3)C[C@H]2C1 ZINC000381874511 1053110407 /nfs/dbraw/zinc/11/04/07/1053110407.db2.gz JUQCFDHXBDZFCH-SLFFLAALSA-N 2 0 348.481 4.266 20 0 EIADRP CC[NH+](CC)CCC[NH2+]C(C)(C)c1ccc(Br)c(C)c1 ZINC001194818373 1053116788 /nfs/dbraw/zinc/11/67/88/1053116788.db2.gz VXKGFYUKWTWSEJ-UHFFFAOYSA-N 2 0 341.337 4.314 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1cc2cnccc2o1 ZINC000850439852 1053213770 /nfs/dbraw/zinc/21/37/70/1053213770.db2.gz PLXAJBMKMAXIEJ-FAEJEUNOSA-N 2 0 327.472 4.276 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1cc2cnccc2o1 ZINC000850439853 1053216131 /nfs/dbraw/zinc/21/61/31/1053216131.db2.gz PLXAJBMKMAXIEJ-ZLPCBKJTSA-N 2 0 327.472 4.276 20 0 EIADRP C[C@H](CSC(C)(C)C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000765322155 1053507713 /nfs/dbraw/zinc/50/77/13/1053507713.db2.gz BJFDFWMABMYFSF-QGZVFWFLSA-N 2 0 334.573 4.408 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]C1CC[NH+](CC3CCCCC3)CC1)CC2 ZINC000765453713 1053557876 /nfs/dbraw/zinc/55/78/76/1053557876.db2.gz QXBWIZNLHWGFCC-JOCHJYFZSA-N 2 0 342.527 4.317 20 0 EIADRP CC[NH+]1CCC(CC2CC[NH+](Cc3cccc(OC)c3)CC2)CC1 ZINC001203825050 1053571781 /nfs/dbraw/zinc/57/17/81/1053571781.db2.gz CCWGBXMAVFZMAP-UHFFFAOYSA-N 2 0 330.516 4.029 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH2+]C2CCC(C)([NH+](C)C)CC2)cc1 ZINC000865765179 1053587398 /nfs/dbraw/zinc/58/73/98/1053587398.db2.gz ZPSYRHJRPFRWHU-UHFFFAOYSA-N 2 0 343.540 4.471 20 0 EIADRP C[C@H](CCc1cncc2ccccc21)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000866248802 1053665467 /nfs/dbraw/zinc/66/54/67/1053665467.db2.gz GDCXVGJLGSEBSL-QGZVFWFLSA-N 2 0 337.511 4.162 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)CCc2cncc3ccccc32)C1 ZINC000866260911 1053666215 /nfs/dbraw/zinc/66/62/15/1053666215.db2.gz PHORDZFIMHHLHA-OALUTQOASA-N 2 0 339.527 4.266 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CCc2ccco2)ccc1OC ZINC000121026603 1053697986 /nfs/dbraw/zinc/69/79/86/1053697986.db2.gz RQCLZPRCUPTINE-INIZCTEOSA-N 2 0 330.472 4.023 20 0 EIADRP c1ccc(CC[C@@H]([NH2+]CC2CC[NH+](C3CC3)CC2)c2ccccn2)cc1 ZINC000866349808 1053700653 /nfs/dbraw/zinc/70/06/53/1053700653.db2.gz OSZQYUYFJXXPSX-HSZRJFAPSA-N 2 0 349.522 4.220 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H](CCc2ccccc2)c2ccccn2)CC1 ZINC000866376912 1053708426 /nfs/dbraw/zinc/70/84/26/1053708426.db2.gz AYSILXXJGWIZHT-QETWGEEDSA-N 2 0 337.511 4.218 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@H](C[C@@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000866518417 1053763513 /nfs/dbraw/zinc/76/35/13/1053763513.db2.gz ZLERTOVTBGAHBK-FZQMEJGWSA-N 2 0 348.506 4.146 20 0 EIADRP C[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1cc(-c2ccccc2)nn1C ZINC000866517845 1053764305 /nfs/dbraw/zinc/76/43/05/1053764305.db2.gz OXXWNBSXGNUACD-SRWJYRBRSA-N 2 0 340.515 4.001 20 0 EIADRP CC[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1cccc(OC)c1OC ZINC000866517811 1053765235 /nfs/dbraw/zinc/76/52/35/1053765235.db2.gz NULVHWBNVQMRPJ-CMVHYPBASA-N 2 0 334.504 4.007 20 0 EIADRP C[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1nc2ccc(Cl)cc2n1C ZINC000866517448 1053765708 /nfs/dbraw/zinc/76/57/08/1053765708.db2.gz ZIJVKOVPMVFMNV-VZDIAYEVSA-N 2 0 348.922 4.140 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@@H]2CC3(CCC3)Oc3ccccc32)CC1 ZINC000866515871 1053765849 /nfs/dbraw/zinc/76/58/49/1053765849.db2.gz KPAMFHFHESDWCU-KGXSXCIVSA-N 2 0 328.500 4.285 20 0 EIADRP COc1ccc2[nH+]c(C)cc(N3C[C@@H](CC[NH3+])c4ccccc43)c2c1 ZINC001168547199 1053785107 /nfs/dbraw/zinc/78/51/07/1053785107.db2.gz AXEZWXNEZMGCFX-OAHLLOKOSA-N 2 0 333.435 4.136 20 0 EIADRP Cc1c([C@@H](C)[NH2+]CCCCNc2ccccn2)cnn1-c1ccccc1 ZINC000765678252 1053838079 /nfs/dbraw/zinc/83/80/79/1053838079.db2.gz UIPQETLOCGESHI-QGZVFWFLSA-N 2 0 349.482 4.119 20 0 EIADRP Cc1ccc2c(c1)CC[C@@H]2[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000765704717 1053851621 /nfs/dbraw/zinc/85/16/21/1053851621.db2.gz ZEQKDTGUVDKPLU-REWPJTCUSA-N 2 0 334.507 4.137 20 0 EIADRP C[N@H+](CCCC[NH+]1CCCCC1)Cc1cccc(C(F)(F)F)c1 ZINC001197285104 1053875654 /nfs/dbraw/zinc/87/56/54/1053875654.db2.gz MZZSELRRORTARD-UHFFFAOYSA-N 2 0 328.422 4.403 20 0 EIADRP CC(C)(C)SCCC[N@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001197912119 1054031697 /nfs/dbraw/zinc/03/16/97/1054031697.db2.gz WASQUCWOYIMBHT-WOJBJXKFSA-N 2 0 346.584 4.362 20 0 EIADRP CC(C)[N@H+](C)Cc1cc(O[C@H]2CC[NH+](C[C@@H](C)C(C)(C)C)C2)ccn1 ZINC000856558423 1054084737 /nfs/dbraw/zinc/08/47/37/1054084737.db2.gz IGNGOVBHKKLAIH-XLIONFOSSA-N 2 0 347.547 4.057 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCOC(C)(C)C)cc1C[NH+]1CCCCC1 ZINC000776891810 1054095328 /nfs/dbraw/zinc/09/53/28/1054095328.db2.gz YLTXKOKDCCTHKM-KRWDZBQOSA-N 2 0 348.531 4.147 20 0 EIADRP C[C@@H]1CN(CCC[NH2+]Cc2ccc(-c3cccs3)cc2)C[C@H](C)O1 ZINC001199085563 1054340616 /nfs/dbraw/zinc/34/06/16/1054340616.db2.gz LVIGDMOMMZFNAY-CALCHBBNSA-N 2 0 344.524 4.004 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCOC3(CCCC3)C2)c1 ZINC000872026462 1054345285 /nfs/dbraw/zinc/34/52/85/1054345285.db2.gz BIRSYYQICMPVIH-HXUWFJFHSA-N 2 0 330.516 4.108 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cnc2c(F)cccc2c1 ZINC001199336603 1054385928 /nfs/dbraw/zinc/38/59/28/1054385928.db2.gz SPYIPINMRUAGEI-INIZCTEOSA-N 2 0 329.463 4.118 20 0 EIADRP C[C@H]([NH2+]Cc1cccc2ncccc12)c1cccc(OCC[NH+](C)C)c1 ZINC000872125109 1054404159 /nfs/dbraw/zinc/40/41/59/1054404159.db2.gz YDBAZBHFZPJKSO-KRWDZBQOSA-N 2 0 349.478 4.026 20 0 EIADRP CCOc1ccc(Cl)cc1C[NH2+][C@@H](Cn1ccnc1)C(C)(C)C ZINC001199608508 1054432178 /nfs/dbraw/zinc/43/21/78/1054432178.db2.gz IZSDLKYXDFRIAK-KRWDZBQOSA-N 2 0 335.879 4.140 20 0 EIADRP Cc1cc(C[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)ccn1 ZINC000858169032 1054432254 /nfs/dbraw/zinc/43/22/54/1054432254.db2.gz VXHVOYYYRINMCP-FRIKZZABSA-N 2 0 335.495 4.065 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2coc(-c3cccc(Cl)c3)n2)CC1 ZINC000056523428 1054471200 /nfs/dbraw/zinc/47/12/00/1054471200.db2.gz RYGMAFGXEMZUDU-UHFFFAOYSA-N 2 0 347.890 4.159 20 0 EIADRP CC(C)[C@H](C[NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccccc1 ZINC001199821652 1054480714 /nfs/dbraw/zinc/48/07/14/1054480714.db2.gz ACQIOGCTCYVHAL-NRFANRHFSA-N 2 0 340.511 4.156 20 0 EIADRP CS[C@H]1CCC[C@@H]([NH2+]CC2CC[NH+](Cc3cccs3)CC2)C1 ZINC001199883258 1054491528 /nfs/dbraw/zinc/49/15/28/1054491528.db2.gz HSTZIYCBNTXBLS-SJORKVTESA-N 2 0 338.586 4.224 20 0 EIADRP CC(C)(C)[C@@]1(C[NH3+])CC[N@H+](Cc2cnc(-c3cccs3)s2)C1 ZINC000873222897 1054508923 /nfs/dbraw/zinc/50/89/23/1054508923.db2.gz DLELFUQHTRMCGA-QGZVFWFLSA-N 2 0 335.542 4.069 20 0 EIADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)C1 ZINC000873254261 1054515186 /nfs/dbraw/zinc/51/51/86/1054515186.db2.gz OTVWISKPCACGMF-GLQYFDAESA-N 2 0 347.915 4.168 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[C@H]([NH3+])C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000873259151 1054516527 /nfs/dbraw/zinc/51/65/27/1054516527.db2.gz YECMPUKVKKLMOO-RVBZMBCESA-N 2 0 340.311 4.112 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H](C)C1CC[NH2+]CC1 ZINC000873267788 1054516544 /nfs/dbraw/zinc/51/65/44/1054516544.db2.gz JSWVWRXKMOMEAI-KGLIPLIRSA-N 2 0 329.513 4.157 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+][C@H](C)C3CC[NH2+]CC3)cs2)cs1 ZINC000873267292 1054517623 /nfs/dbraw/zinc/51/76/23/1054517623.db2.gz BJBWMVSZTQTLST-NEPJUHHUSA-N 2 0 335.542 4.219 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873272147 1054519333 /nfs/dbraw/zinc/51/93/33/1054519333.db2.gz PNNMOJAIHBCJRG-LSDHHAIUSA-N 2 0 343.540 4.081 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@@H](C)C2CC[NH2+]CC2)ccc1SC(F)F ZINC000873271889 1054519989 /nfs/dbraw/zinc/51/99/89/1054519989.db2.gz LKQYYSXHJXSHNR-RYUDHWBXSA-N 2 0 344.471 4.049 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873272146 1054520770 /nfs/dbraw/zinc/52/07/70/1054520770.db2.gz PNNMOJAIHBCJRG-GJZGRUSLSA-N 2 0 343.540 4.081 20 0 EIADRP C[C@@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccns1 ZINC000858576979 1054522505 /nfs/dbraw/zinc/52/25/05/1054522505.db2.gz OFEMFFWEPFKHSK-FAEJEUNOSA-N 2 0 329.513 4.237 20 0 EIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2nc3ccccc3o2)C[N@@H+]1Cc1ccccc1 ZINC001201492516 1054819201 /nfs/dbraw/zinc/81/92/01/1054819201.db2.gz QHDZOIDOAGCAKO-PKOBYXMFSA-N 2 0 349.478 4.218 20 0 EIADRP CC[C@@H](C)C[NH+]1CCC2(CC[N@H+](Cc3cccc(OC)c3)C2)CC1 ZINC001201510285 1054823798 /nfs/dbraw/zinc/82/37/98/1054823798.db2.gz ZBYNIWRGXBOFEI-GOSISDBHSA-N 2 0 330.516 4.029 20 0 EIADRP CCC[C@@H](C)C[NH+]1CCC2(CC1)C[N@H+](Cc1ccc(C)cc1)CCO2 ZINC001201544138 1054837798 /nfs/dbraw/zinc/83/77/98/1054837798.db2.gz NJJNBRABSAJMRM-HXUWFJFHSA-N 2 0 344.543 4.098 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C2(C3CC3)CC2)cc1C[NH+]1CCCCC1 ZINC000777147964 1054851449 /nfs/dbraw/zinc/85/14/49/1054851449.db2.gz BYSLJYASCLODGS-INIZCTEOSA-N 2 0 328.500 4.274 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]Cc2c(Cl)cccc2N2CC[NH+](C)CC2)C[C@@H]1C ZINC001201928864 1054942386 /nfs/dbraw/zinc/94/23/86/1054942386.db2.gz FLTDBBPJAANPTK-IKGGRYGDSA-N 2 0 349.950 4.006 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2c(Cl)cccc2N2CC[NH+](C)CC2)C[C@H]1C ZINC001201928863 1054942700 /nfs/dbraw/zinc/94/27/00/1054942700.db2.gz FLTDBBPJAANPTK-BRWVUGGUSA-N 2 0 349.950 4.006 20 0 EIADRP C[C@@H](CC[NH2+]Cc1cc2nc(Cl)ccc2s1)[NH+]1CCCCC1 ZINC001201962954 1054967918 /nfs/dbraw/zinc/96/79/18/1054967918.db2.gz KHDJKCPFZKYODU-ZDUSSCGKSA-N 2 0 337.920 4.304 20 0 EIADRP c1ccc([C@@H]([NH2+]CCCCC[NH+]2CCCCC2)c2ccccn2)cc1 ZINC000109826140 1055024728 /nfs/dbraw/zinc/02/47/28/1055024728.db2.gz DUEVLJWUXFJFJC-JOCHJYFZSA-N 2 0 337.511 4.417 20 0 EIADRP CC(C)(O)c1ccc(C[NH2+]C(C)(C)CC[NH+]2CCCCCC2)cc1 ZINC001202074832 1055037462 /nfs/dbraw/zinc/03/74/62/1055037462.db2.gz WTERXOAACLZNON-UHFFFAOYSA-N 2 0 332.532 4.048 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H]2CCC(F)(F)C2)ccc1OC ZINC000777242764 1055041571 /nfs/dbraw/zinc/04/15/71/1055041571.db2.gz PUKMSKRYMGGYAY-WMLDXEAASA-N 2 0 340.458 4.375 20 0 EIADRP Cc1cc([NH+]2CCCCCC2)ccc1N[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000671766317 1055071560 /nfs/dbraw/zinc/07/15/60/1055071560.db2.gz CWVSLAHOOGJBMC-RBUKOAKNSA-N 2 0 327.516 4.414 20 0 EIADRP c1ccc([C@@H]2C[C@@H]([NH2+]CC[C@H]3CCSC3)CCN2C2CC2)cc1 ZINC000877661647 1055102285 /nfs/dbraw/zinc/10/22/85/1055102285.db2.gz DTLXRJAVMCMWGO-QRFRQXIXSA-N 2 0 330.541 4.087 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+]Cc2cc3c(ccnc3Cl)o2)CC1 ZINC000877697397 1055109661 /nfs/dbraw/zinc/10/96/61/1055109661.db2.gz KURPBWZYHDIDBV-UHFFFAOYSA-N 2 0 335.879 4.081 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](C)c1ccccc1)c1cccc(OCC[NH+](C)C)c1 ZINC000542680026 1055820188 /nfs/dbraw/zinc/82/01/88/1055820188.db2.gz DTZQLBBGMFSIKY-QZTJIDSGSA-N 2 0 326.484 4.081 20 0 EIADRP C[C@@H](C[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccccc1 ZINC000542680028 1055820314 /nfs/dbraw/zinc/82/03/14/1055820314.db2.gz DTZQLBBGMFSIKY-ZWKOTPCHSA-N 2 0 326.484 4.081 20 0 EIADRP CCN(C)c1ccccc1C[NH2+][C@@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000765849463 1055890741 /nfs/dbraw/zinc/89/07/41/1055890741.db2.gz OVLCSIDKPZVHFE-KRWDZBQOSA-N 2 0 348.494 4.488 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)C2CCC(C(F)(F)F)CC2)C1 ZINC000474710958 1055997776 /nfs/dbraw/zinc/99/77/76/1055997776.db2.gz JZUPHWQZICZLLK-NUWOQIAWSA-N 2 0 334.470 4.454 20 0 EIADRP c1cc2cnccc2c(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)c1 ZINC000183369320 1060002047 /nfs/dbraw/zinc/00/20/47/1060002047.db2.gz MUOIAWJUNSPZIK-UHFFFAOYSA-N 2 0 337.511 4.323 20 0 EIADRP CCC[C@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1cccnc1 ZINC000185137248 1060095135 /nfs/dbraw/zinc/09/51/35/1060095135.db2.gz RTRHERQTXSSRJB-QFIPXVFZSA-N 2 0 337.511 4.425 20 0 EIADRP CC(=O)Nc1cccc([C@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)c1 ZINC000766510286 1060422480 /nfs/dbraw/zinc/42/24/80/1060422480.db2.gz GEMCLKJNSZCMQM-YQHFOJDRSA-N 2 0 343.515 4.093 20 0 EIADRP C1CCC([NH+]2CCC([NH2+]C3CCC([NH+]4CCCCC4)CC3)CC2)CC1 ZINC000766509760 1060424318 /nfs/dbraw/zinc/42/43/18/1060424318.db2.gz BHNISJVQIZWVMD-UHFFFAOYSA-N 3 0 347.591 4.170 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]C1CCC([NH+]3CCCCC3)CC1)CCC2 ZINC000766514441 1060472519 /nfs/dbraw/zinc/47/25/19/1060472519.db2.gz XDGLKDAGYCUDOG-OBFZPWGMSA-N 2 0 342.527 4.459 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CC[C@@H](c3cccc(C(F)(F)F)c3)C1)C2 ZINC001169141064 1060660596 /nfs/dbraw/zinc/66/05/96/1060660596.db2.gz OMLXCFHNMAOCEV-NRSFXHEJSA-N 2 0 338.417 4.120 20 0 EIADRP CC1(C)C[C@@H](Nc2cc(C[NH+]3CCCCC3)ccn2)C[C@@](C)(C[NH3+])C1 ZINC001169140944 1060660797 /nfs/dbraw/zinc/66/07/97/1060660797.db2.gz ICECNJSBYUWCRV-WIYYLYMNSA-N 2 0 344.547 4.023 20 0 EIADRP C[N@@H+]1CC[C@H](c2ccc(N[C@@H]3CC(C)(C)C[C@@](C)(C[NH3+])C3)cc2)C1 ZINC001169148768 1060668728 /nfs/dbraw/zinc/66/87/28/1060668728.db2.gz ZYHNFNMFNAQZES-DSKINZAPSA-N 2 0 329.532 4.061 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](n1cc(C3CC[NH2+]CC3)c3ccc(F)cc31)C2 ZINC001169153692 1060670516 /nfs/dbraw/zinc/67/05/16/1060670516.db2.gz LEZOIPXEZNJUGX-PIIMJCKOSA-N 2 0 341.474 4.045 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H](n1cc(C3CC[NH2+]CC3)c3ccc(F)cc31)C2 ZINC001169153690 1060671346 /nfs/dbraw/zinc/67/13/46/1060671346.db2.gz LEZOIPXEZNJUGX-BCDXTJNWSA-N 2 0 341.474 4.045 20 0 EIADRP CCN1CCC([NH2+][C@@H]2CC[C@H](C[C@@H]3CC[C@H]([NH3+])[C@H](C)C3)C[C@H]2C)CC1 ZINC001169233951 1060706976 /nfs/dbraw/zinc/70/69/76/1060706976.db2.gz YRCMSQTYZSKORT-NVLJRBADSA-N 2 0 349.607 4.019 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](Cc2cccc3cccnc32)C1 ZINC000078704632 217105421 /nfs/dbraw/zinc/10/54/21/217105421.db2.gz BRTAYIONMNVZOM-RBUKOAKNSA-N 2 0 337.511 4.321 20 0 EIADRP CC[C@H](c1ccc(F)cc1)[NH+]1CCC(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)CC1 ZINC000078847304 217134003 /nfs/dbraw/zinc/13/40/03/217134003.db2.gz RMNSWSDTZCVFLZ-LLGFUMIMSA-N 2 0 348.506 4.098 20 0 EIADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2cc(C)c(Br)s2)C1 ZINC001345412329 1019792683 /nfs/dbraw/zinc/79/26/83/1019792683.db2.gz QBHJNYXOAXMQRZ-QWHCGFSZSA-N 2 0 345.350 4.202 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)C1CCOCC1 ZINC000532192759 1032080426 /nfs/dbraw/zinc/08/04/26/1032080426.db2.gz KTJZSDOJBXNXNT-PGRDOPGGSA-N 2 0 344.543 4.356 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@@H](C)c2ccc(Br)cc2)C1 ZINC000532214761 1032096106 /nfs/dbraw/zinc/09/61/06/1032096106.db2.gz LCFFWJGJKWZARJ-LSDHHAIUSA-N 2 0 339.321 4.220 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2sccc2Br)CC1 ZINC000532215474 1032097797 /nfs/dbraw/zinc/09/77/97/1032097797.db2.gz SLYOJQQCJOFVSA-LBPRGKRZSA-N 2 0 345.350 4.283 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)C[C@H](C)O1 ZINC000648431538 1032294115 /nfs/dbraw/zinc/29/41/15/1032294115.db2.gz BPAXAJQZSBWTCE-WGMWDUQUSA-N 2 0 344.543 4.497 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)C1CC(F)(F)C1 ZINC000529575085 1032456002 /nfs/dbraw/zinc/45/60/02/1032456002.db2.gz PTTVBMCICXBFGK-WMZOPIPTSA-N 2 0 336.470 4.312 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2ccc(Cl)c(OC)c2)c1 ZINC000623403307 1032457445 /nfs/dbraw/zinc/45/74/45/1032457445.db2.gz RJLBCBTUDKXMRC-UHFFFAOYSA-N 2 0 332.875 4.090 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1cc(Cl)c(N)c(Cl)c1 ZINC000760166309 1032511871 /nfs/dbraw/zinc/51/18/71/1032511871.db2.gz DKPOGMRHOMNDOC-UHTWSYAYSA-N 2 0 330.303 4.099 20 0 EIADRP Cc1ccccc1C[NH+]1CCC(NCC2=Cc3ccccc3OC2)CC1 ZINC000102423012 1032534770 /nfs/dbraw/zinc/53/47/70/1032534770.db2.gz KYCVSOYEWQQEOY-UHFFFAOYSA-N 2 0 348.490 4.025 20 0 EIADRP COc1cc(-c2ccccc2)ccc1C[NH2+]C[C@@H](C)Cn1ccnc1C ZINC000512431539 1032750073 /nfs/dbraw/zinc/75/00/73/1032750073.db2.gz FRRFSOJGORFCNI-QGZVFWFLSA-N 2 0 349.478 4.293 20 0 EIADRP COc1ccc(-c2ccccc2)cc1CN1CCC[C@H]([NH+](C)C)CC1 ZINC000432792862 1032812087 /nfs/dbraw/zinc/81/20/87/1032812087.db2.gz MYXWFJYZZIPHFQ-NRFANRHFSA-N 2 0 338.495 4.278 20 0 EIADRP COc1ccc(CN2CCC[C@@H]([NH+](C)C)CC2)cc1OCCC(C)C ZINC000432794719 1032819260 /nfs/dbraw/zinc/81/92/60/1032819260.db2.gz URGLHCNYCYIKTR-LJQANCHMSA-N 2 0 348.531 4.036 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH+]2CC[C@H](c3ccc(Cl)c(Cl)c3)C2)C1 ZINC001208613707 1019463486 /nfs/dbraw/zinc/46/34/86/1019463486.db2.gz YMUBJSLFCPVHKF-ZFWWWQNUSA-N 2 0 327.299 4.125 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C(F)F)nc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000631108896 1019974632 /nfs/dbraw/zinc/97/46/32/1019974632.db2.gz IBFWDCZZCOPVOM-QAPCUYQASA-N 2 0 345.437 4.019 20 0 EIADRP Fc1ccc([C@H]([NH2+]CCCn2ccnc2)c2ccccc2Cl)cc1 ZINC000179963260 1019983594 /nfs/dbraw/zinc/98/35/94/1019983594.db2.gz JYIBUCFPGJNHNI-IBGZPJMESA-N 2 0 343.833 4.445 20 0 EIADRP CC(C)Oc1ccc(C[NH+]2CCC(C3CC[NH+](C)CC3)CC2)cc1 ZINC001204454889 1020474206 /nfs/dbraw/zinc/47/42/06/1020474206.db2.gz JXFSXAVECZVUJP-UHFFFAOYSA-N 2 0 330.516 4.028 20 0 EIADRP CCC[C@@H]([NH2+]C1CCN([C@H]2CCOC2)CC1)c1ccc(Cl)cc1 ZINC000655733393 1020924764 /nfs/dbraw/zinc/92/47/64/1020924764.db2.gz MUAOALSDJVDJFW-RBUKOAKNSA-N 2 0 336.907 4.024 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](c2ccc(F)cc2)c2ccccc2Cl)C1 ZINC000655805517 1020971955 /nfs/dbraw/zinc/97/19/55/1020971955.db2.gz OTRTYFXBVFRADQ-NQYLQCIDSA-N 2 0 346.877 4.498 20 0 EIADRP CC(C)[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(C(F)(F)F)cc1 ZINC000655805830 1020972051 /nfs/dbraw/zinc/97/20/51/1020972051.db2.gz TWOOKHVHJCLETP-XOKHGSTOSA-N 2 0 328.422 4.332 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc2cc(OC)ccc2c1 ZINC000655806665 1020972593 /nfs/dbraw/zinc/97/25/93/1020972593.db2.gz ZBSFHMFKRIEJAE-DLVCFXQMSA-N 2 0 326.484 4.229 20 0 EIADRP Cc1ccc(COc2ccc(C[NH2+]C[C@H]3C[C@@H]([NH+](C)C)C3)cc2)cc1 ZINC000655825473 1020991371 /nfs/dbraw/zinc/99/13/71/1020991371.db2.gz DYYCVCJFGHVTPU-OYRHEFFESA-N 2 0 338.495 4.004 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655825073 1020993186 /nfs/dbraw/zinc/99/31/86/1020993186.db2.gz VPVQGJXSAMIQEX-WBHAHGPOSA-N 2 0 326.406 4.039 20 0 EIADRP COCCC[NH2+][C@@H](CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000340472711 1021083974 /nfs/dbraw/zinc/08/39/74/1021083974.db2.gz KZYUFZWIHKTTPN-FQEVSTJZSA-N 2 0 336.495 4.005 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]CCCCC[NH+]1CCCC1)CCCS2 ZINC000340480906 1021103959 /nfs/dbraw/zinc/10/39/59/1021103959.db2.gz XBLZUAPKYFTYCF-LJQANCHMSA-N 2 0 348.556 4.478 20 0 EIADRP C([C@H]1CCC[N@H+](CC2([C@H]3CCCCO3)CCC2)C1)[NH+]1CCCCCC1 ZINC001167326741 1021129293 /nfs/dbraw/zinc/12/92/93/1021129293.db2.gz PZNQJMKXBZEGJD-NHCUHLMSSA-N 2 0 348.575 4.314 20 0 EIADRP Cc1cc(F)ncc1C[NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000892506551 1021197267 /nfs/dbraw/zinc/19/72/67/1021197267.db2.gz HFDUAOYIBBZEBN-UHFFFAOYSA-N 2 0 341.474 4.051 20 0 EIADRP c1cc(N2CCCCC2)ncc1NC1=CC[C@H]([NH+]2CCCC2)CC1 ZINC001210706120 1021562846 /nfs/dbraw/zinc/56/28/46/1021562846.db2.gz SNOJFDYZIVRKTN-IBGZPJMESA-N 2 0 326.488 4.016 20 0 EIADRP c1cnc(N2CCCCC2)c(NC2=CC[C@H]([NH+]3CCCC3)CC2)c1 ZINC001210706184 1021564921 /nfs/dbraw/zinc/56/49/21/1021564921.db2.gz USCKZZRLFFXLHD-SFHVURJKSA-N 2 0 326.488 4.016 20 0 EIADRP Cc1nc(C)c([C@H](C)[NH2+]C[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)s1 ZINC000376165594 1021640210 /nfs/dbraw/zinc/64/02/10/1021640210.db2.gz ZQUICPWTRUDVGG-VHSSKADRSA-N 2 0 329.513 4.104 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]C[C@H]2CCCn3ccnc32)ccc1Br ZINC000376178573 1021672943 /nfs/dbraw/zinc/67/29/43/1021672943.db2.gz RUSDLXNCWZFTNH-UKRRQHHQSA-N 2 0 348.288 4.182 20 0 EIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000683816563 1021686450 /nfs/dbraw/zinc/68/64/50/1021686450.db2.gz SWOSAZKHECXURN-UWJYYQICSA-N 2 0 330.516 4.007 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c(C)c1 ZINC000414103514 1021858933 /nfs/dbraw/zinc/85/89/33/1021858933.db2.gz DUXDLFYWESCUCR-OKZBNKHCSA-N 2 0 330.516 4.307 20 0 EIADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1csc(-c2ccccc2)n1 ZINC000414106243 1021860065 /nfs/dbraw/zinc/86/00/65/1021860065.db2.gz IFZPMMGQCPZIHU-HNNXBMFYSA-N 2 0 329.513 4.193 20 0 EIADRP [NH3+][C@@H]1C[C@@H](NC2(c3cccc(OC(F)(F)F)c3)CC2)c2ccccc21 ZINC000656201289 1021933651 /nfs/dbraw/zinc/93/36/51/1021933651.db2.gz ODMXMFSNMUFERF-IAGOWNOFSA-N 2 0 348.368 4.309 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1csc(-c2ccccc2)n1 ZINC000414169532 1022018304 /nfs/dbraw/zinc/01/83/04/1022018304.db2.gz BGFOFIAVLFHPPW-JKSUJKDBSA-N 2 0 329.513 4.193 20 0 EIADRP COc1ccc(CC[N@H+](CC[C@H]2CCC[NH+]2C)CC(C)(C)C)cc1 ZINC001167401618 1022029967 /nfs/dbraw/zinc/02/99/67/1022029967.db2.gz BKCSBGDTZOKJNO-LJQANCHMSA-N 2 0 332.532 4.070 20 0 EIADRP COc1ccsc1[C@H](C)NCC[C@@H](C)[N@H+](C)Cc1ccccc1 ZINC000471580443 1022062644 /nfs/dbraw/zinc/06/26/44/1022062644.db2.gz IFUKFAYONTXUKZ-CVEARBPZSA-N 2 0 332.513 4.318 20 0 EIADRP COc1ccsc1[C@@H](C)NCC[C@@H](C)[N@H+](C)Cc1ccccc1 ZINC000471580445 1022064006 /nfs/dbraw/zinc/06/40/06/1022064006.db2.gz IFUKFAYONTXUKZ-HZPDHXFCSA-N 2 0 332.513 4.318 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cccs1 ZINC000171130928 1022099758 /nfs/dbraw/zinc/09/97/58/1022099758.db2.gz DEZJAFYFDGRPGX-GOSISDBHSA-N 2 0 332.513 4.320 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(Cl)cc1 ZINC000398097550 1022220811 /nfs/dbraw/zinc/22/08/11/1022220811.db2.gz KWUSLTALRXMGNE-OXQOHEQNSA-N 2 0 328.887 4.340 20 0 EIADRP CCc1onc(C)c1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000892574369 1022258031 /nfs/dbraw/zinc/25/80/31/1022258031.db2.gz ZKHCEEVNHVJEJN-MRXNPFEDSA-N 2 0 341.499 4.210 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+]C[C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000564435591 1022395080 /nfs/dbraw/zinc/39/50/80/1022395080.db2.gz JMNJOAOUXSCSLL-LSDHHAIUSA-N 2 0 328.422 4.130 20 0 EIADRP c1ccc(C[N@@H+]2C[C@H]3[C@H](C2)[C@@H]2CC[C@H]3C[NH+]2Cc2ccccc2)cc1 ZINC000656404132 1022846055 /nfs/dbraw/zinc/84/60/55/1022846055.db2.gz WYQSTLLFJCLBJL-BJESRGMDSA-N 2 0 332.491 4.029 20 0 EIADRP CN1CC[C@H]([NH2+][C@H]2CCCc3cc(N)ccc32)C[C@@H]1c1ccccc1 ZINC000423369633 1022861163 /nfs/dbraw/zinc/86/11/63/1022861163.db2.gz SUBYGKHTHQEKMK-ILWGZMRPSA-N 2 0 335.495 4.071 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@H]([NH3+])C1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000423386641 1022864899 /nfs/dbraw/zinc/86/48/99/1022864899.db2.gz MDRPMNGYTJLNEQ-AUZPSNTRSA-N 2 0 331.287 4.009 20 0 EIADRP C[C@@H](Cc1ccccc1F)[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000311193165 1022875514 /nfs/dbraw/zinc/87/55/14/1022875514.db2.gz GPZLAMUKBSTGMA-ICSRJNTNSA-N 2 0 340.486 4.259 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000311193166 1022875777 /nfs/dbraw/zinc/87/57/77/1022875777.db2.gz GPZLAMUKBSTGMA-QUCCMNQESA-N 2 0 340.486 4.259 20 0 EIADRP C[C@@H]([NH2+]CCCOC1CCCCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548162961 1023097121 /nfs/dbraw/zinc/09/71/21/1023097121.db2.gz GGJHBQXIDWBDBC-TZIWHRDSSA-N 2 0 344.543 4.226 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1c1cccs1 ZINC000417338816 1023272741 /nfs/dbraw/zinc/27/27/41/1023272741.db2.gz ZFWHXMSZUDDDLK-RSPOEFSDSA-N 2 0 340.536 4.352 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+]Cc1cn(-c2ccccc2Cl)nc1C(C)(C)C ZINC000415026424 1023397726 /nfs/dbraw/zinc/39/77/26/1023397726.db2.gz UIAPYGMSXINTQC-CQSZACIVSA-N 2 0 348.922 4.040 20 0 EIADRP Cc1ccc(-c2nc(CN3CCCC[C@H]3[C@H]3CC[NH2+]C3)cs2)cc1 ZINC000415034244 1023402402 /nfs/dbraw/zinc/40/24/02/1023402402.db2.gz CLTYFKNSNKWGIW-HKUYNNGSSA-N 2 0 341.524 4.083 20 0 EIADRP C[C@@H](CC[NH2+]C1CCC(C[NH3+])CC1)c1cccc(C(F)(F)F)c1 ZINC000415075778 1023423153 /nfs/dbraw/zinc/42/31/53/1023423153.db2.gz AFWDVNLLIWUBIA-CBCUQQMYSA-N 2 0 328.422 4.306 20 0 EIADRP C[C@@H]([NH2+]CCC[N@H+](C)Cc1ccccc1)c1ccc(-n2ccnc2)cc1 ZINC000310714685 1023427339 /nfs/dbraw/zinc/42/73/39/1023427339.db2.gz VKIBXSTUSBWXDC-LJQANCHMSA-N 2 0 348.494 4.045 20 0 EIADRP C[C@@H](CC[NH2+]C[C@@H]1CC[NH2+][C@H](C)C1)c1cccc(C(F)(F)F)c1 ZINC000415085931 1023435090 /nfs/dbraw/zinc/43/50/90/1023435090.db2.gz IZHGWLHZDSOXBZ-RRFJBIMHSA-N 2 0 328.422 4.177 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)cnc1F ZINC000893328044 1023472243 /nfs/dbraw/zinc/47/22/43/1023472243.db2.gz RVFLCNIEPCOQBL-UHFFFAOYSA-N 2 0 341.474 4.051 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ccc(-n2ccnc2)cc1 ZINC000120151990 1023503125 /nfs/dbraw/zinc/50/31/25/1023503125.db2.gz SUQDTGIAZZTQOI-ROUUACIJSA-N 2 0 328.504 4.033 20 0 EIADRP c1csc(-c2nc(C[N@@H+]3CCC[C@@H](C4CC[NH2+]CC4)C3)cs2)c1 ZINC000656783989 1023529452 /nfs/dbraw/zinc/52/94/52/1023529452.db2.gz BYPICGGRUOXIQK-OAHLLOKOSA-N 2 0 347.553 4.083 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCNc1ccc(C[NH+]2CCCC[C@@H]2C)cn1 ZINC001167750757 1023617351 /nfs/dbraw/zinc/61/73/51/1023617351.db2.gz BHEUNUPTUGBTLM-MOPGFXCFSA-N 2 0 344.547 4.132 20 0 EIADRP C[C@@H]1CCCC[NH+]1Cc1ccc(NCCC[N@H+]2CCCC[C@H]2C)nc1 ZINC001167750760 1023617600 /nfs/dbraw/zinc/61/76/00/1023617600.db2.gz BHEUNUPTUGBTLM-RTBURBONSA-N 2 0 344.547 4.132 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)c2cnc(C)s2)cc1 ZINC000090403132 1023621212 /nfs/dbraw/zinc/62/12/12/1023621212.db2.gz QKJASANGKRJSQW-OAHLLOKOSA-N 2 0 347.528 4.023 20 0 EIADRP Cc1ccc([C@@H](C[NH2+]C2CC(c3ccccn3)C2)N2CCCC2)cc1 ZINC000377616435 1023635090 /nfs/dbraw/zinc/63/50/90/1023635090.db2.gz POBLTDAJPKWGMZ-QETWGEEDSA-N 2 0 335.495 4.063 20 0 EIADRP C[C@@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1cscn1 ZINC000581737911 1023658520 /nfs/dbraw/zinc/65/85/20/1023658520.db2.gz WEHQICVRNBCLHV-FAEJEUNOSA-N 2 0 329.513 4.237 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cc(F)ccc1Br ZINC000020049122 1023713778 /nfs/dbraw/zinc/71/37/78/1023713778.db2.gz XRXXHEBZOWTWRG-ZDUSSCGKSA-N 2 0 345.300 4.188 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc(F)cc1Br ZINC000020049185 1023714813 /nfs/dbraw/zinc/71/48/13/1023714813.db2.gz OWOUXUCDPOMWGB-ZDUSSCGKSA-N 2 0 345.300 4.188 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CC2(SC)CC2)ccc1OC ZINC000193830387 1023728486 /nfs/dbraw/zinc/72/84/86/1023728486.db2.gz DKDUTXUFXCETKS-HNNXBMFYSA-N 2 0 336.545 4.083 20 0 EIADRP CCC[NH+]1CCC([N@H+](C)Cc2cc(C)c(OC(F)F)c(C)c2)CC1 ZINC000510468839 1023774397 /nfs/dbraw/zinc/77/43/97/1023774397.db2.gz HRMCIYRDIRXEER-UHFFFAOYSA-N 2 0 340.458 4.211 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1cccc(O)c1 ZINC000194874416 1023788833 /nfs/dbraw/zinc/78/88/33/1023788833.db2.gz YCUXAVPGPXPJSK-OAHLLOKOSA-N 2 0 330.497 4.017 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCO3)c1 ZINC000178202998 1023831173 /nfs/dbraw/zinc/83/11/73/1023831173.db2.gz NRLMBDJFGDQOQO-KRWDZBQOSA-N 2 0 338.495 4.314 20 0 EIADRP Fc1ccc(/C=C\C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000511784734 1023881320 /nfs/dbraw/zinc/88/13/20/1023881320.db2.gz HTRSVHHRMMMBJK-BQHGXPCASA-N 2 0 342.433 4.090 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000157850190 1023894780 /nfs/dbraw/zinc/89/47/80/1023894780.db2.gz HZENDPIAMANXQQ-LJQANCHMSA-N 3 0 335.580 4.028 20 0 EIADRP COc1cccc([C@@H](C)[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000430710904 1023966590 /nfs/dbraw/zinc/96/65/90/1023966590.db2.gz UYBMRFRSVCJWNL-UYAOXDASSA-N 2 0 338.495 4.210 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]C1(c2ccccc2C)CCC1 ZINC000651862355 1024112522 /nfs/dbraw/zinc/11/25/22/1024112522.db2.gz NGDHOBGEZVIAPP-UHFFFAOYSA-N 2 0 332.451 4.053 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)CCCOc2ccc(Cl)c(C)c2)C1 ZINC000510653326 1024172826 /nfs/dbraw/zinc/17/28/26/1024172826.db2.gz RERWBZBBXGVHGA-DLBZAZTESA-N 2 0 338.923 4.127 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(OCc2ccccc2)cc1 ZINC000301216790 1033191653 /nfs/dbraw/zinc/19/16/53/1033191653.db2.gz ZGYBRBIMGYDIHW-QUCCMNQESA-N 2 0 338.495 4.258 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000510699554 1024251894 /nfs/dbraw/zinc/25/18/94/1024251894.db2.gz BZSMHBUQTFDQRG-NVXWUHKLSA-N 2 0 342.449 4.348 20 0 EIADRP Cc1cc(OCCC[C@@H](C)[NH2+]CC2=CC[N@H+](C)CC2)ccc1Cl ZINC000510711446 1024280021 /nfs/dbraw/zinc/28/00/21/1024280021.db2.gz COXMMVPJNFMTPI-MRXNPFEDSA-N 2 0 336.907 4.047 20 0 EIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1NCc1cc2cnccc2o1 ZINC000651731091 1024284853 /nfs/dbraw/zinc/28/48/53/1024284853.db2.gz GAHVVLHOYRHHRS-IRXDYDNUSA-N 2 0 349.478 4.074 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H](CC(C)C)c2ccc(F)cc2)CC1 ZINC000652148224 1024327879 /nfs/dbraw/zinc/32/78/79/1024327879.db2.gz RLHSKWXDKBYMJX-FQEVSTJZSA-N 2 0 336.495 4.003 20 0 EIADRP Clc1ccc([C@H]2c3ccsc3CCN2CCn2ccnc2)cc1 ZINC000661788564 1024509788 /nfs/dbraw/zinc/50/97/88/1024509788.db2.gz QABNDDXVGAKZBJ-SFHVURJKSA-N 2 0 343.883 4.246 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ccc(Br)cn1 ZINC000684549449 1024526437 /nfs/dbraw/zinc/52/64/37/1024526437.db2.gz ORYWBSRUJWMIRG-KBPBESRZSA-N 2 0 342.325 4.005 20 0 EIADRP Oc1cccc2c(NCc3ccccc3C[NH+]3CCCC3)cc[nH+]c12 ZINC000684566206 1024799940 /nfs/dbraw/zinc/79/99/40/1024799940.db2.gz MLTPGJIGAOVHEO-UHFFFAOYSA-N 2 0 333.435 4.148 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)o1 ZINC000548482338 1024826475 /nfs/dbraw/zinc/82/64/75/1024826475.db2.gz GDXCIRCCZXLUCZ-HFSMHLIXSA-N 2 0 340.511 4.409 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)o1 ZINC000548482337 1024826819 /nfs/dbraw/zinc/82/68/19/1024826819.db2.gz GDXCIRCCZXLUCZ-FBBABVLZSA-N 2 0 340.511 4.409 20 0 EIADRP CCC[C@H]([NH2+][C@H](Cn1ccnc1)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000326661146 1025000914 /nfs/dbraw/zinc/00/09/14/1025000914.db2.gz JBASGJMEORUEGF-ZWKOTPCHSA-N 2 0 344.459 4.337 20 0 EIADRP CC[C@H](C)[C@@H](C)[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000341980433 1025020148 /nfs/dbraw/zinc/02/01/48/1025020148.db2.gz QGAYTACBDVALBY-RBUKOAKNSA-N 2 0 332.532 4.082 20 0 EIADRP Cc1nc(C(C)C)sc1[C@@H](C)[N@H+](C)Cc1cccc2c1CC[NH2+]C2 ZINC000662278577 1025025842 /nfs/dbraw/zinc/02/58/42/1025025842.db2.gz HELVGZNCAONQGR-OAHLLOKOSA-N 2 0 343.540 4.414 20 0 EIADRP Fc1ccc(C2([NH2+]Cc3cccc4c3CC[NH2+]C4)CCCC2)c(F)c1 ZINC000662282762 1025032224 /nfs/dbraw/zinc/03/22/24/1025032224.db2.gz QMUYDDDCMDUOFN-UHFFFAOYSA-N 2 0 342.433 4.170 20 0 EIADRP C[C@H](c1ccc(OC(F)F)cc1)[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000662294957 1025043870 /nfs/dbraw/zinc/04/38/70/1025043870.db2.gz XKNDRCZHXSRYSK-RHSMWYFYSA-N 2 0 338.442 4.061 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CCCc2c(Cl)cccc2Cl)[C@@H](C)C1 ZINC000684613738 1025088372 /nfs/dbraw/zinc/08/83/72/1025088372.db2.gz KWQZEZWWMMSKHA-GUYCJALGSA-N 2 0 329.315 4.246 20 0 EIADRP CC(C)[C@H]([NH3+])CC[NH2+]Cc1ccc(-c2nc3ccccc3s2)o1 ZINC000663498269 1025591120 /nfs/dbraw/zinc/59/11/20/1025591120.db2.gz ABVOWUSJWABPDP-CQSZACIVSA-N 2 0 329.469 4.019 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1cccs1 ZINC000643535904 1025725518 /nfs/dbraw/zinc/72/55/18/1025725518.db2.gz KXIQXVSGZIDLLJ-AEFFLSMTSA-N 2 0 346.927 4.417 20 0 EIADRP C[C@H]1CN(CCC[NH2+]Cc2cc(-c3ccccc3)cs2)CCCO1 ZINC000432352162 1025728202 /nfs/dbraw/zinc/72/82/02/1025728202.db2.gz WCXDNBAKLIFWEO-KRWDZBQOSA-N 2 0 344.524 4.006 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+]C2CC(c3ccccc3Cl)C2)c1 ZINC000512032792 1025804458 /nfs/dbraw/zinc/80/44/58/1025804458.db2.gz WWZZEDGWEUAVGE-UHFFFAOYSA-N 2 0 328.887 4.437 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(C(=O)c2ccccc2F)CC1 ZINC001167834565 1025822559 /nfs/dbraw/zinc/82/25/59/1025822559.db2.gz KVLIARBZEQGPJJ-QGZVFWFLSA-N 2 0 348.506 4.231 20 0 EIADRP Clc1ccc(-c2nc(C[N@@H+]3CCC4(C3)CC[NH2+]CC4)cs2)cc1 ZINC000262041160 1025824875 /nfs/dbraw/zinc/82/48/75/1025824875.db2.gz PEKSGUHNEWTVQS-UHFFFAOYSA-N 2 0 347.915 4.039 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C ZINC000511045030 1025831404 /nfs/dbraw/zinc/83/14/04/1025831404.db2.gz RMTHQWIIJXLHSZ-PZSQYBTKSA-N 2 0 332.532 4.192 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@H]1c1ccc(C(=O)OC)cc1 ZINC001167836397 1025847096 /nfs/dbraw/zinc/84/70/96/1025847096.db2.gz ZHBCKCYUTFODNU-XLIONFOSSA-N 2 0 346.515 4.121 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(Oc2cccc(C)c2)CC1 ZINC001167839379 1025852134 /nfs/dbraw/zinc/85/21/34/1025852134.db2.gz XPDDRCKVZYELIT-IBGZPJMESA-N 2 0 332.532 4.349 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(c2cccc(OC)c2)CC1 ZINC001167839716 1025852280 /nfs/dbraw/zinc/85/22/80/1025852280.db2.gz BLJBFEPTLOYMEZ-SFHVURJKSA-N 2 0 332.532 4.385 20 0 EIADRP C[C@H]([NH2+]CCC[N@@H+]1CCCO[C@@H](C)C1)c1ccc(OC(C)(C)C)cc1 ZINC000432409160 1025878500 /nfs/dbraw/zinc/87/85/00/1025878500.db2.gz FGQFWCAWVCEDBS-ROUUACIJSA-N 2 0 348.531 4.015 20 0 EIADRP CC(C)n1cc([C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)cn1 ZINC000163945924 1025880287 /nfs/dbraw/zinc/88/02/87/1025880287.db2.gz SSYQNVQQBPUATK-SFHVURJKSA-N 2 0 340.515 4.301 20 0 EIADRP Cc1cc(N(C)C)ccc1NC1CC[NH+](CCc2ccccc2)CC1 ZINC000237145633 1025892797 /nfs/dbraw/zinc/89/27/97/1025892797.db2.gz ZWJZOWGJBMIJMT-UHFFFAOYSA-N 2 0 337.511 4.180 20 0 EIADRP CCn1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)cn1 ZINC000157652741 1025908382 /nfs/dbraw/zinc/90/83/82/1025908382.db2.gz LMFYQAPROZAPJH-ZWKOTPCHSA-N 2 0 340.515 4.128 20 0 EIADRP C[C@H]1C[N@H+](CCC[NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CCCO1 ZINC000432433117 1025969378 /nfs/dbraw/zinc/96/93/78/1025969378.db2.gz ZORANQBABCGQMQ-UWJYYQICSA-N 2 0 348.506 4.148 20 0 EIADRP c1cc2c(cccc2C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)s1 ZINC001167970408 1026047474 /nfs/dbraw/zinc/04/74/74/1026047474.db2.gz JXMLAVFQLFPBQW-AYHJJNSGSA-N 2 0 326.509 4.396 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2cc(C)c(Br)s2)C1 ZINC000512130023 1026078600 /nfs/dbraw/zinc/07/86/00/1026078600.db2.gz MNMSTUIGANKHDT-STQMWFEESA-N 2 0 345.350 4.202 20 0 EIADRP C[C@H](C[NH2+][C@H](C)c1cccc(OC(F)F)c1)C[NH+]1CCCCC1 ZINC000390933914 1026093403 /nfs/dbraw/zinc/09/34/03/1026093403.db2.gz IHMSCUZAYPUUBQ-HUUCEWRRSA-N 2 0 326.431 4.061 20 0 EIADRP CCOc1ccc(C[NH2+]Cc2cccc(C[N@H+](C)CC)c2)c(C)c1 ZINC000657347540 1026212403 /nfs/dbraw/zinc/21/24/03/1026212403.db2.gz BCWJNROWVGBUCR-UHFFFAOYSA-N 2 0 326.484 4.135 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1)C1CC[NH+](C)CC1 ZINC000684774095 1026247455 /nfs/dbraw/zinc/24/74/55/1026247455.db2.gz QNYJFTUBAVBIOS-MZMPZRCHSA-N 2 0 340.433 4.271 20 0 EIADRP CC(C)(C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)Cc1ccccc1F ZINC001167977523 1026332533 /nfs/dbraw/zinc/33/25/33/1026332533.db2.gz DEMSNQHRHPWCGY-IHWFROFDSA-N 2 0 344.518 4.389 20 0 EIADRP COCc1csc(C[NH2+]C2CCN([C@@H](C)c3ccccc3)CC2)c1 ZINC000657367576 1026333980 /nfs/dbraw/zinc/33/39/80/1026333980.db2.gz QWGJNAUVYPIZOI-INIZCTEOSA-N 2 0 344.524 4.210 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2csc(-c3csc(C)n3)c2)C1 ZINC000163260804 1026360865 /nfs/dbraw/zinc/36/08/65/1026360865.db2.gz FQFHKBRGBWPGMZ-JSGCOSHPSA-N 2 0 335.542 4.172 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cccc3[nH]ccc32)C1 ZINC000512210338 1026471011 /nfs/dbraw/zinc/47/10/11/1026471011.db2.gz CRSIVWJQOHJUJC-MSOLQXFVSA-N 2 0 325.500 4.254 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc3ccccc3s2)[C@H](C)C1 ZINC000132698301 1026565986 /nfs/dbraw/zinc/56/59/86/1026565986.db2.gz ITARHSAFPBFCMO-APWZRJJASA-N 2 0 346.540 4.128 20 0 EIADRP CO[C@H](CC(C)C)C[N@H+](C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC001167571826 1026584174 /nfs/dbraw/zinc/58/41/74/1026584174.db2.gz BAVWZTYANQEMTE-CEWLAPEOSA-N 2 0 332.532 4.032 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000119805537 1026654446 /nfs/dbraw/zinc/65/44/46/1026654446.db2.gz YGHQNAKVMHCOAZ-KRWDZBQOSA-N 2 0 348.494 4.093 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1nc(-c2ccccc2)cs1 ZINC000236860632 1026734519 /nfs/dbraw/zinc/73/45/19/1026734519.db2.gz HSYBPIKSCIZZHB-INIZCTEOSA-N 2 0 331.529 4.410 20 0 EIADRP CC(C)n1nccc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000279877653 1026744593 /nfs/dbraw/zinc/74/45/93/1026744593.db2.gz KATXARHUBMABAX-SFHVURJKSA-N 2 0 340.515 4.128 20 0 EIADRP [NH3+][C@@H]1C[C@H](NC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)c2ccccc21 ZINC000261629364 1026755807 /nfs/dbraw/zinc/75/58/07/1026755807.db2.gz VTYNMQHREBQRHS-PMOQBDJRSA-N 2 0 349.522 4.023 20 0 EIADRP c1cc(Oc2ccccc2)oc1C[NH+]1CCC(C[NH+]2CCCC2)CC1 ZINC000507627164 1026857876 /nfs/dbraw/zinc/85/78/76/1026857876.db2.gz VAKMRQZIIWONIS-UHFFFAOYSA-N 2 0 340.467 4.380 20 0 EIADRP C[C@@H]1CC[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)[C@H](C)C1 ZINC000342810183 1027094147 /nfs/dbraw/zinc/09/41/47/1027094147.db2.gz PDDILRIQBHIENG-LZJOCLMNSA-N 2 0 330.516 4.074 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)C1CCSCC1 ZINC000474472409 1027100481 /nfs/dbraw/zinc/10/04/81/1027100481.db2.gz OEQXUDNFURTZMM-QGZVFWFLSA-N 2 0 332.557 4.294 20 0 EIADRP C[C@@H]([NH2+]CCC[NH+]1CCCCC1)[C@@H](C)c1nc2ccccc2s1 ZINC000474477166 1027109970 /nfs/dbraw/zinc/10/99/70/1027109970.db2.gz QSWVSIHXSXNXPD-HZPDHXFCSA-N 2 0 331.529 4.254 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000474477199 1027111238 /nfs/dbraw/zinc/11/12/38/1027111238.db2.gz RCBBSSSKCCLRQH-OTWHNJEPSA-N 2 0 332.532 4.431 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)C3CCCC3)CC2)cc1 ZINC000474597613 1027262974 /nfs/dbraw/zinc/26/29/74/1027262974.db2.gz JQWWUSLHYBVNMJ-QGZVFWFLSA-N 2 0 330.516 4.076 20 0 EIADRP Clc1ccc(CCC[N@@H+]2CC[C@@H]3[C@H](CCCN3C3CC3)C2)cc1 ZINC000441410726 1027529037 /nfs/dbraw/zinc/52/90/37/1027529037.db2.gz LTMXLAKPEYUKPX-YLJYHZDGSA-N 2 0 332.919 4.221 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cc1 ZINC000474812441 1027533313 /nfs/dbraw/zinc/53/33/13/1027533313.db2.gz DLGLOJSPEFFUFJ-HZPDHXFCSA-N 2 0 344.474 4.178 20 0 EIADRP CC(C)O[C@@H](C[NH+]1CCC(CCC[NH+](C)C)CC1)c1ccccc1 ZINC000428303586 1027553168 /nfs/dbraw/zinc/55/31/68/1027553168.db2.gz SURSQGUARCPGJY-NRFANRHFSA-N 2 0 332.532 4.207 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000320915256 1027563353 /nfs/dbraw/zinc/56/33/53/1027563353.db2.gz DOOGLPPWFUVPDY-UKPHBRMFSA-N 2 0 326.406 4.230 20 0 EIADRP CC(C)OC1CCC([NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)CC1 ZINC000090771697 1027593745 /nfs/dbraw/zinc/59/37/45/1027593745.db2.gz HFGACSNZTCBQAX-FQVISZRSSA-N 2 0 348.531 4.014 20 0 EIADRP CC(C)COc1ccccc1CN1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000441449614 1028002984 /nfs/dbraw/zinc/00/29/84/1028002984.db2.gz PNUDYZQXPZSECH-LJQANCHMSA-N 2 0 330.516 4.029 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](CC[C@H](C)OCc2ccccc2)CC1 ZINC000475046141 1028209528 /nfs/dbraw/zinc/20/95/28/1028209528.db2.gz GSGUDKVQBGCDGQ-IBGZPJMESA-N 2 0 332.532 4.036 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH+]1CCC(Cc2ccccc2)CC1 ZINC000346143157 1028278533 /nfs/dbraw/zinc/27/85/33/1028278533.db2.gz PSPYYHVQMGFYLR-UHFFFAOYSA-N 2 0 346.478 4.030 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+](Cc1ccc(F)cc1)C(C)C ZINC000346142377 1028279221 /nfs/dbraw/zinc/27/92/21/1028279221.db2.gz AOJUBABFKQVVIY-UHFFFAOYSA-N 2 0 338.430 4.125 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@H+]1C[C@@H](c2ccccc2C)C[C@H]1C ZINC000346197005 1028322198 /nfs/dbraw/zinc/32/21/98/1028322198.db2.gz DCWIQCSVWHXZCT-MJGOQNOKSA-N 2 0 346.478 4.262 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCC12CCOCC2 ZINC000548794489 1028696426 /nfs/dbraw/zinc/69/64/26/1028696426.db2.gz HYECITHUGVEMOS-RXVVDRJESA-N 2 0 342.527 4.110 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cccc(C(F)(F)F)c2)CC1 ZINC000524156207 1028723439 /nfs/dbraw/zinc/72/34/39/1028723439.db2.gz UTQOETKUFUZBIG-UHFFFAOYSA-N 2 0 328.422 4.258 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+]CC[C@H](C)[NH+]2CCCCC2)cc1 ZINC000346870254 1028803595 /nfs/dbraw/zinc/80/35/95/1028803595.db2.gz LSLLFWLRJBCPSN-ROUUACIJSA-N 2 0 340.515 4.096 20 0 EIADRP Cc1nc(-c2ccccc2)oc1C[NH+]1CCC(C[N@@H+](C)C(C)C)CC1 ZINC000639473119 1028807510 /nfs/dbraw/zinc/80/75/10/1028807510.db2.gz FOUPGTCNCWTLDP-UHFFFAOYSA-N 2 0 341.499 4.202 20 0 EIADRP Clc1cccc2c1SCC[C@H]2[NH2+]Cc1cccc2c1CC[NH2+]C2 ZINC000635013018 1028822382 /nfs/dbraw/zinc/82/23/82/1028822382.db2.gz YONHOBNHDUCBJX-GOSISDBHSA-N 2 0 344.911 4.312 20 0 EIADRP C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000347001250 1028836668 /nfs/dbraw/zinc/83/66/68/1028836668.db2.gz GVNOGJMJNKQWEU-UKRRQHHQSA-N 2 0 334.410 4.000 20 0 EIADRP C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000347001251 1028838017 /nfs/dbraw/zinc/83/80/17/1028838017.db2.gz GVNOGJMJNKQWEU-ZFWWWQNUSA-N 2 0 334.410 4.000 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)c(F)c1 ZINC000650718354 1028878245 /nfs/dbraw/zinc/87/82/45/1028878245.db2.gz IEBLRIZRQDJHSJ-UHFFFAOYSA-N 2 0 346.755 4.246 20 0 EIADRP CC(C)C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000647302039 1028993315 /nfs/dbraw/zinc/99/33/15/1028993315.db2.gz PKUBGQGLNVZYJC-UNMCSNQZSA-N 2 0 337.511 4.281 20 0 EIADRP CCCOC1CC[NH+](C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CC1 ZINC001168051004 1028994207 /nfs/dbraw/zinc/99/42/07/1028994207.db2.gz FEVVBHOUUVETDB-RTBURBONSA-N 2 0 344.543 4.319 20 0 EIADRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000650743942 1029063373 /nfs/dbraw/zinc/06/33/73/1029063373.db2.gz BWUOIJQGXKQNDA-OAHLLOKOSA-N 2 0 328.431 4.398 20 0 EIADRP C[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000650746079 1029081847 /nfs/dbraw/zinc/08/18/47/1029081847.db2.gz VSYYJAQSYIGTGQ-GFCCVEGCSA-N 2 0 332.435 4.121 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(Cl)c(Cl)c1 ZINC000650752207 1029137955 /nfs/dbraw/zinc/13/79/55/1029137955.db2.gz LVWYOOJHPWZOOR-SNVBAGLBSA-N 2 0 327.230 4.442 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)c1ccc(OC(F)(F)F)cc1 ZINC000650752404 1029139450 /nfs/dbraw/zinc/13/94/50/1029139450.db2.gz QLTWODUKGCOSJK-LLVKDONJSA-N 2 0 342.336 4.034 20 0 EIADRP COCCC1CC[NH+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168053295 1029158341 /nfs/dbraw/zinc/15/83/41/1029158341.db2.gz NCYBYCFUKZHZEF-OALUTQOASA-N 2 0 344.543 4.177 20 0 EIADRP C[C@@H]1C[C@@H]([NH+]2CC[C@@H](c3cccnc3)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168053365 1029160105 /nfs/dbraw/zinc/16/01/05/1029160105.db2.gz OEOPTENAXNXTEN-IYRWYFENSA-N 2 0 349.522 4.313 20 0 EIADRP C[C@@H]1CC([N@@H+]2CC[C@@H](c3cccnc3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168053367 1029161394 /nfs/dbraw/zinc/16/13/94/1029161394.db2.gz OEOPTENAXNXTEN-WOIUINJBSA-N 2 0 349.522 4.313 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC(NCc2ccc(C[NH3+])cc2F)CC1 ZINC000650755960 1029183369 /nfs/dbraw/zinc/18/33/69/1029183369.db2.gz QIYFKZOSZJFEQY-UHFFFAOYSA-N 2 0 349.538 4.053 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@H](c2ccccc2F)C2CCCC2)c(F)c1 ZINC000650755135 1029185741 /nfs/dbraw/zinc/18/57/41/1029185741.db2.gz ZYKMNDOBAIJDNX-FQEVSTJZSA-N 2 0 330.422 4.445 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)c1sccc1Br ZINC000650758674 1029216546 /nfs/dbraw/zinc/21/65/46/1029216546.db2.gz VIHGDNPJVJOSPR-LLVKDONJSA-N 2 0 339.302 4.081 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)C(c1ccccc1)c1ccccc1 ZINC000247057236 1029234413 /nfs/dbraw/zinc/23/44/13/1029234413.db2.gz NPHJKQROAITBMN-NYVOZVTQSA-N 2 0 334.507 4.423 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]CCC2CC[NH2+]CC2)cc1 ZINC000650764112 1029277146 /nfs/dbraw/zinc/27/71/46/1029277146.db2.gz QNUSWZQJOSHMJQ-KRWDZBQOSA-N 2 0 338.495 4.403 20 0 EIADRP C[C@@H]1CC([N@@H+]2CC[C@@]3(CC3(F)F)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168058825 1029374297 /nfs/dbraw/zinc/37/42/97/1029374297.db2.gz CPEDYAHEHKEJCY-GPMSIDNRSA-N 2 0 334.454 4.159 20 0 EIADRP C[C@@H](CCc1ccsc1)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475265284 1029474978 /nfs/dbraw/zinc/47/49/78/1029474978.db2.gz IAKYENKSBAKLTK-FXAWDEMLSA-N 2 0 328.525 4.181 20 0 EIADRP C[C@@H]1[C@H]([NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)C[C@H]1c1ccccc1 ZINC000475278833 1029485526 /nfs/dbraw/zinc/48/55/26/1029485526.db2.gz XFRGCHVCJFGVPL-CVNLYIMZSA-N 2 0 334.507 4.290 20 0 EIADRP C[C@@H](CCc1ccc(F)cc1)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475270416 1029486606 /nfs/dbraw/zinc/48/66/06/1029486606.db2.gz SEXAYVRXHQITJI-GHTZIAJQSA-N 2 0 340.486 4.259 20 0 EIADRP CC(C)[C@@H](COCc1ccccc1)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000446742895 1029553054 /nfs/dbraw/zinc/55/30/54/1029553054.db2.gz HOGDRZVXZINKJO-JOCHJYFZSA-N 2 0 340.511 4.079 20 0 EIADRP C[C@H](CC[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1 ZINC000446758578 1029572259 /nfs/dbraw/zinc/57/22/59/1029572259.db2.gz JUGMXEJCQWCTGH-LJQANCHMSA-N 2 0 337.511 4.424 20 0 EIADRP CCO[C@H](C[NH2+]C1CC[NH+]([C@@H]2CCC[C@H](C)C2)CC1)c1ccccc1 ZINC000446838155 1029599471 /nfs/dbraw/zinc/59/94/71/1029599471.db2.gz FONBMHIUMUCABB-VLCRHTCISA-N 2 0 344.543 4.397 20 0 EIADRP CSC1CC[NH+](C2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168063142 1029605865 /nfs/dbraw/zinc/60/58/65/1029605865.db2.gz MEOWZSGNEZHNRL-IRXDYDNUSA-N 2 0 332.557 4.255 20 0 EIADRP CC(C)[NH+]1CCC([NH2+][C@H]2CCc3[nH]c4ccc(Cl)cc4c3C2)CC1 ZINC000647321887 1029613080 /nfs/dbraw/zinc/61/30/80/1029613080.db2.gz VXVAXDQNFXWVPU-INIZCTEOSA-N 2 0 345.918 4.141 20 0 EIADRP CCOCc1ccc(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000151608026 1029622590 /nfs/dbraw/zinc/62/25/90/1029622590.db2.gz UGJSFFALNRQJEC-UHFFFAOYSA-N 2 0 330.516 4.110 20 0 EIADRP COc1ccc2cc([C@H](C)[NH2+]CC3CC[NH+](C4CC4)CC3)ccc2c1 ZINC000447024886 1029666553 /nfs/dbraw/zinc/66/65/53/1029666553.db2.gz ATJLAPGPBYENNF-INIZCTEOSA-N 2 0 338.495 4.373 20 0 EIADRP Clc1cc2c(c(Cl)c1)CC[C@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447036290 1029669628 /nfs/dbraw/zinc/66/96/28/1029669628.db2.gz DNMNRHFEFDHYHP-GOSISDBHSA-N 2 0 339.310 4.445 20 0 EIADRP CSc1ccc([C@@H](C)[NH2+]CC2(SC)CC[NH+](C)CC2)cc1F ZINC000584261686 1029698620 /nfs/dbraw/zinc/69/86/20/1029698620.db2.gz PTWLUZCZXSGWJP-CYBMUJFWSA-N 2 0 342.549 4.026 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1cc2ccncc2s1 ZINC000657838297 1029727950 /nfs/dbraw/zinc/72/79/50/1029727950.db2.gz QNIMILYZHITDBU-MRXNPFEDSA-N 2 0 331.529 4.459 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1cccc(C2CC2)c1 ZINC000708502468 1029743932 /nfs/dbraw/zinc/74/39/32/1029743932.db2.gz HNSCXKKPRRKWIP-JPYJTQIMSA-N 2 0 334.507 4.422 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNCc1ccc(Cl)cc1F ZINC000708519306 1029744110 /nfs/dbraw/zinc/74/41/10/1029744110.db2.gz HNRPWTURFWUPRO-CRAIPNDOSA-N 2 0 346.877 4.337 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCc2ccc(F)cc21)c1cccc(OCC[NH+](C)C)c1 ZINC000089552528 1029854666 /nfs/dbraw/zinc/85/46/66/1029854666.db2.gz YXQGNGKSKOBELW-QVKFZJNVSA-N 2 0 342.458 4.104 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](c2cccnc2)C(C)C)cc1 ZINC000091267344 1029882680 /nfs/dbraw/zinc/88/26/80/1029882680.db2.gz QCCYUGGNFVMXJV-OAQYLSRUSA-N 2 0 325.500 4.410 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000091333286 1029884567 /nfs/dbraw/zinc/88/45/67/1029884567.db2.gz AGBXUTCNOOKOBH-QGZVFWFLSA-N 2 0 326.406 4.088 20 0 EIADRP Cc1nc(C)c([C@@H](C)[NH2+]C2CCC([NH+]3CCC(C)CC3)CC2)s1 ZINC000181663804 1029905613 /nfs/dbraw/zinc/90/56/13/1029905613.db2.gz JIGBOBSNMXSLPU-FAEJEUNOSA-N 2 0 335.561 4.454 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccc(Br)cc1 ZINC000171126486 1030060983 /nfs/dbraw/zinc/06/09/83/1030060983.db2.gz SFDNCCNUXFRNOY-CQSZACIVSA-N 2 0 347.300 4.362 20 0 EIADRP C[C@H](C[NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc(F)cc1 ZINC000525869866 1030090978 /nfs/dbraw/zinc/09/09/78/1030090978.db2.gz MABIRSXSTXXNNZ-MRXNPFEDSA-N 2 0 346.515 4.493 20 0 EIADRP C[C@@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000657875693 1030142323 /nfs/dbraw/zinc/14/23/23/1030142323.db2.gz HSGZOLSWTBAQGI-GXTWGEPZSA-N 2 0 348.840 4.221 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccc(Br)c(Cl)c1 ZINC000657877297 1030154970 /nfs/dbraw/zinc/15/49/70/1030154970.db2.gz PUYOODWCPKWMGA-NWDGAFQWSA-N 2 0 345.712 4.095 20 0 EIADRP FC1(F)CC[C@@H](C[N@@H+]2CC[C@@]3(CC[NH+](Cc4ccccc4)C3)C2)C1 ZINC000450981581 1030159359 /nfs/dbraw/zinc/15/93/59/1030159359.db2.gz IYLQQWYUBYFUKN-RTBURBONSA-N 2 0 334.454 4.020 20 0 EIADRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]CC2CC[NH+](C3CC3)CC2)c1 ZINC000447561103 1030170159 /nfs/dbraw/zinc/17/01/59/1030170159.db2.gz WNQVHNBFVYJFKO-AWEZNQCLSA-N 2 0 338.442 4.121 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H](Cc2ccc(F)cc2)c2ccccc2)CC1 ZINC000447561339 1030172164 /nfs/dbraw/zinc/17/21/64/1030172164.db2.gz HTDVVJVTSFJYJA-OAQYLSRUSA-N 2 0 326.459 4.041 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CC[NH2+]C12CCC2 ZINC000530217583 1030224846 /nfs/dbraw/zinc/22/48/46/1030224846.db2.gz UFJLZDBAGCGITE-HNAYVOBHSA-N 2 0 325.500 4.098 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cscc1Br ZINC000302676841 1030246419 /nfs/dbraw/zinc/24/64/19/1030246419.db2.gz NVUSBYJQQMBYGW-GFCCVEGCSA-N 2 0 333.339 4.111 20 0 EIADRP CCC[NH+]1CCC([N@H+](C)CCCc2c(F)cccc2Cl)CC1 ZINC000447743713 1030315238 /nfs/dbraw/zinc/31/52/38/1030315238.db2.gz HXCKJOUCSPNQMX-UHFFFAOYSA-N 2 0 326.887 4.218 20 0 EIADRP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@H]1CCOc2ccccc21 ZINC000685456694 1030334841 /nfs/dbraw/zinc/33/48/41/1030334841.db2.gz JAROUSWNDBVKGC-HXUWFJFHSA-N 2 0 338.495 4.136 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2[nH]nc3ccccc32)CC1)CC(C)C ZINC000685462660 1030340153 /nfs/dbraw/zinc/34/01/53/1030340153.db2.gz SJAXQSRFTVARFG-UHFFFAOYSA-N 2 0 342.531 4.143 20 0 EIADRP C([C@H]1CCC2(CCCC2)O1)[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000530410444 1030382386 /nfs/dbraw/zinc/38/23/86/1030382386.db2.gz SOSOOMKJSPFJDI-VQTJNVASSA-N 2 0 334.548 4.066 20 0 EIADRP CCC[NH+]1CCC([NH2+]C/C(C)=C\c2ccccc2OC(F)F)CC1 ZINC000685612450 1030562427 /nfs/dbraw/zinc/56/24/27/1030562427.db2.gz SXBYKIVUINEXMW-SQFISAMPSA-N 2 0 338.442 4.155 20 0 EIADRP COCCCC[C@@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1 ZINC000527241352 1030570958 /nfs/dbraw/zinc/57/09/58/1030570958.db2.gz WZTQJDFLTGYOSB-OAQYLSRUSA-N 2 0 330.516 4.008 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(Br)o1)c1cccc(-n2ccnc2)c1 ZINC000191240613 1030610867 /nfs/dbraw/zinc/61/08/67/1030610867.db2.gz ZQGHVIIKGYDOLO-LBPRGKRZSA-N 2 0 346.228 4.079 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C[C@@H]1CCC[N@@H+](C)C1 ZINC000548851783 1030633012 /nfs/dbraw/zinc/63/30/12/1030633012.db2.gz FHCPGEDZZOCZAD-IPJDOKCGSA-N 2 0 326.406 4.040 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccc2cc[nH]c21 ZINC000398167212 1030718330 /nfs/dbraw/zinc/71/83/30/1030718330.db2.gz TZNXXSQHOVWSQK-DYESRHJHSA-N 2 0 333.479 4.168 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1C[N@H+](C)C[C@H]1c1ccccc1)c1ccc(C(F)F)nc1 ZINC000658041827 1030794251 /nfs/dbraw/zinc/79/42/51/1030794251.db2.gz JCVLEWJOVVTAMN-QGTPRVQTSA-N 2 0 345.437 4.015 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)[C@H](C)C1CCCCC1 ZINC000658066999 1030812375 /nfs/dbraw/zinc/81/23/75/1030812375.db2.gz JHHIDCNEAXLQAT-ZWKOTPCHSA-N 2 0 336.564 4.072 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CCc2cc(Cl)ccc21 ZINC000527796073 1030862092 /nfs/dbraw/zinc/86/20/92/1030862092.db2.gz VAJYKVLWAQGGGC-IBGZPJMESA-N 2 0 338.842 4.006 20 0 EIADRP c1ccc([C@H]2CCC[C@@H]2[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658168781 1030864560 /nfs/dbraw/zinc/86/45/60/1030864560.db2.gz YSOOTCPXIWSFSZ-PKTZIBPZSA-N 2 0 349.522 4.220 20 0 EIADRP Cc1cc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c(C)s1 ZINC000658167361 1030864636 /nfs/dbraw/zinc/86/46/36/1030864636.db2.gz RTUDPDAVYKFGEO-INIZCTEOSA-N 2 0 343.540 4.323 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c2ccccc21 ZINC000658168411 1030865431 /nfs/dbraw/zinc/86/54/31/1030865431.db2.gz WVNFJHVNUUIYHA-VGOFRKELSA-N 2 0 335.495 4.132 20 0 EIADRP CC[C@H]1C[C@@H]([NH2+]CC2(CC)CC[NH+](Cc3ccccc3)CC2)CCO1 ZINC000648488627 1030881160 /nfs/dbraw/zinc/88/11/60/1030881160.db2.gz CMDPIAILMDHQSK-SFTDATJTSA-N 2 0 344.543 4.226 20 0 EIADRP C[C@]1(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@H]3CCC[C@H]32)CC1(F)F ZINC000658219636 1030885540 /nfs/dbraw/zinc/88/55/40/1030885540.db2.gz CJANBTSUOQPLGU-ZSYWTGECSA-N 2 0 334.454 4.065 20 0 EIADRP CC(C)c1cccc([C@H](C)[NH2+]C2CC[NH+]([C@@H]3CCCC[C@H]3O)CC2)c1 ZINC000527872491 1030890283 /nfs/dbraw/zinc/89/02/83/1030890283.db2.gz LZHADIGHMWAEKD-MTNREXPMSA-N 2 0 344.543 4.229 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](CC2CC2)CC1)c1ccccc1OC(F)F ZINC000658356654 1031025633 /nfs/dbraw/zinc/02/56/33/1031025633.db2.gz LHMRWKVUWPJSST-CQSZACIVSA-N 2 0 338.442 4.061 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCSc2ccc(Cl)cc2)[C@H](C)C1 ZINC001167686154 1031027147 /nfs/dbraw/zinc/02/71/47/1031027147.db2.gz OICXACFCFZZISX-PBHICJAKSA-N 2 0 326.937 4.094 20 0 EIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@H]2CCc3cccnc3CC2)c1 ZINC000421822432 1031034183 /nfs/dbraw/zinc/03/41/83/1031034183.db2.gz WYGJFCMYMRWPHC-QFIPXVFZSA-N 2 0 349.522 4.105 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccccc3)CC2)cc1 ZINC000532463512 1031120536 /nfs/dbraw/zinc/12/05/36/1031120536.db2.gz HSKPZJXNGSLONL-GOSISDBHSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1cccc(CO)c1 ZINC000305665115 1031212337 /nfs/dbraw/zinc/21/23/37/1031212337.db2.gz TZOQSYYUZNMIRA-SFHVURJKSA-N 2 0 338.495 4.016 20 0 EIADRP C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000532500223 1031236025 /nfs/dbraw/zinc/23/60/25/1031236025.db2.gz MTWAJEYWZKZGLJ-LHSJRXKWSA-N 2 0 344.449 4.440 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCCC1)c1ccc(-n2cccn2)cc1 ZINC000532511012 1031245208 /nfs/dbraw/zinc/24/52/08/1031245208.db2.gz OMYNLLSSPZAERI-IBGZPJMESA-N 2 0 340.515 4.179 20 0 EIADRP CCC1(C[NH2+]Cc2oc(C)nc2C)CC[NH+](Cc2ccccc2)CC1 ZINC000628231581 1031252580 /nfs/dbraw/zinc/25/25/80/1031252580.db2.gz TYLAUFPLQBYIHH-UHFFFAOYSA-N 2 0 341.499 4.073 20 0 EIADRP CCc1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)o1 ZINC000531602954 1031406725 /nfs/dbraw/zinc/40/67/25/1031406725.db2.gz PNCBHILCMLEUFH-QGZVFWFLSA-N 2 0 326.484 4.364 20 0 EIADRP Cc1cc(C)n(CCC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)n1 ZINC000449058350 1031411195 /nfs/dbraw/zinc/41/11/95/1031411195.db2.gz IIJKQEAWZZKEAE-UHFFFAOYSA-N 2 0 348.579 4.159 20 0 EIADRP CCc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)o1 ZINC000531603084 1031422534 /nfs/dbraw/zinc/42/25/34/1031422534.db2.gz PPYNXTAWASCEQB-UHFFFAOYSA-N 2 0 326.484 4.364 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+][C@H]3CCOC4(CCC4)C3)cc2)C1 ZINC000449074137 1031425153 /nfs/dbraw/zinc/42/51/53/1031425153.db2.gz BLRAZDRQHRYDEV-RXVVDRJESA-N 2 0 342.527 4.110 20 0 EIADRP CS[C@@H]1CCC[C@H]([NH2+]C2CC[NH+]([C@@H](C)Cc3ccccc3)CC2)C1 ZINC000449143942 1031479330 /nfs/dbraw/zinc/47/93/30/1031479330.db2.gz RNBYESBIVXZLAG-DZFGPLHGSA-N 2 0 346.584 4.346 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CCCc1ccc(Cl)cc1Cl ZINC000531738283 1031515308 /nfs/dbraw/zinc/51/53/08/1031515308.db2.gz FUHJTXZAAOBUOM-XNJGSVPQSA-N 2 0 329.315 4.244 20 0 EIADRP Cc1ccc2sc(C[NH+]3CCC(CCC[NH+](C)C)CC3)nc2c1 ZINC000528434646 1031515977 /nfs/dbraw/zinc/51/59/77/1031515977.db2.gz XBXMTGYXXMLBCF-UHFFFAOYSA-N 2 0 331.529 4.159 20 0 EIADRP COc1cccc(-c2ccc(C[NH2+][C@@H]3C[C@@H](C)[N@H+](C)C[C@H]3C)cc2)c1 ZINC000531725042 1031526644 /nfs/dbraw/zinc/52/66/44/1031526644.db2.gz GKOGDKVOLNRRMT-DRSNIGMVSA-N 2 0 338.495 4.181 20 0 EIADRP COCC1CCC([NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000449216234 1031549421 /nfs/dbraw/zinc/54/94/21/1031549421.db2.gz QQJAFAMENNRVIF-NTYOPAKOSA-N 2 0 344.543 4.082 20 0 EIADRP CSCCCCC[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449256318 1031572664 /nfs/dbraw/zinc/57/26/64/1031572664.db2.gz HZDHCBAEAMPQMG-SFHVURJKSA-N 2 0 334.573 4.205 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCC[C@@H]2CCCCO2)CC1 ZINC000449241748 1031578774 /nfs/dbraw/zinc/57/87/74/1031578774.db2.gz CMGINWABOUQYFU-KNQAVFIVSA-N 2 0 344.543 4.021 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@H]2CCC(F)(F)C2)CC1 ZINC000449298096 1031605144 /nfs/dbraw/zinc/60/51/44/1031605144.db2.gz FSRJSPRAZOAGOQ-AEFFLSMTSA-N 2 0 336.470 4.107 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3CCOC4(CCCC4)C3)CC2)C1 ZINC000127341960 1031687425 /nfs/dbraw/zinc/68/74/25/1031687425.db2.gz MATZZTSUOAOGQV-RLLQIKCJSA-N 2 0 334.548 4.111 20 0 EIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]Cc2ccc(C[NH+](C)C)cc2)cc1 ZINC000531944452 1031825573 /nfs/dbraw/zinc/82/55/73/1031825573.db2.gz NNOXLFJNYMCUOK-DLBZAZTESA-N 2 0 326.484 4.039 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000449556688 1031843220 /nfs/dbraw/zinc/84/32/20/1031843220.db2.gz NLUNPHRZRHYZBH-IHWFROFDSA-N 2 0 336.479 4.077 20 0 EIADRP Cc1cc2c(cc1C)[C@H](NC1CC[NH+](CC(C)C)CC1)CCCO2 ZINC000531941889 1031852896 /nfs/dbraw/zinc/85/28/96/1031852896.db2.gz PLSIPKRFGQALHB-HXUWFJFHSA-N 2 0 330.516 4.227 20 0 EIADRP COc1ccc([C@H]2CCCC[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1F ZINC000453359698 1031889608 /nfs/dbraw/zinc/88/96/08/1031889608.db2.gz QFNHWAAPNACHMS-VCOHRLAKSA-N 2 0 346.490 4.075 20 0 EIADRP CC[NH+](CC)C[C@H]1CCCC[C@@H]1[NH2+]C1CCC2(CCOCC2)CC1 ZINC000531979785 1031926090 /nfs/dbraw/zinc/92/60/90/1031926090.db2.gz VSVWPYQAUCIGFK-QUCCMNQESA-N 2 0 336.564 4.216 20 0 EIADRP CCN(c1ccccc1)c1ccc(C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000531980330 1031928214 /nfs/dbraw/zinc/92/82/14/1031928214.db2.gz ZZLICZRAQDKBBY-UYAOXDASSA-N 2 0 337.511 4.417 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccccc1OC(F)(F)F ZINC000453418666 1031951236 /nfs/dbraw/zinc/95/12/36/1031951236.db2.gz YPYJMNSLYIUWPI-ZDUSSCGKSA-N 2 0 330.394 4.110 20 0 EIADRP C[C@H]1Cc2ccc(F)cc2[C@@H]1[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000531993868 1031960352 /nfs/dbraw/zinc/96/03/52/1031960352.db2.gz CLAQBNDNXQCGCH-YCRPNKLZSA-N 2 0 330.491 4.446 20 0 EIADRP COc1ccc2oc([C@@H](C)[NH2+]CCCC[N@H+](C)C3CC3)c(C)c2c1 ZINC000453419329 1031976627 /nfs/dbraw/zinc/97/66/27/1031976627.db2.gz YUHNVSKYXOPYOG-OAHLLOKOSA-N 2 0 330.472 4.275 20 0 EIADRP Clc1ccc2c(c1Cl)CC[C@@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000152482539 1031985859 /nfs/dbraw/zinc/98/58/59/1031985859.db2.gz VEJXYTHYOAXBBJ-ZBEGNZNMSA-N 2 0 325.283 4.055 20 0 EIADRP CC(C)Oc1ccc(C[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000512831764 1034028654 /nfs/dbraw/zinc/02/86/54/1034028654.db2.gz DNTGUKHDIYOVHM-KDURUIRLSA-N 2 0 332.532 4.322 20 0 EIADRP c1ccc2c(c1)ccnc2C[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000894153833 1034379540 /nfs/dbraw/zinc/37/95/40/1034379540.db2.gz NMYXFMMRXOEIHG-UHFFFAOYSA-N 2 0 331.463 4.120 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+]Cc2cc3ccnc(Cl)c3s2)CC1 ZINC000894195607 1034655149 /nfs/dbraw/zinc/65/51/49/1034655149.db2.gz KZQYTXIEMHAGDK-UHFFFAOYSA-N 2 0 337.920 4.302 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+]CCCC[N@@H+]1CCC[C@H](C)C1 ZINC000509927401 1035011294 /nfs/dbraw/zinc/01/12/94/1035011294.db2.gz PEMNIHHGUWXXOG-RVPSJEOCSA-N 2 0 344.543 4.338 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2ccccc2OCc2ccccc2)CC1 ZINC000513702342 1035328797 /nfs/dbraw/zinc/32/87/97/1035328797.db2.gz IELGCNFJQCDMMI-UHFFFAOYSA-N 2 0 338.495 4.228 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000501378235 1035432840 /nfs/dbraw/zinc/43/28/40/1035432840.db2.gz PACLTWOMMVQFQZ-DYQZNNLLSA-N 2 0 343.559 4.456 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)CC[N@@H+]1C ZINC000501465710 1035449496 /nfs/dbraw/zinc/44/94/96/1035449496.db2.gz GLQWXKQJLVHTFW-FOIQADDNSA-N 2 0 344.449 4.169 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)CC1 ZINC000501476019 1035452660 /nfs/dbraw/zinc/45/26/60/1035452660.db2.gz UDEKJNIWDGWMHY-RBBKRZOGSA-N 2 0 343.559 4.456 20 0 EIADRP Cc1cc(C[N@@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)ccc1C(F)(F)F ZINC000414439529 1035456384 /nfs/dbraw/zinc/45/63/84/1035456384.db2.gz LDTBDVRWXAQYCJ-XYPWUTKMSA-N 2 0 326.406 4.071 20 0 EIADRP FC(F)(F)c1cccc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000261818051 1035483348 /nfs/dbraw/zinc/48/33/48/1035483348.db2.gz WIZAOJBFLINDQT-BRWVUGGUSA-N 2 0 326.406 4.106 20 0 EIADRP CC[NH2+]CC1CC[NH+](Cc2nc(-c3ccccc3Cl)cs2)CC1 ZINC000420297266 1035495800 /nfs/dbraw/zinc/49/58/00/1035495800.db2.gz YKSLTJBUYBRUHZ-UHFFFAOYSA-N 2 0 349.931 4.285 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(SC(F)F)cc2)C1 ZINC000151137008 1035508825 /nfs/dbraw/zinc/50/88/25/1035508825.db2.gz WJAHMMKECJIULY-UONOGXRCSA-N 2 0 328.472 4.384 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420327446 1035533575 /nfs/dbraw/zinc/53/35/75/1035533575.db2.gz LDPLGFBKDPYTHZ-BMFZPTHFSA-N 2 0 326.406 4.088 20 0 EIADRP Brc1ccc([C@H]2CCC[N@@H+]2CCC2CC[NH2+]CC2)s1 ZINC000420377147 1035559560 /nfs/dbraw/zinc/55/95/60/1035559560.db2.gz RRLZEZOMUWZFPB-CYBMUJFWSA-N 2 0 343.334 4.037 20 0 EIADRP C[C@@H](c1ccc(OC(F)F)cc1)[NH+]1CCC(CCC[NH+](C)C)CC1 ZINC000501770133 1035577124 /nfs/dbraw/zinc/57/71/24/1035577124.db2.gz MWPJNGVCLMIWON-HNNXBMFYSA-N 2 0 340.458 4.403 20 0 EIADRP Cc1cc(O)c(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cc1C ZINC000059579068 1035640894 /nfs/dbraw/zinc/64/08/94/1035640894.db2.gz HZEVGVSRVVXAQG-UHFFFAOYSA-N 2 0 330.516 4.097 20 0 EIADRP c1cnc2c(c1)cccc2C[N@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491053937 1035798758 /nfs/dbraw/zinc/79/87/58/1035798758.db2.gz ACMSWCCASFFPOM-LJQANCHMSA-N 2 0 337.511 4.323 20 0 EIADRP Cc1cc(C)c([C@H](C)[N@@H+]2CC[C@H](C(F)(F)F)[C@H](C[NH3+])C2)c(C)c1 ZINC000629561781 1035830951 /nfs/dbraw/zinc/83/09/51/1035830951.db2.gz KKJWUZKTAKQDHN-XHSDSOJGSA-N 2 0 328.422 4.132 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)c1cccc(OCC[NH+](C)C)c1 ZINC000502511882 1036270762 /nfs/dbraw/zinc/27/07/62/1036270762.db2.gz VAAXEDHSRBNMKX-JKSUJKDBSA-N 2 0 340.458 4.103 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2ccc(Cl)c(Br)c2)CC1 ZINC000421369516 1036313868 /nfs/dbraw/zinc/31/38/68/1036313868.db2.gz HVWVKUMTGVRQEL-UHFFFAOYSA-N 2 0 345.712 4.065 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2cc(Cl)ccc2Br)CC1 ZINC000421378462 1036329901 /nfs/dbraw/zinc/32/99/01/1036329901.db2.gz VFSJZMXTSSIFAY-UHFFFAOYSA-N 2 0 345.712 4.065 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000421381921 1036340649 /nfs/dbraw/zinc/34/06/49/1036340649.db2.gz XMGUXAYIDFTTMS-NNZPWHBESA-N 2 0 326.937 4.356 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1cnn(C2CCCC2)c1 ZINC000502727536 1036586848 /nfs/dbraw/zinc/58/68/48/1036586848.db2.gz NRVMEIMBNUTJDW-ROUUACIJSA-N 2 0 332.536 4.303 20 0 EIADRP Fc1ccc2cc(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)[nH]c2c1 ZINC000486697843 1036818215 /nfs/dbraw/zinc/81/82/15/1036818215.db2.gz UFDFMKKIBPOLIS-UHFFFAOYSA-N 2 0 329.463 4.194 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cc3ccc(F)cc3[nH]2)cc1 ZINC000486699298 1036819481 /nfs/dbraw/zinc/81/94/81/1036819481.db2.gz HGGVGHYCDRSJAW-UHFFFAOYSA-N 2 0 339.458 4.439 20 0 EIADRP Cc1cc(C[NH2+]C2CCC([N@H+](C)Cc3ccccc3)CC2)cc(C)n1 ZINC000421848313 1036824692 /nfs/dbraw/zinc/82/46/92/1036824692.db2.gz AGXJSCJHPLWQBP-UHFFFAOYSA-N 2 0 337.511 4.231 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]C1CCC([NH+](C)C)CC1)CCCS2 ZINC000421876767 1036828864 /nfs/dbraw/zinc/82/88/64/1036828864.db2.gz LCEFXOKEPPMQQH-JTTJXQCZSA-N 2 0 334.529 4.085 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C2CCC([NH+](C)C)CC2)c2ccccc12 ZINC000421871989 1036839871 /nfs/dbraw/zinc/83/98/71/1036839871.db2.gz GKJBWJJRGFFOFS-GTPINHCMSA-N 2 0 326.484 4.372 20 0 EIADRP CCOc1ccc([C@H]2CCC[N@@H+]2C2CC[NH+](CC3CC3)CC2)cc1 ZINC001168392697 1036852676 /nfs/dbraw/zinc/85/26/76/1036852676.db2.gz SBRLOHALUCJXJE-OAQYLSRUSA-N 2 0 328.500 4.097 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CCc2cccc3[nH]ccc32)CCN1Cc1ccccc1 ZINC000503123233 1036921236 /nfs/dbraw/zinc/92/12/36/1036921236.db2.gz RMWSXKGBFUCZLY-WIYYLYMNSA-N 2 0 347.506 4.353 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+]C/C=C\c2ccncc2)C1 ZINC000486980344 1036930910 /nfs/dbraw/zinc/93/09/10/1036930910.db2.gz MLNZGQKTTZRNBH-SBUVDCAVSA-N 2 0 349.522 4.363 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]C[C@H]3CCSC3)cc2)C1 ZINC000486985700 1036933917 /nfs/dbraw/zinc/93/39/17/1036933917.db2.gz HXLYYRMMWIDVKE-MBOZVWFJSA-N 2 0 332.557 4.007 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]CC2=CC[N@H+](C)CC2)cc1 ZINC000271868080 1037042835 /nfs/dbraw/zinc/04/28/35/1037042835.db2.gz LWGUHTCFYQMMPJ-QGZVFWFLSA-N 2 0 336.479 4.275 20 0 EIADRP C[NH+](C)CCCC[NH2+]Cc1cn(Cc2ccccc2)c2ccccc12 ZINC000590611209 1037117124 /nfs/dbraw/zinc/11/71/24/1037117124.db2.gz HMTGMCHRROKDFR-UHFFFAOYSA-N 2 0 335.495 4.121 20 0 EIADRP CCC1(C[NH2+]C[C@H]2CCSC2)CC[NH+](Cc2ccccc2)CC1 ZINC000487555374 1037137747 /nfs/dbraw/zinc/13/77/47/1037137747.db2.gz GIQAAWIBTOEXEL-LJQANCHMSA-N 2 0 332.557 4.022 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](CCCOc2ccc(Cl)cc2)CC1 ZINC000590786469 1037167006 /nfs/dbraw/zinc/16/70/06/1037167006.db2.gz BJEDEDKARNFROQ-UHFFFAOYSA-N 2 0 338.923 4.161 20 0 EIADRP CC[C@H](C)Oc1cc(C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)ccc1OC ZINC000590880850 1037197564 /nfs/dbraw/zinc/19/75/64/1037197564.db2.gz URZOVQNIOHPMKB-HNNXBMFYSA-N 2 0 348.531 4.271 20 0 EIADRP COc1cccc([C@@H](C)[NH+]2CCN(c3cc[nH+]c4ccccc43)CC2)c1 ZINC000599881943 1037222050 /nfs/dbraw/zinc/22/20/50/1037222050.db2.gz GVYCYRFIQIRRRS-QGZVFWFLSA-N 2 0 347.462 4.127 20 0 EIADRP CC(C)[NH+]1CCC([N@H+](C)CCc2cc(Cl)ccc2Cl)CC1 ZINC000487854764 1037262423 /nfs/dbraw/zinc/26/24/23/1037262423.db2.gz CYENBCYPNLFFPV-UHFFFAOYSA-N 2 0 329.315 4.341 20 0 EIADRP Oc1ccc(C2CCC([NH2+]C[C@@H]3CCC[N@H+](CC4CC4)C3)CC2)cc1 ZINC000668820336 1037352155 /nfs/dbraw/zinc/35/21/55/1037352155.db2.gz UGHIPQHHVRVQEF-JSOIOWGOSA-N 2 0 342.527 4.130 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H](c2ccccc2)C2CCC2)cc1 ZINC000591699432 1037553058 /nfs/dbraw/zinc/55/30/58/1037553058.db2.gz UHFHAHKAKGJFKG-QFIPXVFZSA-N 2 0 338.495 4.258 20 0 EIADRP C/C(=C\c1ccccc1)C[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000488459043 1037600859 /nfs/dbraw/zinc/60/08/59/1037600859.db2.gz NCNAKZCMSKCHLL-UEAVEIDSSA-N 2 0 334.507 4.244 20 0 EIADRP [NH3+]C[C@@H]1CC[N@H+](Cc2ccccc2Oc2ccc(F)cc2Cl)C1 ZINC000414649874 1037663415 /nfs/dbraw/zinc/66/34/15/1037663415.db2.gz COMMKEKLYZXLFH-ZDUSSCGKSA-N 2 0 334.822 4.052 20 0 EIADRP C[NH2+]CCC1CC[NH+](C[C@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000414660107 1037705622 /nfs/dbraw/zinc/70/56/22/1037705622.db2.gz MFBAKSANUJXLQT-AWEZNQCLSA-N 2 0 328.422 4.130 20 0 EIADRP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2N[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000513787596 1037712474 /nfs/dbraw/zinc/71/24/74/1037712474.db2.gz BLMGIIJUIBCZBP-NSHGMRRFSA-N 2 0 340.511 4.430 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](CC(F)(F)F)c1ccccc1 ZINC000422705266 1037802194 /nfs/dbraw/zinc/80/21/94/1037802194.db2.gz BOICMLMFKGXFJN-SUMWQHHRSA-N 2 0 337.389 4.193 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](CC(F)(F)F)c1ccccc1 ZINC000422705264 1037802346 /nfs/dbraw/zinc/80/23/46/1037802346.db2.gz BOICMLMFKGXFJN-DYVFJYSZSA-N 2 0 337.389 4.193 20 0 EIADRP C(CC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1)CCOC1CCCCC1 ZINC000422704251 1037802552 /nfs/dbraw/zinc/80/25/52/1037802552.db2.gz KEHVASLDUXZZMN-PCCBWWKXSA-N 2 0 336.564 4.406 20 0 EIADRP C(CC[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1)CCOC1CCCCC1 ZINC000422704246 1037802695 /nfs/dbraw/zinc/80/26/95/1037802695.db2.gz KEHVASLDUXZZMN-NJDAHSKKSA-N 2 0 336.564 4.406 20 0 EIADRP FC(F)(F)c1cccc(CCC[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCC[NH2+]2)c1 ZINC000422710655 1037804454 /nfs/dbraw/zinc/80/44/54/1037804454.db2.gz FHJRTOOHKFSMHI-KSZLIROESA-N 2 0 340.433 4.148 20 0 EIADRP C[NH+](C)CC1CCC([NH2+]Cc2ccc(Oc3ccccc3)o2)CC1 ZINC000503546554 1037804859 /nfs/dbraw/zinc/80/48/59/1037804859.db2.gz KRMZZXNBUTZWFN-UHFFFAOYSA-N 2 0 328.456 4.282 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1cccc(C(F)(F)F)c1 ZINC000422733078 1037809031 /nfs/dbraw/zinc/80/90/31/1037809031.db2.gz QNSGJKIIMZSKIE-NEPJUHHUSA-N 2 0 337.389 4.279 20 0 EIADRP c1ccc([C@H]([NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C2CCC2)cc1 ZINC000422720696 1037816049 /nfs/dbraw/zinc/81/60/49/1037816049.db2.gz SYWFMSDALGPUJK-ACIOBRDBSA-N 2 0 348.490 4.373 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000422743201 1037821907 /nfs/dbraw/zinc/82/19/07/1037821907.db2.gz RAMBCTAMGWBUPJ-MLGOLLRUSA-N 2 0 333.476 4.050 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000422743204 1037822350 /nfs/dbraw/zinc/82/23/50/1037822350.db2.gz RAMBCTAMGWBUPJ-WBMJQRKESA-N 2 0 333.476 4.050 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@H]1CCC[NH2+]CC1 ZINC000422743197 1037822720 /nfs/dbraw/zinc/82/27/20/1037822720.db2.gz RAMBCTAMGWBUPJ-LRDDRELGSA-N 2 0 333.476 4.050 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+][C@H](C)CCCC[NH3+] ZINC000422745137 1037824044 /nfs/dbraw/zinc/82/40/44/1037824044.db2.gz UOIBMBDLPJTDCZ-CHWSQXEVSA-N 2 0 335.492 4.426 20 0 EIADRP C[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(Cl)cc1 ZINC000422745347 1037824483 /nfs/dbraw/zinc/82/44/83/1037824483.db2.gz MDZNLDSIVONFDC-ADLFWFRXSA-N 2 0 342.870 4.247 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1cccc(Cl)c1 ZINC000422748885 1037826000 /nfs/dbraw/zinc/82/60/00/1037826000.db2.gz WPUQIYRVBOMEOS-QMIHWGKISA-N 2 0 342.870 4.247 20 0 EIADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CCCCSc1ccccc1Br ZINC000422750225 1037826186 /nfs/dbraw/zinc/82/61/86/1037826186.db2.gz CLQMNMQXPMHHBC-CHWSQXEVSA-N 2 0 345.350 4.037 20 0 EIADRP CCC(CC)(CN[C@H](C)c1c[nH+]ccc1N)[NH2+][C@H](C)c1ccccc1 ZINC000422773358 1037829999 /nfs/dbraw/zinc/82/99/99/1037829999.db2.gz YMRSGMWLXFLHJH-IAGOWNOFSA-N 2 0 340.515 4.054 20 0 EIADRP CC(C)[C@H]([NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1 ZINC000422776360 1037830181 /nfs/dbraw/zinc/83/01/81/1037830181.db2.gz AJAWCECDIATSAU-BVSLBCMMSA-N 2 0 336.479 4.229 20 0 EIADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](C)c1ccccc1-c1ccc(Cl)cc1 ZINC000422774491 1037830318 /nfs/dbraw/zinc/83/03/18/1037830318.db2.gz XEYRERVEHMWDAG-YJBOKZPZSA-N 2 0 346.902 4.412 20 0 EIADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](c1cccs1)c1ccc(C(C)C)cc1 ZINC000422785207 1037832058 /nfs/dbraw/zinc/83/20/58/1037832058.db2.gz MWOZTSTVDIHXGJ-QUCCMNQESA-N 2 0 346.540 4.304 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](c1ccc(F)cc1)C(C)(C)C ZINC000422788109 1037834666 /nfs/dbraw/zinc/83/46/66/1037834666.db2.gz VESUDZWLVGQYRW-LIRRHRJNSA-N 2 0 329.463 4.426 20 0 EIADRP Cc1nc(-c2ccc([C@@H](C)[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)cc2)cs1 ZINC000422800881 1037836939 /nfs/dbraw/zinc/83/69/39/1037836939.db2.gz DEEOVPKAKPBSHK-GUPASQGTSA-N 2 0 327.497 4.052 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(CN[C@@H]3C[C@@H]([NH3+])c4ccccc43)cc2)C1 ZINC000422866967 1037848660 /nfs/dbraw/zinc/84/86/60/1037848660.db2.gz RGZOJHFOMMLFJE-NLSFWIRASA-N 2 0 349.522 4.153 20 0 EIADRP Cc1ccc(SC2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)CCCC2)cc1 ZINC000422842946 1037850553 /nfs/dbraw/zinc/85/05/53/1037850553.db2.gz ZVBNESDZCLNYPY-JWTNVVGKSA-N 2 0 330.541 4.273 20 0 EIADRP CCOc1ccccc1[C@H](CC)[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422880295 1037851781 /nfs/dbraw/zinc/85/17/81/1037851781.db2.gz NWHCAIDOLLPORS-KXBFYZLASA-N 2 0 327.472 4.049 20 0 EIADRP Cc1ccc(-c2nc(CC[NH2+][C@@H](C)C[C@H]3CCCCC[NH2+]3)co2)cc1 ZINC000422878867 1037852220 /nfs/dbraw/zinc/85/22/20/1037852220.db2.gz LAEPUEYQLWSYIX-PKOBYXMFSA-N 2 0 341.499 4.093 20 0 EIADRP c1[nH]c2ccccc2c1CCC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000422884126 1037852583 /nfs/dbraw/zinc/85/25/83/1037852583.db2.gz DLAYZTFKSFRCIK-CEWLAPEOSA-N 2 0 325.500 4.001 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(Cl)cc1Cl)C1C[NH2+]C1 ZINC000422883966 1037854039 /nfs/dbraw/zinc/85/40/39/1037854039.db2.gz DIXKCPCWMMBJBL-LBPRGKRZSA-N 2 0 335.278 4.358 20 0 EIADRP Clc1ccc(-c2ccccc2C[NH2+]C2C[C@H]3CC[C@@H](C2)[NH2+]3)cc1 ZINC000422908166 1037863399 /nfs/dbraw/zinc/86/33/99/1037863399.db2.gz LZWQLBJVLHUJAM-DFNIBXOVSA-N 2 0 326.871 4.380 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+][C@H](C)CCCC[NH3+] ZINC000422914650 1037867711 /nfs/dbraw/zinc/86/77/11/1037867711.db2.gz VIFLAKUHTLFSES-CHWSQXEVSA-N 2 0 335.492 4.426 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](COc1ccccc1F)c1ccccc1 ZINC000422940950 1037876410 /nfs/dbraw/zinc/87/64/10/1037876410.db2.gz UJZXBAXFFUNKJA-APWZRJJASA-N 2 0 330.447 4.053 20 0 EIADRP c1ccc(-c2cccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)c2)nc1 ZINC000422997588 1037897870 /nfs/dbraw/zinc/89/78/70/1037897870.db2.gz OLXKLVUDFPKWAL-ILWGZMRPSA-N 2 0 335.495 4.149 20 0 EIADRP Fc1ccc(C2=CC[C@H]([NH2+][C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)CC2)cc1 ZINC000423049433 1037907902 /nfs/dbraw/zinc/90/79/02/1037907902.db2.gz XNVQRKFGLPWYTQ-DOIPELPJSA-N 2 0 328.475 4.272 20 0 EIADRP C[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423028934 1037910309 /nfs/dbraw/zinc/91/03/09/1037910309.db2.gz UCSFGSNXRYRQOC-NZILNVENSA-N 2 0 348.490 4.156 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]CCc1c[nH]c2cc(Cl)cc(Cl)c12 ZINC000423071999 1037934817 /nfs/dbraw/zinc/93/48/17/1037934817.db2.gz INTRGDSJRZGGAO-LLVKDONJSA-N 2 0 328.287 4.124 20 0 EIADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CC1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000423070845 1037935021 /nfs/dbraw/zinc/93/50/21/1037935021.db2.gz NWXWKXWVLOPYNB-MNOVXSKESA-N 2 0 334.813 4.106 20 0 EIADRP c1cncc(-c2cccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)c2)c1 ZINC000423052949 1037935992 /nfs/dbraw/zinc/93/59/92/1037935992.db2.gz RNPRFTVWFAFHQR-BHDDXSALSA-N 2 0 335.495 4.149 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1cc2cccc(F)c2o1 ZINC000423074980 1037937272 /nfs/dbraw/zinc/93/72/72/1037937272.db2.gz VVJBTQXSRMLKSK-YPMHNXCESA-N 2 0 327.403 4.146 20 0 EIADRP COCCCC[C@@H]([NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)c1ccccc1 ZINC000423085557 1037944040 /nfs/dbraw/zinc/94/40/40/1037944040.db2.gz KTYQFOFHVRZCHJ-LAUBAEHRSA-N 2 0 341.499 4.057 20 0 EIADRP CC(C)Oc1ccc([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000574226559 1037957286 /nfs/dbraw/zinc/95/72/86/1037957286.db2.gz LXEUECOKWKUMSH-QRVBRYPASA-N 2 0 348.531 4.014 20 0 EIADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000423098582 1037958166 /nfs/dbraw/zinc/95/81/66/1037958166.db2.gz SIXHXYLSYSZIGR-MEGFKASBSA-N 2 0 326.459 4.010 20 0 EIADRP COCCC[C@H](C[NH2+][C@H]1CCCCC[C@@H]1[NH3+])c1ccc(Cl)cc1 ZINC000423100148 1037959710 /nfs/dbraw/zinc/95/97/10/1037959710.db2.gz GJSCORDWAFUPEZ-NEWSRXKRSA-N 2 0 338.923 4.100 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1CCCc2sc(Cl)cc21 ZINC000423126401 1037967525 /nfs/dbraw/zinc/96/75/25/1037967525.db2.gz ISIBCJAIYCFURJ-NHYWBVRUSA-N 2 0 335.904 4.292 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+]C[C@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000423123769 1037970019 /nfs/dbraw/zinc/97/00/19/1037970019.db2.gz FGQXWCFSMYHNJC-JXFKEZNVSA-N 2 0 346.902 4.315 20 0 EIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+][C@@H](C)CCCC[NH3+])cc1 ZINC000423120409 1037970394 /nfs/dbraw/zinc/97/03/94/1037970394.db2.gz GKVYNDPLAPSDEA-LAUBAEHRSA-N 2 0 326.484 4.086 20 0 EIADRP C[C@@H]([NH2+]CCc1cccc2[nH]ccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000503903619 1037975732 /nfs/dbraw/zinc/97/57/32/1037975732.db2.gz RDJZNOIOIUYCQB-NQIIRXRSSA-N 2 0 347.506 4.211 20 0 EIADRP FC(F)(F)[C@H](CC[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1)c1ccccc1 ZINC000423127232 1037977453 /nfs/dbraw/zinc/97/74/53/1037977453.db2.gz BRDAWSJFZUXFKW-BRSBDYLESA-N 2 0 340.433 4.233 20 0 EIADRP CC[N@H+](Cc1cnc(-c2ccc(C)cc2)s1)[C@@H]1CCC[NH2+]CC1 ZINC000414718368 1037982758 /nfs/dbraw/zinc/98/27/58/1037982758.db2.gz RLSVYADJCFVCTD-QGZVFWFLSA-N 2 0 329.513 4.083 20 0 EIADRP Cc1cc([C@@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)ccc1F ZINC000423146630 1037999241 /nfs/dbraw/zinc/99/92/41/1037999241.db2.gz PUVDPGSUIITNAQ-MFMILTCTSA-N 2 0 340.442 4.041 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+]Cc2ccccc2OCc2ccccc2)CC1 ZINC000503925948 1038004808 /nfs/dbraw/zinc/00/48/08/1038004808.db2.gz DPCNXFYAYMDRAL-UHFFFAOYSA-N 2 0 338.495 4.087 20 0 EIADRP Cc1ccsc1C[N@H+](Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000414725638 1038057891 /nfs/dbraw/zinc/05/78/91/1038057891.db2.gz WPOBZUZQWCXBEP-QGZVFWFLSA-N 2 0 332.538 4.262 20 0 EIADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]C1)c1ccc2cc(OC)ccc2c1 ZINC000423219273 1038064148 /nfs/dbraw/zinc/06/41/48/1038064148.db2.gz SZKPNLYKUGMAFF-VMRPVKRXSA-N 2 0 326.484 4.277 20 0 EIADRP Cc1cccc(C)c1OCCC[N@@H+]1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000606447865 1038066417 /nfs/dbraw/zinc/06/64/17/1038066417.db2.gz IOHLNUHWUFGOFQ-HXUWFJFHSA-N 2 0 330.516 4.023 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423256658 1038086038 /nfs/dbraw/zinc/08/60/38/1038086038.db2.gz FPCPBHUITWYKGN-UONOGXRCSA-N 2 0 346.462 4.381 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423283594 1038088968 /nfs/dbraw/zinc/08/89/68/1038088968.db2.gz XNUHACNUVYSSNT-DLBZAZTESA-N 2 0 327.516 4.203 20 0 EIADRP Cc1ccc([C@H](C)C[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)cc1 ZINC000606471600 1038096255 /nfs/dbraw/zinc/09/62/55/1038096255.db2.gz ZEUVAKVUVGQDSL-LJQANCHMSA-N 2 0 340.511 4.219 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccccc2OC(F)(F)F)cc1 ZINC000423292199 1038097261 /nfs/dbraw/zinc/09/72/61/1038097261.db2.gz LYMZQYLXUJBWKD-OLZOCXBDSA-N 2 0 338.373 4.456 20 0 EIADRP CC(C)[C@@H](COCc1ccccc1)[NH2+]Cc1ccc([C@H](C)[NH3+])cc1 ZINC000423293691 1038097884 /nfs/dbraw/zinc/09/78/84/1038097884.db2.gz RXUMSWWKBFPFQZ-LAUBAEHRSA-N 2 0 326.484 4.037 20 0 EIADRP [NH3+][C@H](C[NH2+][C@H]1CCCC[C@H]1c1ccc(C(F)(F)F)cc1)C1CC1 ZINC000423315518 1038111044 /nfs/dbraw/zinc/11/10/44/1038111044.db2.gz IWPRQOJDMRVMFA-BBWFWOEESA-N 2 0 326.406 4.059 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2ccc(OC(F)(F)F)cc2)cc1 ZINC000423296588 1038121564 /nfs/dbraw/zinc/12/15/64/1038121564.db2.gz ZMBLLRLHJWGMQU-CHWSQXEVSA-N 2 0 338.373 4.456 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]CC1=CC[NH2+]CC1 ZINC000423345069 1038136159 /nfs/dbraw/zinc/13/61/59/1038136159.db2.gz NNAVAUOSXALOGL-LBPRGKRZSA-N 2 0 347.915 4.342 20 0 EIADRP CC1(C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)CC[NH2+]CC1 ZINC000423333459 1038150016 /nfs/dbraw/zinc/15/00/16/1038150016.db2.gz PXQSOVRXARLHMF-INIZCTEOSA-N 2 0 326.406 4.136 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@@H]1CCC[C@H]([NH3+])C1 ZINC000423368901 1038186125 /nfs/dbraw/zinc/18/61/25/1038186125.db2.gz DMNIISVCNWNTLY-FPMFFAJLSA-N 2 0 333.476 4.178 20 0 EIADRP Clc1cccc([C@H]2CC[C@H]([NH2+]Cc3ccc4c(c3)C[NH2+]C4)C2)c1 ZINC000423383636 1038192706 /nfs/dbraw/zinc/19/27/06/1038192706.db2.gz KMWFNNZRWIVIFN-JXFKEZNVSA-N 2 0 326.871 4.369 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@H]1CC[NH2+]C[C@H]1C ZINC000423392766 1038198464 /nfs/dbraw/zinc/19/84/64/1038198464.db2.gz MACWNAVUTASONN-WQGACYEGSA-N 2 0 349.931 4.421 20 0 EIADRP COCC1(C[NH2+][C@H](C)c2ccc(-c3ccccc3)cc2)CC[NH2+]CC1 ZINC000423388697 1038198692 /nfs/dbraw/zinc/19/86/92/1038198692.db2.gz KWMGIMHAUXVPCI-GOSISDBHSA-N 2 0 338.495 4.020 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H](Cc2ccccc2Cl)c2cccs2)CC[NH2+]1 ZINC000423388620 1038199131 /nfs/dbraw/zinc/19/91/31/1038199131.db2.gz UHGDEOHQTGUAOI-UNEWFSDZSA-N 2 0 334.916 4.415 20 0 EIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CCCO2 ZINC000423399737 1038207215 /nfs/dbraw/zinc/20/72/15/1038207215.db2.gz UWVDNYFTSJXMSZ-NRFANRHFSA-N 2 0 336.479 4.417 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1cccc2c1CCCN2 ZINC000423422166 1038213206 /nfs/dbraw/zinc/21/32/06/1038213206.db2.gz YKFWFZVBRHMVBX-PGRDOPGGSA-N 2 0 349.522 4.045 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccccc1OC(F)(F)F ZINC000423406140 1038217883 /nfs/dbraw/zinc/21/78/83/1038217883.db2.gz YPZNSDKWXABEIB-LBPRGKRZSA-N 2 0 336.357 4.039 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccc(F)cc1)c1cnc2ccccc2c1 ZINC000423443822 1038224174 /nfs/dbraw/zinc/22/41/74/1038224174.db2.gz AQMSDGMOGFMQEK-BTYIYWSLSA-N 2 0 337.442 4.180 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000423444790 1038225167 /nfs/dbraw/zinc/22/51/67/1038225167.db2.gz MCXAKZSBEREZHE-XMSQKQJNSA-N 2 0 349.522 4.045 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)c1ccc(OC(F)F)cc1 ZINC000423427492 1038230695 /nfs/dbraw/zinc/23/06/95/1038230695.db2.gz QQTNZBGGNCMLMU-ZQIUZPCESA-N 2 0 326.431 4.094 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](c1ccc(Br)cc1)C1CC1 ZINC000423440469 1038237635 /nfs/dbraw/zinc/23/76/35/1038237635.db2.gz TUGBULSQAPJBLL-WBMJQRKESA-N 2 0 325.294 4.007 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000423462741 1038240432 /nfs/dbraw/zinc/24/04/32/1038240432.db2.gz FAHORMJWIMWGMX-AEGPPILISA-N 2 0 347.503 4.426 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@@H](c2ccc(Br)cc2)C2CC2)C1 ZINC000423461972 1038243293 /nfs/dbraw/zinc/24/32/93/1038243293.db2.gz DBEUEJMHKIRWER-CSMYWGQOSA-N 2 0 337.305 4.007 20 0 EIADRP Fc1ccc(C([NH2+]CCC[C@H]2CCC[NH2+]2)c2ccc(F)cc2)cc1 ZINC000423474899 1038246966 /nfs/dbraw/zinc/24/69/66/1038246966.db2.gz HVCUOWXIAKYIKI-LJQANCHMSA-N 2 0 330.422 4.176 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]C[C@@H]1CCC[C@H]([NH3+])C1 ZINC000423472177 1038247104 /nfs/dbraw/zinc/24/71/04/1038247104.db2.gz MXSAGEKLIVLADG-QGTPRVQTSA-N 2 0 343.540 4.210 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423472175 1038247230 /nfs/dbraw/zinc/24/72/30/1038247230.db2.gz MXSAGEKLIVLADG-BMGDILEWSA-N 2 0 343.540 4.210 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]C[C@H]1CCC[C@@H]([NH3+])C1 ZINC000423472176 1038247569 /nfs/dbraw/zinc/24/75/69/1038247569.db2.gz MXSAGEKLIVLADG-JCGIZDLHSA-N 2 0 343.540 4.210 20 0 EIADRP Cc1cc([C@@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)sc1Br ZINC000423478370 1038249416 /nfs/dbraw/zinc/24/94/16/1038249416.db2.gz LDUDOLWHLCPGMG-NEPJUHHUSA-N 2 0 331.323 4.002 20 0 EIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cnn(C2CCCC2)c1 ZINC000423499459 1038254187 /nfs/dbraw/zinc/25/41/87/1038254187.db2.gz AYPYWIDUSATFRY-JXFKEZNVSA-N 2 0 326.488 4.129 20 0 EIADRP [NH3+]CCC[C@H]([NH2+][C@H]1CCSc2ccc(F)cc21)c1ccccc1 ZINC000423499229 1038255182 /nfs/dbraw/zinc/25/51/82/1038255182.db2.gz IZZHRZVFEBWWQT-ROUUACIJSA-N 2 0 330.472 4.432 20 0 EIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cnn(Cc2ccccc2)c1 ZINC000423498594 1038255718 /nfs/dbraw/zinc/25/57/18/1038255718.db2.gz IHASLSNIJFDTAJ-XMSQKQJNSA-N 2 0 348.494 4.062 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000423486812 1038260349 /nfs/dbraw/zinc/26/03/49/1038260349.db2.gz SUXWRPAHIRKYRB-IAGOWNOFSA-N 2 0 327.516 4.346 20 0 EIADRP C[C@@H](CCc1ccc(C(F)(F)F)cc1)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423487726 1038260681 /nfs/dbraw/zinc/26/06/81/1038260681.db2.gz UPKJNFGWKKPDTA-YOEHRIQHSA-N 2 0 328.422 4.148 20 0 EIADRP FC(F)(F)c1cccc([C@H]([NH2+]CCC[C@H]2CCC[NH2+]2)C2CC2)c1 ZINC000423487685 1038262753 /nfs/dbraw/zinc/26/27/53/1038262753.db2.gz UOCNFQPJYNJUNY-IAGOWNOFSA-N 2 0 326.406 4.278 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423535625 1038271803 /nfs/dbraw/zinc/27/18/03/1038271803.db2.gz DSSXBCAQRVRIPT-ZDUSSCGKSA-N 2 0 345.487 4.218 20 0 EIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cccc(OC(F)F)c1 ZINC000423511495 1038272215 /nfs/dbraw/zinc/27/22/15/1038272215.db2.gz TWQDSKLPKUEVKW-KBXCAEBGSA-N 2 0 334.410 4.419 20 0 EIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ncc(-c2ccccc2)n1C ZINC000423518993 1038275046 /nfs/dbraw/zinc/27/50/46/1038275046.db2.gz PNRYVSBWCDFMQB-YLJYHZDGSA-N 2 0 348.494 4.218 20 0 EIADRP Clc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@H]3C[NH2+]C[C@H]3C1)CCCS2 ZINC000423539075 1038284732 /nfs/dbraw/zinc/28/47/32/1038284732.db2.gz HRDQISNFXJKPPG-TZDHZFECSA-N 2 0 336.932 4.245 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423538646 1038285028 /nfs/dbraw/zinc/28/50/28/1038285028.db2.gz NTANIKRFBFIVFM-CYBMUJFWSA-N 2 0 345.487 4.218 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@@H]2C1 ZINC000423538690 1038285151 /nfs/dbraw/zinc/28/51/51/1038285151.db2.gz GVTWYVLFRCABNR-HNONPPJISA-N 2 0 341.524 4.157 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@@H]4C3)cs2)cs1 ZINC000423539622 1038285175 /nfs/dbraw/zinc/28/51/75/1038285175.db2.gz IPVSQFKDNNAWLM-ZGMNHVEMSA-N 2 0 347.553 4.219 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+][C@@H]3CC[C@H]4C[NH2+]C[C@H]4C3)cs2)cs1 ZINC000423539621 1038285742 /nfs/dbraw/zinc/28/57/42/1038285742.db2.gz IPVSQFKDNNAWLM-YYWXWVFPSA-N 2 0 347.553 4.219 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@H]1CCCC[NH2+]C1 ZINC000423556826 1038295931 /nfs/dbraw/zinc/29/59/31/1038295931.db2.gz MTILJOCXGVBWKI-WBMJQRKESA-N 2 0 333.476 4.050 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H](CC2CCOCC2)c2ccccc2)CC1 ZINC001168312085 1038785135 /nfs/dbraw/zinc/78/51/35/1038785135.db2.gz JIBALBQCPDEQDC-XVAXZDLZSA-N 2 0 330.516 4.007 20 0 EIADRP Cc1ccc(-c2nc(C[N@H+]3CC4(C[C@H]3C)CC[NH2+]CC4)cs2)cc1 ZINC000424284649 1038794204 /nfs/dbraw/zinc/79/42/04/1038794204.db2.gz DLHGDIAWHCCYRJ-MRXNPFEDSA-N 2 0 341.524 4.083 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](Cc2ccncc2)c2cccs2)C1 ZINC000424311948 1038798442 /nfs/dbraw/zinc/79/84/42/1038798442.db2.gz LNZKKMFZBSLTNU-RBUKOAKNSA-N 2 0 343.540 4.137 20 0 EIADRP CCc1ccc([C@H](CC)[NH2+]C2CC[NH+]([C@H]3CCCC[C@H]3O)CC2)cc1 ZINC000539058430 1038805220 /nfs/dbraw/zinc/80/52/20/1038805220.db2.gz JONIJNGJMLMQFX-FDFHNCONSA-N 2 0 344.543 4.058 20 0 EIADRP CC[C@@H](CSc1ccc(Cl)cc1)[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000480772779 1038810035 /nfs/dbraw/zinc/81/00/35/1038810035.db2.gz GOTWPMAUYRBWQB-HOCLYGCPSA-N 2 0 338.948 4.285 20 0 EIADRP C[C@@H]1C[N@@H+](CCCC[NH2+][C@@H](CC2CC2)c2ccccc2)C[C@H](C)O1 ZINC000539071188 1038820958 /nfs/dbraw/zinc/82/09/58/1038820958.db2.gz FRCBNMYLFVGSSE-UEXGIBASSA-N 2 0 330.516 4.007 20 0 EIADRP Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000504893366 1038839244 /nfs/dbraw/zinc/83/92/44/1038839244.db2.gz DTTBYTDDZPZHRO-UTKZUKDTSA-N 2 0 338.495 4.274 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCCC2)C2CC[NH+](CC3CC3)CC2)CC1 ZINC001168364907 1038866902 /nfs/dbraw/zinc/86/69/02/1038866902.db2.gz JSLZNGZKYFHZNV-MEMLXQNLSA-N 3 0 347.591 4.013 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccnn1C1CCC1 ZINC000924686351 1038873692 /nfs/dbraw/zinc/87/36/92/1038873692.db2.gz RIRRRKPVNDTVEF-KSZLIROESA-N 2 0 332.536 4.017 20 0 EIADRP COc1ccc([C@@H]([NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)C2CC2)cc1 ZINC000539215681 1038886076 /nfs/dbraw/zinc/88/60/76/1038886076.db2.gz BZBQSDINQUHZDR-UTKZUKDTSA-N 2 0 330.516 4.104 20 0 EIADRP FC(F)c1ccc(C[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cn1 ZINC000637907372 1038888511 /nfs/dbraw/zinc/88/85/11/1038888511.db2.gz KSSXHSWSSDIAQP-UHFFFAOYSA-N 2 0 337.458 4.107 20 0 EIADRP C[NH+](C)C1CCC([NH+]2CCC3(CC2)OCc2cc(Cl)ccc23)CC1 ZINC001168328186 1038936391 /nfs/dbraw/zinc/93/63/91/1038936391.db2.gz YVWBKGNMCGKFGF-UHFFFAOYSA-N 2 0 348.918 4.034 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[NH2+]CC1)c1ccc2ccccc2c1OC(F)F ZINC000643521716 1038995448 /nfs/dbraw/zinc/99/54/48/1038995448.db2.gz YNOLBEOXENXYPK-ZFWWWQNUSA-N 2 0 334.410 4.234 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000555232556 1038999345 /nfs/dbraw/zinc/99/93/45/1038999345.db2.gz HVPRVHXZAGIKNW-OHCFRWENSA-N 2 0 348.534 4.333 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CCc2c[nH]c3cc(Cl)cc(Cl)c23)CC[N@@H+]1C ZINC000477855748 1039137056 /nfs/dbraw/zinc/13/70/56/1039137056.db2.gz IIFFFLGGDGYIIG-FZMZJTMJSA-N 2 0 340.298 4.090 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CC2(c3cccc(Cl)c3F)CCCC2)CC[N@@H+]1C ZINC000477864120 1039143278 /nfs/dbraw/zinc/14/32/78/1039143278.db2.gz ZUZJOOCGZVMZSM-CABCVRRESA-N 2 0 338.898 4.363 20 0 EIADRP Cc1cc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc(C)c1F ZINC000481290633 1039243922 /nfs/dbraw/zinc/24/39/22/1039243922.db2.gz AGQRORYZLWVGDR-KRWDZBQOSA-N 2 0 344.474 4.234 20 0 EIADRP C[C@H](CCc1ccc(F)cc1F)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000552239979 1039304850 /nfs/dbraw/zinc/30/48/50/1039304850.db2.gz HRVOOLJQKWGXAQ-OAHLLOKOSA-N 2 0 332.438 4.137 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(Br)s1 ZINC000552246159 1039310704 /nfs/dbraw/zinc/31/07/04/1039310704.db2.gz KLHWSDWYARLXOI-VOMCLLRMSA-N 2 0 331.323 4.034 20 0 EIADRP Fc1cccc2c1CC[C@H]2[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000513859351 1039337524 /nfs/dbraw/zinc/33/75/24/1039337524.db2.gz KUEJWUOPDPBUQZ-HXUWFJFHSA-N 2 0 344.499 4.376 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(Br)cc1F ZINC000552296737 1039367896 /nfs/dbraw/zinc/36/78/96/1039367896.db2.gz PMVCYNHNLCLDSR-LMWSTFAQSA-N 2 0 343.284 4.112 20 0 EIADRP Cc1nc(C(C)(C)C)sc1[C@H](C)NC1CC[NH+](C2CCC2)CC1 ZINC000481437277 1039410085 /nfs/dbraw/zinc/41/00/85/1039410085.db2.gz PSCSWKLSIACWAN-ZDUSSCGKSA-N 2 0 335.561 4.417 20 0 EIADRP C[N@@H+]1CC[C@@]2(CC[NH+](C3CCC(c4ccc(Cl)cc4)CC3)C2)C1 ZINC001168348483 1039553110 /nfs/dbraw/zinc/55/31/10/1039553110.db2.gz YYMGVMMQXNYNHE-LYBXBRPPSA-N 2 0 332.919 4.394 20 0 EIADRP Cc1ccc(C)c([C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)c1 ZINC000122306281 1039663628 /nfs/dbraw/zinc/66/36/28/1039663628.db2.gz UELMAHVDWDWIRY-GOSISDBHSA-N 2 0 326.484 4.095 20 0 EIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1 ZINC000481669055 1039704169 /nfs/dbraw/zinc/70/41/69/1039704169.db2.gz KDMHJYXILWLHCI-BMFZPTHFSA-N 2 0 328.422 4.099 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)CCOc2c(Cl)cccc2Cl)[C@H](C)C1 ZINC000429781288 1039732327 /nfs/dbraw/zinc/73/23/27/1039732327.db2.gz SLHKRVDIHLAAPB-CJNGLKHVSA-N 2 0 345.314 4.034 20 0 EIADRP Fc1ccc2c(c1)CC[C@@H]2[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000481717819 1039775359 /nfs/dbraw/zinc/77/53/59/1039775359.db2.gz LLNZWECLGUZBIC-FQEVSTJZSA-N 2 0 344.499 4.376 20 0 EIADRP C[C@@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000414850109 1039777242 /nfs/dbraw/zinc/77/72/42/1039777242.db2.gz YTEOIKWXDPUECS-GOEBONIOSA-N 2 0 328.422 4.006 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)CCN1C ZINC000481740607 1039803695 /nfs/dbraw/zinc/80/36/95/1039803695.db2.gz MUTHHPPYNRGWLB-GQWLDOHISA-N 2 0 344.449 4.321 20 0 EIADRP COc1ccc(F)cc1C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000552813676 1039822777 /nfs/dbraw/zinc/82/27/77/1039822777.db2.gz GVASQCLWUWHDAJ-UHFFFAOYSA-N 2 0 342.458 4.110 20 0 EIADRP CCc1oc2ccccc2c1C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1 ZINC000537649740 1039823831 /nfs/dbraw/zinc/82/38/31/1039823831.db2.gz ZFNJIMPSULKWNR-KRWDZBQOSA-N 2 0 326.484 4.159 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H](C)c2ccccc2N(C)C)cc1 ZINC000537651879 1039845647 /nfs/dbraw/zinc/84/56/47/1039845647.db2.gz NLZBGUXNTMHVGN-GOSISDBHSA-N 2 0 339.527 4.445 20 0 EIADRP CN(c1ccccc1C[NH2+]C1CCC2(CC2)CC1)C1CC[NH+](C)CC1 ZINC000434773495 1039862382 /nfs/dbraw/zinc/86/23/82/1039862382.db2.gz GKUFZJQNBTYMIN-UHFFFAOYSA-N 2 0 341.543 4.029 20 0 EIADRP Cc1ccc(OCCC[NH2+][C@@H]2CCN(C)[C@H](c3ccccc3)C2)cc1 ZINC000551029567 1039886293 /nfs/dbraw/zinc/88/62/93/1039886293.db2.gz KCUJOOBLRJDYPF-IRLDBZIGSA-N 2 0 338.495 4.189 20 0 EIADRP Cc1ccccc1-c1cnc(C[NH+]2CCC(CCC[NH+](C)C)CC2)o1 ZINC000535043491 1039894589 /nfs/dbraw/zinc/89/45/89/1039894589.db2.gz JZKDLWZADTZEEV-UHFFFAOYSA-N 2 0 341.499 4.204 20 0 EIADRP CC(C)c1ccccc1NC(=O)C[C@H](C)[NH2+]CC1([NH3+])CCCCCC1 ZINC000414857184 1039896616 /nfs/dbraw/zinc/89/66/16/1039896616.db2.gz BSZWFETYWWLFRL-KRWDZBQOSA-N 2 0 345.531 4.168 20 0 EIADRP Cc1cc2[nH]c(C[NH+]3CCC(C[NH+]4CCCC4)CC3)cc2c(C)c1 ZINC000481907940 1039897747 /nfs/dbraw/zinc/89/77/47/1039897747.db2.gz JPBYYOZZEIURJZ-UHFFFAOYSA-N 2 0 325.500 4.093 20 0 EIADRP COc1ccc2cc(C[NH+]3CCC(C[N@H+](C)C(C)C)CC3)ccc2c1 ZINC000535081761 1039920897 /nfs/dbraw/zinc/92/08/97/1039920897.db2.gz HVMAHGDSOHUCPS-UHFFFAOYSA-N 2 0 340.511 4.401 20 0 EIADRP Clc1ccccc1C[C@H]([NH2+]C1CC([NH+]2CCCCC2)C1)C1CC1 ZINC000551174427 1040019508 /nfs/dbraw/zinc/01/95/08/1040019508.db2.gz BTOVAGTTWKFRGX-QLOJAFMTSA-N 2 0 332.919 4.268 20 0 EIADRP CC(C)=CCC[C@@H](C)CC[NH+]1CCC(N2CC[NH+](C(C)C)CC2)CC1 ZINC000482173139 1040059246 /nfs/dbraw/zinc/05/92/46/1040059246.db2.gz XDBIYQXUOKKVAZ-OAQYLSRUSA-N 2 0 349.607 4.249 20 0 EIADRP Clc1cccc(Cl)c1CCC[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000482242600 1040096808 /nfs/dbraw/zinc/09/68/08/1040096808.db2.gz UEZDIMZSLIVIRF-UONOGXRCSA-N 2 0 327.299 4.142 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1cccc(Br)c1 ZINC000551264743 1040124413 /nfs/dbraw/zinc/12/44/13/1040124413.db2.gz MZOJFDPXMPFWNM-OAHLLOKOSA-N 2 0 339.321 4.366 20 0 EIADRP C[NH+]1CCC(CC[NH2+][C@H]2CCc3c2ccc(Cl)c3Cl)CC1 ZINC000482347304 1040192777 /nfs/dbraw/zinc/19/27/77/1040192777.db2.gz CUPYIMDZGQPITP-INIZCTEOSA-N 2 0 327.299 4.302 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@@H](C)c2cc(C)ccc2OC(F)F)CC1 ZINC000482501618 1040302361 /nfs/dbraw/zinc/30/23/61/1040302361.db2.gz CBJVTLWUDRHNSX-HNNXBMFYSA-N 2 0 340.458 4.369 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC3(CCCC3)O2)CCN1Cc1ccccc1 ZINC000379655501 1040318130 /nfs/dbraw/zinc/31/81/30/1040318130.db2.gz MBXNYHLZRZDSLD-NRSPTQNISA-N 2 0 342.527 4.121 20 0 EIADRP c1ccc(C[C@H]([NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)C2CC2)cc1 ZINC000479462200 1040371658 /nfs/dbraw/zinc/37/16/58/1040371658.db2.gz FPIKYDSQQWXYQU-GGAORHGYSA-N 2 0 334.507 4.119 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cncn2C(C)C)CC1)CC(C)C ZINC000425378865 1040381469 /nfs/dbraw/zinc/38/14/69/1040381469.db2.gz KHHLGSDGPVCLLN-UHFFFAOYSA-N 2 0 334.552 4.044 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cccc(Br)c2C)C[C@@H]1C ZINC000535585289 1040386072 /nfs/dbraw/zinc/38/60/72/1040386072.db2.gz LMYGJAYGHLZJDU-BBRMVZONSA-N 2 0 339.321 4.062 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@H]2[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000666995160 1040408640 /nfs/dbraw/zinc/40/86/40/1040408640.db2.gz FABOVAMCWQDFGN-HLAWJBBLSA-N 2 0 342.527 4.374 20 0 EIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H]3CCC[C@H](C4CC4)C3)cc2)CC1 ZINC000551573446 1040424207 /nfs/dbraw/zinc/42/42/07/1040424207.db2.gz RNQMNTMCBUGNSN-PMACEKPBSA-N 2 0 342.527 4.218 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cc2cc(Cl)ccc2o1 ZINC000539494270 1040469269 /nfs/dbraw/zinc/46/92/69/1040469269.db2.gz CQNZUUJZBKPNPX-BBRMVZONSA-N 2 0 338.879 4.094 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2nc(-c3ccccc3)oc2C)CC1 ZINC000515137326 1040511833 /nfs/dbraw/zinc/51/18/33/1040511833.db2.gz CLKXZSQPQFXTMI-UHFFFAOYSA-N 2 0 341.499 4.204 20 0 EIADRP COc1ncc([C@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cc1Cl ZINC000551788737 1040601200 /nfs/dbraw/zinc/60/12/00/1040601200.db2.gz JWHKVGIYIAFTGU-HNNXBMFYSA-N 2 0 339.911 4.050 20 0 EIADRP Cc1ccccc1[C@H](CC(C)C)[NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1 ZINC000483199009 1040757664 /nfs/dbraw/zinc/75/76/64/1040757664.db2.gz NGWMSJMHMOTFDK-UGKGYDQZSA-N 2 0 344.543 4.173 20 0 EIADRP Cc1ccc(C[C@@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)s1 ZINC000483312906 1040816653 /nfs/dbraw/zinc/81/66/53/1040816653.db2.gz WMHFHLAZUJDAEE-WBVHZDCISA-N 2 0 346.540 4.279 20 0 EIADRP C[N@H+](Cc1ccnn1-c1cc[nH+]cc1)[C@@H]1CCC[C@H]1c1ccccc1 ZINC000668235277 1040819786 /nfs/dbraw/zinc/81/97/86/1040819786.db2.gz HRDSXDUIDXKPBP-LEWJYISDSA-N 2 0 332.451 4.035 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2ccc(F)cc2C(F)(F)F)[C@H](C)C1 ZINC000539834799 1040828651 /nfs/dbraw/zinc/82/86/51/1040828651.db2.gz FZURXILMAVCPNV-WBMJQRKESA-N 2 0 332.385 4.007 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2nc3ccccc3o2)CC1)CC1CC1 ZINC000537847821 1040853185 /nfs/dbraw/zinc/85/31/85/1040853185.db2.gz VHDMLBLNWILBAY-UHFFFAOYSA-N 2 0 341.499 4.162 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](CCCOc3ccc4ccccc4c3)CC[C@@H]21 ZINC000483479440 1040872431 /nfs/dbraw/zinc/87/24/31/1040872431.db2.gz DWSGJCBCXCTQIF-UNMCSNQZSA-N 2 0 338.495 4.025 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](CCCSc3ccccc3Cl)CC[C@H]21 ZINC000483504616 1040876437 /nfs/dbraw/zinc/87/64/37/1040876437.db2.gz RVVJURMMKKTPKA-NVXWUHKLSA-N 2 0 338.948 4.238 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](CCCSc3ccccc3Cl)CC[C@@H]21 ZINC000483504618 1040877132 /nfs/dbraw/zinc/87/71/32/1040877132.db2.gz RVVJURMMKKTPKA-RDJZCZTQSA-N 2 0 338.948 4.238 20 0 EIADRP c1ccc(C[N@H+]2CCC[C@@H](CN[C@H](c3ccccn3)C3CC3)C2)cc1 ZINC000903083769 1040896152 /nfs/dbraw/zinc/89/61/52/1040896152.db2.gz NDVOZGDKPUNBCY-UGKGYDQZSA-N 2 0 335.495 4.035 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]CCc1ccc(Oc2ccc(F)cc2)cc1 ZINC000537938877 1040900954 /nfs/dbraw/zinc/90/09/54/1040900954.db2.gz UUEVICWWFTXIIJ-IERDGZPVSA-N 2 0 342.458 4.090 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1cscn1 ZINC000537944567 1040912427 /nfs/dbraw/zinc/91/24/27/1040912427.db2.gz GHSOJDIGEDRANI-XYJFISCASA-N 2 0 329.513 4.094 20 0 EIADRP Cc1cccc2c1CC[C@H]2[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000537981114 1040953448 /nfs/dbraw/zinc/95/34/48/1040953448.db2.gz XVCHPLRVYUZQGC-VGOFRKELSA-N 2 0 338.495 4.274 20 0 EIADRP Cc1cccc2c1CC[C@@H]2[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000537981115 1040955022 /nfs/dbraw/zinc/95/50/22/1040955022.db2.gz XVCHPLRVYUZQGC-VGSWGCGISA-N 2 0 338.495 4.274 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(COc3ccccc3)cc2)[C@H](C)C1 ZINC000537989796 1040963593 /nfs/dbraw/zinc/96/35/93/1040963593.db2.gz FCLMZIYQTIDAFK-GCJKJVERSA-N 2 0 338.495 4.086 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@H](C)N(C)C1CC1 ZINC000462805138 1040971505 /nfs/dbraw/zinc/97/15/05/1040971505.db2.gz MJTAMGJJFYDZKO-HOTGVXAUSA-N 2 0 327.516 4.296 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](C)Cc1cccs1)c1ccc(OCC[NH+](C)C)cc1 ZINC000483741944 1040994335 /nfs/dbraw/zinc/99/43/35/1040994335.db2.gz INCJWKKDWFFFIJ-DLBZAZTESA-N 2 0 346.540 4.218 20 0 EIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccc(OC(F)F)c1 ZINC000515710542 1040996390 /nfs/dbraw/zinc/99/63/90/1040996390.db2.gz RBTNMGAEWYVYEO-UHFFFAOYSA-N 2 0 348.437 4.372 20 0 EIADRP c1ccc(-c2nc3c(s2)[C@@H]([NH2+]CCC[NH+]2CCCC2)CCC3)cc1 ZINC000480144984 1041000522 /nfs/dbraw/zinc/00/05/22/1041000522.db2.gz GHLIIVXDAOFFPR-KRWDZBQOSA-N 2 0 341.524 4.263 20 0 EIADRP C[C@H]([NH2+]CCCN1CC[NH+](C)CC1)c1ccc(C2CCCCC2)cc1 ZINC000480149116 1041005646 /nfs/dbraw/zinc/00/56/46/1041005646.db2.gz NHUINXGZCVWSOX-IBGZPJMESA-N 2 0 343.559 4.022 20 0 EIADRP C([NH2+]C1CCC2(CCOCC2)CC1)[C@H]1CCC[N@@H+]1C1CCCCC1 ZINC000436296301 1041063250 /nfs/dbraw/zinc/06/32/50/1041063250.db2.gz RDYPIIUIANJKJW-HXUWFJFHSA-N 2 0 334.548 4.113 20 0 EIADRP COCCC1(C[NH2+]CC2CC[NH+](CCC(C)C)CC2)CCCCC1 ZINC000436306497 1041075433 /nfs/dbraw/zinc/07/54/33/1041075433.db2.gz OTQFIRPCVVSPHM-UHFFFAOYSA-N 2 0 338.580 4.321 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000436306041 1041077942 /nfs/dbraw/zinc/07/79/42/1041077942.db2.gz NTILICQRBKONJP-AQDKSWOWSA-N 2 0 340.433 4.270 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CC1(c2ccccc2)CC1 ZINC000480208932 1041081552 /nfs/dbraw/zinc/08/15/52/1041081552.db2.gz LDRZBTVZHNGRJS-UGKGYDQZSA-N 2 0 334.507 4.218 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCC2CC2)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000480273621 1041148734 /nfs/dbraw/zinc/14/87/34/1041148734.db2.gz IVBDNFBHXZIEMG-PXNSSMCTSA-N 2 0 342.527 4.218 20 0 EIADRP C[C@H](CCc1ccco1)[NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000540141006 1041160194 /nfs/dbraw/zinc/16/01/94/1041160194.db2.gz VIKRDUYHGRUDGB-SVFBPWRDSA-N 2 0 340.511 4.491 20 0 EIADRP C[C@H]1C[N@H+](C)CC[C@H]1[NH2+]Cc1ccc(Sc2ccccc2)cc1 ZINC000540148276 1041195762 /nfs/dbraw/zinc/19/57/62/1041195762.db2.gz YKEWNEZPRJDYCY-OXJNMPFZSA-N 2 0 326.509 4.268 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)cc1F ZINC000436411716 1041213187 /nfs/dbraw/zinc/21/31/87/1041213187.db2.gz FIWKADIWFHAIAG-AZUAARDMSA-N 2 0 326.459 4.313 20 0 EIADRP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CCOC)c1cccc(Cl)c1 ZINC000924659568 1041232667 /nfs/dbraw/zinc/23/26/67/1041232667.db2.gz LVJGWEJFAJWALK-XVLXNVKGSA-N 2 0 336.907 4.023 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1cccc(O)c1 ZINC000194851775 1041233120 /nfs/dbraw/zinc/23/31/20/1041233120.db2.gz LVOKZCABJBJRTG-SFHVURJKSA-N 2 0 338.495 4.475 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)cc1OCC ZINC000484469880 1041246338 /nfs/dbraw/zinc/24/63/38/1041246338.db2.gz FPPONKIHJMIQTJ-JQHSSLGASA-N 2 0 334.504 4.007 20 0 EIADRP C[C@H]1CC([NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)C[C@H](C)C1 ZINC000538297609 1041249476 /nfs/dbraw/zinc/24/94/76/1041249476.db2.gz WWTGKOCALYLKSG-HLIPFELVSA-N 2 0 342.527 4.389 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+]C2CCN(CCc3ccc(F)cc3)CC2)cc1 ZINC000463084691 1041334515 /nfs/dbraw/zinc/33/45/15/1041334515.db2.gz JWXQZLBUXGSBBT-GOSISDBHSA-N 2 0 340.486 4.492 20 0 EIADRP C[N@@H+]1CCC[C@H](C[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)C1 ZINC000540301590 1041351698 /nfs/dbraw/zinc/35/16/98/1041351698.db2.gz LQUYJOUCDUESDK-PXAZEXFGSA-N 2 0 327.299 4.376 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)CC1 ZINC000540300738 1041351995 /nfs/dbraw/zinc/35/19/95/1041351995.db2.gz DJGITIQOFVTPBD-LJQANCHMSA-N 2 0 338.923 4.128 20 0 EIADRP C[C@@H](Nc1ccc(N2CC[C@H]([NH+](C)C)C2)cn1)c1ccc(Cl)cc1 ZINC000538557761 1041421052 /nfs/dbraw/zinc/42/10/52/1041421052.db2.gz LWMGAINMYIUUOW-KDOFPFPSSA-N 2 0 344.890 4.048 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH+]2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)cc1 ZINC000667706286 1041422618 /nfs/dbraw/zinc/42/26/18/1041422618.db2.gz WBQTYGYDSJMMNF-RTBURBONSA-N 2 0 341.524 4.035 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1ccc(F)cc1N(C)C ZINC000480638492 1041450971 /nfs/dbraw/zinc/45/09/71/1041450971.db2.gz IXZQRFUQUVQIIR-DLBZAZTESA-N 2 0 335.511 4.197 20 0 EIADRP Cc1sc([C@H](C)[NH2+]C2CC(C[NH3+])C2)nc1-c1ccc(Cl)cc1 ZINC000904363815 1041459152 /nfs/dbraw/zinc/45/91/52/1041459152.db2.gz NPSPENZESJVVHA-VLRKGOCCSA-N 2 0 335.904 4.160 20 0 EIADRP Fc1cc(C[NH2+][C@@H]2CCCCC23CC[NH2+]CC3)ccc1C(F)F ZINC000904385112 1041465802 /nfs/dbraw/zinc/46/58/02/1041465802.db2.gz SMWZAUQEVSORNN-MRXNPFEDSA-N 2 0 326.406 4.165 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[NH+]1C[C@H](C)C[C@@H](C)C1)[C@H]1CCOC1 ZINC000480703452 1041479771 /nfs/dbraw/zinc/47/97/71/1041479771.db2.gz YPRHDNPTZCZWAM-UBBRYJJRSA-N 2 0 344.543 4.069 20 0 EIADRP C[C@@H]([NH2+]C1(Cc2ccccc2)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000480695742 1041482939 /nfs/dbraw/zinc/48/29/39/1041482939.db2.gz TXVOWWNAOCCFSG-GOSISDBHSA-N 2 0 338.495 4.053 20 0 EIADRP C[C@H]([NH2+]C1(Cc2ccccc2)CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000480695743 1041483275 /nfs/dbraw/zinc/48/32/75/1041483275.db2.gz TXVOWWNAOCCFSG-SFHVURJKSA-N 2 0 338.495 4.053 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCCC2CCOCC2)CC1 ZINC000463289867 1041490310 /nfs/dbraw/zinc/49/03/10/1041490310.db2.gz QJOXBEJMVBDZBX-UHFFFAOYSA-N 2 0 344.543 4.037 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000540607270 1041559705 /nfs/dbraw/zinc/55/97/05/1041559705.db2.gz MCPBMULMMGNOMV-CRAIPNDOSA-N 2 0 339.310 4.481 20 0 EIADRP C[N@H+]1CC=C(C[NH2+]Cc2ccc(-c3ccccc3Cl)s2)CC1 ZINC000540645022 1041585321 /nfs/dbraw/zinc/58/53/21/1041585321.db2.gz YEDVYXMOPUDKNJ-UHFFFAOYSA-N 2 0 332.900 4.420 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1Nc1ccc(C[NH+]2CCCC[C@H]2C)cc1 ZINC000540699942 1041614922 /nfs/dbraw/zinc/61/49/22/1041614922.db2.gz RRMSCPHOFKVVRT-NEYJZJCJSA-N 2 0 329.532 4.202 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000539040595 1041616818 /nfs/dbraw/zinc/61/68/18/1041616818.db2.gz DNZHJXOMVWBMAS-ZIFCJYIRSA-N 2 0 341.474 4.172 20 0 EIADRP C[C@@H](CCc1cccc(C(F)(F)F)c1)[NH2+]C[C@]1(C)CCC[NH2+]C1 ZINC000414900479 1041738432 /nfs/dbraw/zinc/73/84/32/1041738432.db2.gz DSKJKEABPHYFNM-WMLDXEAASA-N 2 0 328.422 4.006 20 0 EIADRP C[C@@H]([NH2+]CCc1ccc(F)cc1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000516802131 1041763779 /nfs/dbraw/zinc/76/37/79/1041763779.db2.gz LSPNPISOOLLEDR-VQIMIIECSA-N 2 0 344.449 4.008 20 0 EIADRP CSC1(C[NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CCC1 ZINC000516822416 1041774130 /nfs/dbraw/zinc/77/41/30/1041774130.db2.gz RHMOIXYPNLBTRD-IEBWSBKVSA-N 2 0 332.557 4.162 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 ZINC000414909762 1041855031 /nfs/dbraw/zinc/85/50/31/1041855031.db2.gz CKIUBBMSXKSADX-OLZOCXBDSA-N 2 0 340.311 4.084 20 0 EIADRP C[C@@H](Cc1ccsc1)[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000541234370 1041859853 /nfs/dbraw/zinc/85/98/53/1041859853.db2.gz DXGODMGBKMCXES-FXAWDEMLSA-N 2 0 328.525 4.133 20 0 EIADRP Cc1ccsc1CC[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508722733 1041918310 /nfs/dbraw/zinc/91/83/10/1041918310.db2.gz UGQANSABYXSSDN-IEBWSBKVSA-N 2 0 328.525 4.099 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CCn1c2ccccc2c2ccccc21 ZINC000541571139 1042019423 /nfs/dbraw/zinc/01/94/23/1042019423.db2.gz OSXMEAVDWABZPZ-UWVAXJGDSA-N 2 0 335.495 4.113 20 0 EIADRP Fc1ccc2c(c1)CC[C@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)C2 ZINC001168438777 1042062040 /nfs/dbraw/zinc/06/20/40/1042062040.db2.gz ODZJDEQHKCYARD-RTWAWAEBSA-N 2 0 330.491 4.023 20 0 EIADRP C[C@]1(c2ccccc2)CC[C@H]([N@@H+]2CC[C@@H]3[C@H](CCCN3C3CC3)C2)C1 ZINC000438119937 1042062323 /nfs/dbraw/zinc/06/23/23/1042062323.db2.gz LAFTUKSKZIACIF-MSYGRNIXSA-N 2 0 338.539 4.446 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C[C@H](C)C[NH+](C)C ZINC000425951439 1042067554 /nfs/dbraw/zinc/06/75/54/1042067554.db2.gz MQKMNCBRCRUQQP-LSDHHAIUSA-N 2 0 331.529 4.275 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC[NH2+]1 ZINC000414948182 1042336130 /nfs/dbraw/zinc/33/61/30/1042336130.db2.gz LSSXKIUVIMZOES-BASLNEPJSA-N 2 0 326.406 4.072 20 0 EIADRP C[N@@H+](Cc1cc(Cl)cs1)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000426158729 1042351023 /nfs/dbraw/zinc/35/10/23/1042351023.db2.gz DYNGCNNMHSEZCE-UHFFFAOYSA-N 2 0 335.904 4.145 20 0 EIADRP c1ccc2c(c1)C=C(C[NH2+]Cc1ccccc1C[NH+]1CCCCC1)CO2 ZINC000518272190 1042446082 /nfs/dbraw/zinc/44/60/82/1042446082.db2.gz VJJHBYWWDYYMBB-UHFFFAOYSA-N 2 0 348.490 4.238 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1CCc2cc(F)ccc2C1 ZINC001168442474 1042505873 /nfs/dbraw/zinc/50/58/73/1042505873.db2.gz VMGFSJAHRAAOKM-PCCBWWKXSA-N 2 0 330.491 4.022 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1CCc2cc(F)ccc2C1 ZINC001168442469 1042506315 /nfs/dbraw/zinc/50/63/15/1042506315.db2.gz VMGFSJAHRAAOKM-ACRUOGEOSA-N 2 0 330.491 4.022 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(OC(C)C)c(Cl)c2)[C@H](C)C1 ZINC000492335646 1042611236 /nfs/dbraw/zinc/61/12/36/1042611236.db2.gz SQMUEZOROOSWCW-QAPCUYQASA-N 2 0 338.923 4.289 20 0 EIADRP C[C@H]([NH2+]CCOC1CCCCCC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492398270 1042634749 /nfs/dbraw/zinc/63/47/49/1042634749.db2.gz GVDWKSMOSKSGOY-FPOVZHCZSA-N 2 0 344.543 4.226 20 0 EIADRP C[C@H]([NH2+]CCO[C@H]1CCCC[C@H]1C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492427284 1042649518 /nfs/dbraw/zinc/64/95/18/1042649518.db2.gz YRWKSXRUOHNWSJ-WAGURGNTSA-N 2 0 344.543 4.082 20 0 EIADRP Cc1cc(F)cc(C[NH+]2CCC3(CC[N@H+](Cc4ccoc4)C3)CC2)c1 ZINC001143585813 1042852387 /nfs/dbraw/zinc/85/23/87/1042852387.db2.gz HFIPGPRILCCFFD-UHFFFAOYSA-N 2 0 342.458 4.215 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)[C@H](C)C2 ZINC000493235790 1042853765 /nfs/dbraw/zinc/85/37/65/1042853765.db2.gz YTENCBLNNYGOJV-VGOFRKELSA-N 2 0 335.495 4.130 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+]CC1CCN(c3cc[nH+]cc3)CC1)[C@@H](C)C2 ZINC000493235788 1042854036 /nfs/dbraw/zinc/85/40/36/1042854036.db2.gz YTENCBLNNYGOJV-HTAPYJJXSA-N 2 0 335.495 4.130 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)c2ccsc2)cc1 ZINC000178131771 1042859643 /nfs/dbraw/zinc/85/96/43/1042859643.db2.gz ITZUSZOSQJJGBX-MRXNPFEDSA-N 2 0 332.513 4.320 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](CCCCCOc2ccccc2)CC1 ZINC000525864918 1042946016 /nfs/dbraw/zinc/94/60/16/1042946016.db2.gz APADBXRPIBFKQP-UHFFFAOYSA-N 2 0 332.532 4.288 20 0 EIADRP Cc1nc2ccc(C[NH2+]Cc3ccc(C[NH+](C)C)c(F)c3)cc2s1 ZINC000494192606 1043031149 /nfs/dbraw/zinc/03/11/49/1043031149.db2.gz RZCGHOFMHXNFAW-UHFFFAOYSA-N 2 0 343.471 4.095 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)ccc1F ZINC000183191816 1043040139 /nfs/dbraw/zinc/04/01/39/1043040139.db2.gz YGYSTDJZWHMUBS-ZMSDIMECSA-N 2 0 334.479 4.138 20 0 EIADRP C[C@@H]([NH2+]Cc1ccnc2ccccc12)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000388842127 1043061594 /nfs/dbraw/zinc/06/15/94/1043061594.db2.gz YFOLSSDRRPBLHW-WIYYLYMNSA-N 2 0 345.490 4.235 20 0 EIADRP CC1CC[NH+](CCCC[NH2+][C@H](c2ccco2)c2ccccc2)CC1 ZINC000542477206 1043118321 /nfs/dbraw/zinc/11/83/21/1043118321.db2.gz WFYBSAVMJAAHGB-NRFANRHFSA-N 2 0 326.484 4.471 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc(-c2cccs2)cc1 ZINC000665238151 1043139793 /nfs/dbraw/zinc/13/97/93/1043139793.db2.gz RPFIMRRVYFZMQD-CQSZACIVSA-N 2 0 337.492 4.428 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000164758688 1043151942 /nfs/dbraw/zinc/15/19/42/1043151942.db2.gz WDCHESDSWJVRHH-GJZGRUSLSA-N 2 0 343.540 4.499 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@@H](C)C1CC[NH+](C)CC1 ZINC000164758572 1043152446 /nfs/dbraw/zinc/15/24/46/1043152446.db2.gz WDCHESDSWJVRHH-LSDHHAIUSA-N 2 0 343.540 4.499 20 0 EIADRP CC[NH+](CC)CCOC1CC[NH+]([C@H](C)c2ccc(Cl)cc2)CC1 ZINC000347851109 1043214862 /nfs/dbraw/zinc/21/48/62/1043214862.db2.gz LOJSNAJSQLJNCZ-MRXNPFEDSA-N 2 0 338.923 4.224 20 0 EIADRP Cc1ccc2c(c1)CC[C@H]2[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000727468173 1043225929 /nfs/dbraw/zinc/22/59/29/1043225929.db2.gz GFTPCDLQTXKCCT-JOCHJYFZSA-N 2 0 338.495 4.103 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CC2(c3ccc(F)cc3Cl)CCCC2)CC[N@@H+]1C ZINC000427882715 1043247234 /nfs/dbraw/zinc/24/72/34/1043247234.db2.gz ANQQNIRAJHNZNV-GDBMZVCRSA-N 2 0 338.898 4.363 20 0 EIADRP Brc1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[N@@H+]3CCC[C@H]3C1)CCC2 ZINC000356682446 1043253594 /nfs/dbraw/zinc/25/35/94/1043253594.db2.gz SDWNQWRLVNSSAD-SOLBZPMBSA-N 2 0 349.316 4.043 20 0 EIADRP CC(C)Oc1ccc(CC[C@@H](C)[NH2+][C@H](C)C2CC[NH+](C)CC2)cc1 ZINC000166012447 1043268124 /nfs/dbraw/zinc/26/81/24/1043268124.db2.gz RKZXZLUUSNSDPO-QZTJIDSGSA-N 2 0 332.532 4.115 20 0 EIADRP CC(C)[NH+]1CCC([N@H+](C)CCCc2ccc(C(F)(F)F)cc2)CC1 ZINC000674005842 1043270868 /nfs/dbraw/zinc/27/08/68/1043270868.db2.gz NXNIZRRXKDTREH-UHFFFAOYSA-N 2 0 342.449 4.443 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)c2ccnn2-c2ccccc2)c1 ZINC000281344588 1043276007 /nfs/dbraw/zinc/27/60/07/1043276007.db2.gz UXWNVOMZYGNKGA-SFHVURJKSA-N 2 0 348.494 4.175 20 0 EIADRP CCC(CC)(CN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)[NH2+][C@@H](C)c1ccccc1 ZINC000166661969 1043308105 /nfs/dbraw/zinc/30/81/05/1043308105.db2.gz WRZUJMMFRNHBCC-CEWLAPEOSA-N 2 0 343.559 4.112 20 0 EIADRP C[C@H](CC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cccc(C(F)(F)F)c1 ZINC000166754984 1043310868 /nfs/dbraw/zinc/31/08/68/1043310868.db2.gz DOSNPMUHLBNOBR-ZTFGCOKTSA-N 2 0 340.433 4.415 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)C1CCSCC1 ZINC000187060794 1043324914 /nfs/dbraw/zinc/32/49/14/1043324914.db2.gz UCFYSBFCANCMMK-QGZVFWFLSA-N 2 0 332.557 4.020 20 0 EIADRP CCCc1csc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)n1 ZINC000494305903 1043414891 /nfs/dbraw/zinc/41/48/91/1043414891.db2.gz BFCYFCUXDSVINH-UHFFFAOYSA-N 2 0 343.540 4.097 20 0 EIADRP CC[NH+](CC)CCCC[NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1 ZINC001168012057 1043421345 /nfs/dbraw/zinc/42/13/45/1043421345.db2.gz VIRBCXOXTHATHH-VTYHHJSWSA-N 3 0 345.575 4.140 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1cc(Br)cs1 ZINC000494522381 1043547569 /nfs/dbraw/zinc/54/75/69/1043547569.db2.gz HNFRMTMUYIVMDP-LLVKDONJSA-N 2 0 343.334 4.036 20 0 EIADRP C[C@H](CC[NH2+][C@@H]1CCCC[C@H]1[C@H]1CCOC1)[N@H+](C)Cc1ccccc1 ZINC000474035179 1043697481 /nfs/dbraw/zinc/69/74/81/1043697481.db2.gz OWLPQOXPLDYQJO-RYFAJOAYSA-N 2 0 344.543 4.082 20 0 EIADRP c1ccc([C@H](CC2CC2)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658067767 1043733235 /nfs/dbraw/zinc/73/32/35/1043733235.db2.gz QGWCYRVYHFCAFN-QFIPXVFZSA-N 2 0 342.527 4.008 20 0 EIADRP Cc1c([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)cnn1C(C)(C)C ZINC000191178400 1043788962 /nfs/dbraw/zinc/78/89/62/1043788962.db2.gz XVXXDQCIOXZNSA-DLBZAZTESA-N 2 0 334.552 4.109 20 0 EIADRP CC(C)(C[NH2+][C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000191550240 1043826300 /nfs/dbraw/zinc/82/63/00/1043826300.db2.gz VFIVEOUOCMHTAC-DLBZAZTESA-N 2 0 340.433 4.199 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC000443012399 1043965496 /nfs/dbraw/zinc/96/54/96/1043965496.db2.gz SFAMASHQKLKHSP-ALOPSCKCSA-N 2 0 326.406 4.119 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2cnc(-c3ccco3)s2)C1 ZINC000193007318 1043990777 /nfs/dbraw/zinc/99/07/77/1043990777.db2.gz JQPAICRKGJTQBL-IYBDPMFKSA-N 2 0 347.528 4.251 20 0 EIADRP [NH3+]C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000521860131 1044032107 /nfs/dbraw/zinc/03/21/07/1044032107.db2.gz VZQXXDFNQNMWMH-XJKCOSOUSA-N 2 0 345.487 4.044 20 0 EIADRP C[C@@]1(CC[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1(F)F ZINC000658223141 1044073450 /nfs/dbraw/zinc/07/34/50/1044073450.db2.gz SPHGYKJKOYLGLR-FCGDIQPGSA-N 2 0 334.454 4.207 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H]3CCC34CCCC4)CC2)cc1 ZINC000474051111 1044308714 /nfs/dbraw/zinc/30/87/14/1044308714.db2.gz JHBXSXRVKSXOHM-NRFANRHFSA-N 2 0 342.527 4.220 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OC2CCCCC2)cc1)C1CC[NH+](C)CC1 ZINC000675796516 1044493571 /nfs/dbraw/zinc/49/35/71/1044493571.db2.gz CPHMLYPWVNQWMQ-QGZVFWFLSA-N 2 0 330.516 4.218 20 0 EIADRP CC(C)(C[NH2+][C@H](C[C@H]1CCOC1)c1ccc(F)cc1)C[NH+]1CCCC1 ZINC000494937812 1044535490 /nfs/dbraw/zinc/53/54/90/1044535490.db2.gz GBNQSQVRKSUPFS-YLJYHZDGSA-N 2 0 348.506 4.005 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](C/C=C/c2ccncc2)CC1 ZINC000494984910 1044569239 /nfs/dbraw/zinc/56/92/39/1044569239.db2.gz HQEDPDXVFVUXNP-OQBYNLHGSA-N 2 0 327.516 4.071 20 0 EIADRP CS[C@H](C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)C(C)(C)C ZINC000543426729 1044577972 /nfs/dbraw/zinc/57/79/72/1044577972.db2.gz JIEFLLTXSNFHKC-MAUKXSAKSA-N 2 0 338.561 4.055 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCOC2CCCCC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168024250 1044605953 /nfs/dbraw/zinc/60/59/53/1044605953.db2.gz CVCIEVNMCLJBMT-CEQLMSFQSA-N 2 0 344.543 4.367 20 0 EIADRP CC1CC[NH+](CCCC[NH2+][C@@H]2CCSc3c(F)cccc32)CC1 ZINC000359949929 1044652061 /nfs/dbraw/zinc/65/20/61/1044652061.db2.gz MXRYOWHRCNMCAK-GOSISDBHSA-N 2 0 336.520 4.464 20 0 EIADRP C[C@@H]1CC(n2cc3ccc(C[NH3+])cc3n2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168025349 1044656917 /nfs/dbraw/zinc/65/69/17/1044656917.db2.gz JRGZGOTUOXNCJY-IAGOWNOFSA-N 2 0 348.494 4.109 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCCC(F)(F)F)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168026917 1044722470 /nfs/dbraw/zinc/72/24/70/1044722470.db2.gz MFIUOLWXAVQICU-SCAQPMJSSA-N 2 0 328.422 4.360 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)C1)c1ccc(N)cc1 ZINC001168028540 1044747742 /nfs/dbraw/zinc/74/77/42/1044747742.db2.gz PGIKSLUUXRPRBE-SUWCGCSTSA-N 2 0 337.511 4.361 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1)[C@@H]1CCCO1 ZINC000544362329 1044822664 /nfs/dbraw/zinc/82/26/64/1044822664.db2.gz CSIPBKRVDJOBMW-JTSKRJEESA-N 2 0 338.495 4.072 20 0 EIADRP Cc1ccc(CCC[NH+]2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)cn1 ZINC000474278099 1044836761 /nfs/dbraw/zinc/83/67/61/1044836761.db2.gz OAHJTUGDBCSJKP-HXUWFJFHSA-N 2 0 343.559 4.299 20 0 EIADRP C[C@H]1CC([NH2+]C2(Cc3cccnc3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168031901 1044840786 /nfs/dbraw/zinc/84/07/86/1044840786.db2.gz DATRXQWHVYHMOA-OALUTQOASA-N 2 0 349.522 4.188 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CCN(C2CC2)[C@@H](c2ccccc2)C1)[C@@H]1CCCOC1 ZINC000895663396 1044842057 /nfs/dbraw/zinc/84/20/57/1044842057.db2.gz KPSUGSYYLBWXJN-KRXUUXHPSA-N 2 0 342.527 4.149 20 0 EIADRP COC1(C[C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCC2)CCC1 ZINC000429372604 1045036572 /nfs/dbraw/zinc/03/65/72/1045036572.db2.gz NNFWGZAYNDMVDO-GOSISDBHSA-N 2 0 330.516 4.110 20 0 EIADRP c1ccc([C@@H]2C[C@@H](N[C@@H]3CC[N@@H+]4CCC[C@H]4C3)c3ccccc3O2)cc1 ZINC000922887095 1045084014 /nfs/dbraw/zinc/08/40/14/1045084014.db2.gz YXDDQWCLAJJRSN-XZYOPWHXSA-N 2 0 348.490 4.468 20 0 EIADRP Cc1nc([C@H](C)[N@@H+]2CC[C@@H](C[NH3+])[C@@H](C)C2)oc1-c1ccc(Cl)cc1 ZINC000923494884 1045134889 /nfs/dbraw/zinc/13/48/89/1045134889.db2.gz PYRMSXMOXSPFOQ-NOLJZWGESA-N 2 0 347.890 4.281 20 0 EIADRP FC(F)(F)CC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc2c(c1)C[NH2+]CC2 ZINC000923525373 1045147597 /nfs/dbraw/zinc/14/75/97/1045147597.db2.gz GHXYLKOVVKKQAW-DODVFSASSA-N 2 0 338.417 4.028 20 0 EIADRP c1nc(C2CC2)c(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)s1 ZINC000486952179 1045221114 /nfs/dbraw/zinc/22/11/14/1045221114.db2.gz BBNJZSUOUNAJLP-UHFFFAOYSA-N 2 0 341.524 4.296 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3scnc3C3CC3)CC2)CC1 ZINC000487572055 1045229008 /nfs/dbraw/zinc/22/90/08/1045229008.db2.gz KCAVOHYPZHGWNA-UHFFFAOYSA-N 2 0 333.545 4.153 20 0 EIADRP CCCCCC/C(=C\c1ccccc1)C[NH2+]CC1(O)CC[NH+](C)CC1 ZINC000740899157 1045241127 /nfs/dbraw/zinc/24/11/27/1045241127.db2.gz USBUVZILBKEFPG-HEHNFIMWSA-N 2 0 344.543 4.087 20 0 EIADRP CCCCCCOc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1 ZINC000915681643 1045447270 /nfs/dbraw/zinc/44/72/70/1045447270.db2.gz FMOHFPITTWQQBT-UXHICEINSA-N 2 0 330.516 4.362 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1cc(Cl)c(N)c(Cl)c1 ZINC000790751758 1045569076 /nfs/dbraw/zinc/56/90/76/1045569076.db2.gz XDGWLPWJEDJCHQ-GFCCVEGCSA-N 2 0 344.330 4.348 20 0 EIADRP COc1cc([C@@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)ccc1F ZINC000768110212 1045717981 /nfs/dbraw/zinc/71/79/81/1045717981.db2.gz ZBGJRJNJMZXMAK-FAEJEUNOSA-N 2 0 334.479 4.282 20 0 EIADRP C[NH+](C)C1CC[NH+](CC(c2ccc(F)cc2)c2ccc(F)cc2)CC1 ZINC000670262439 1045733303 /nfs/dbraw/zinc/73/33/03/1045733303.db2.gz UFLJZECLHYICBY-UHFFFAOYSA-N 2 0 344.449 4.123 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H]1CCCCC1(F)F ZINC000398023822 1045823818 /nfs/dbraw/zinc/82/38/18/1045823818.db2.gz LEWJMHBYEPLOIJ-BHIYHBOVSA-N 2 0 336.470 4.312 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1CCCCC1(F)F ZINC000398023825 1045823841 /nfs/dbraw/zinc/82/38/41/1045823841.db2.gz LEWJMHBYEPLOIJ-NZSAHSFTSA-N 2 0 336.470 4.312 20 0 EIADRP CSC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCC1 ZINC000248649017 1045880291 /nfs/dbraw/zinc/88/02/91/1045880291.db2.gz KGPNXZIBTZZEPT-REPLKXPHSA-N 2 0 330.541 4.057 20 0 EIADRP C[C@H]([NH3+])c1ccc(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC001170332207 1046001533 /nfs/dbraw/zinc/00/15/33/1046001533.db2.gz ASSFCYMDTWCVNS-IRNNPGBSSA-N 2 0 335.495 4.314 20 0 EIADRP Cc1cc2[nH+]ccn2cc1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001170333862 1046004834 /nfs/dbraw/zinc/00/48/34/1046004834.db2.gz WOFXFUZFXPURLF-OWZKRDHZSA-N 2 0 346.478 4.250 20 0 EIADRP [NH3+][C@H]1CCc2c1cccc2N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001170336815 1046005493 /nfs/dbraw/zinc/00/54/93/1046005493.db2.gz FUZMTIXHVKRNCN-VWNVYAMZSA-N 2 0 347.506 4.240 20 0 EIADRP Cc1cc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)cnc1Cl ZINC000769516175 1046007387 /nfs/dbraw/zinc/00/73/87/1046007387.db2.gz ZTKWFBKMFHEEMV-UHFFFAOYSA-N 2 0 335.923 4.131 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@H](C)c2cccc(Br)c2)CC1 ZINC000037150424 1046013315 /nfs/dbraw/zinc/01/33/15/1046013315.db2.gz NOEMQRQVQCTMLW-CQSZACIVSA-N 2 0 339.321 4.364 20 0 EIADRP CCc1noc(C)c1[C@@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000769871856 1046099701 /nfs/dbraw/zinc/09/97/01/1046099701.db2.gz ZVRLCWVXZPOYOS-OAHLLOKOSA-N 2 0 329.488 4.236 20 0 EIADRP CCC[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@@H](O)c1ccccc1 ZINC000793235714 1046181991 /nfs/dbraw/zinc/18/19/91/1046181991.db2.gz BAAOBPGUSZIDAJ-VXKWHMMOSA-N 2 0 344.543 4.275 20 0 EIADRP CCC(C)(C)[NH2+][C@H](C)C(=O)Nc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000476006310 1046196452 /nfs/dbraw/zinc/19/64/52/1046196452.db2.gz BCSIFLTXAXHIBN-IAGOWNOFSA-N 2 0 345.531 4.166 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C(c1ccccc1)c1ccccc1 ZINC000124380079 1046235828 /nfs/dbraw/zinc/23/58/28/1046235828.db2.gz MFHDJIAQENILBZ-RTBURBONSA-N 2 0 334.507 4.281 20 0 EIADRP COCCC1(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CCCC1 ZINC000508699887 1046327326 /nfs/dbraw/zinc/32/73/26/1046327326.db2.gz OYYMIPPBIMEFEE-TZIWHRDSSA-N 2 0 344.543 4.084 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c(C)c1 ZINC000162576378 1046356659 /nfs/dbraw/zinc/35/66/59/1046356659.db2.gz ZGONKUFTNVWJIC-GOSISDBHSA-N 2 0 326.484 4.095 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)C/C(C)=C/c2ccccc2COC)C[C@@H]1C ZINC000508719529 1046378843 /nfs/dbraw/zinc/37/88/43/1046378843.db2.gz NYAFEXDQTIJWHJ-VDKPFWJGSA-N 2 0 330.516 4.041 20 0 EIADRP CC(C)(C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1cccc(Cl)c1 ZINC000459393094 1046613078 /nfs/dbraw/zinc/61/30/78/1046613078.db2.gz VIJFKLDRRNIRFB-UHFFFAOYSA-N 2 0 343.902 4.271 20 0 EIADRP CC[N@@H+](Cc1ccc(F)cc1C)CC1CCN(c2ccccn2)CC1 ZINC000536661638 1046631106 /nfs/dbraw/zinc/63/11/06/1046631106.db2.gz ZOUQPUXUQHZMLQ-UHFFFAOYSA-N 2 0 341.474 4.268 20 0 EIADRP CCC[N@H+](C)C[C@H]1CCN(Cc2cc(C)c(C)cc2OC(F)F)C1 ZINC000536663328 1046632934 /nfs/dbraw/zinc/63/29/34/1046632934.db2.gz FMSOENBCRRZMDE-MRXNPFEDSA-N 2 0 340.458 4.069 20 0 EIADRP Clc1cccc(C2CC([NH2+]C3CCN(c4cc[nH+]cc4)CC3)C2)c1 ZINC000459423401 1046653977 /nfs/dbraw/zinc/65/39/77/1046653977.db2.gz OVENFTAIGRKPBJ-UHFFFAOYSA-N 2 0 341.886 4.240 20 0 EIADRP CCOc1ccc(C[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000536673520 1046657274 /nfs/dbraw/zinc/65/72/74/1046657274.db2.gz YJVXHBHEQGHSPB-OAQYLSRUSA-N 2 0 338.495 4.039 20 0 EIADRP c1ccc(C[C@@H](C[NH2+]C2CCN(C3CC3)CC2)c2ccccc2)cc1 ZINC000459435874 1046667638 /nfs/dbraw/zinc/66/76/38/1046667638.db2.gz XNZWQLMXCXHEID-NRFANRHFSA-N 2 0 334.507 4.229 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc3cc(OC)ccc3c2)[C@@H](C)C1 ZINC000536682263 1046684416 /nfs/dbraw/zinc/68/44/16/1046684416.db2.gz BJCDJJXDORATLU-KKSFZXQISA-N 2 0 326.484 4.011 20 0 EIADRP Cc1cc(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc(C)c1O ZINC000379615154 1046702040 /nfs/dbraw/zinc/70/20/40/1046702040.db2.gz AFXKGXWHSUNYHN-GHTZIAJQSA-N 2 0 338.495 4.152 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CCCOc2ccccc2)CCN1Cc1ccccc1 ZINC000379624694 1046715932 /nfs/dbraw/zinc/71/59/32/1046715932.db2.gz JRDUVMUTZSYSOT-PZJWPPBQSA-N 2 0 338.495 4.098 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+][C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 ZINC000379625308 1046716055 /nfs/dbraw/zinc/71/60/55/1046716055.db2.gz KPWJNFOUVJPFLV-LVCYWYKZSA-N 2 0 340.486 4.399 20 0 EIADRP CN(Cc1ccccc1)CC(C)(C)[NH2+]Cc1ccc2ncccc2c1 ZINC000379636010 1046724431 /nfs/dbraw/zinc/72/44/31/1046724431.db2.gz WSMNCDVBNZYZNU-UHFFFAOYSA-N 2 0 333.479 4.235 20 0 EIADRP C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc2ncsc2c1 ZINC000459499079 1046725482 /nfs/dbraw/zinc/72/54/82/1046725482.db2.gz LWFLZEVDXSPSNB-CQSZACIVSA-N 2 0 338.480 4.011 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3ccccc3C2)CCN1Cc1ccccc1 ZINC000379647794 1046740754 /nfs/dbraw/zinc/74/07/54/1046740754.db2.gz LDHKQHFRDZSORX-LEOXJPRUSA-N 2 0 334.507 4.187 20 0 EIADRP CC(C)C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)O[C@@H](C)C1)c1cccs1 ZINC000536858749 1046826738 /nfs/dbraw/zinc/82/67/38/1046826738.db2.gz RROCLULKLLAEJZ-BZSNNMDCSA-N 2 0 338.561 4.314 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(-c3ccc(OC)cc3)cc2)[C@@H](C)C1 ZINC000536874133 1046837044 /nfs/dbraw/zinc/83/70/44/1046837044.db2.gz CJHDNVFGNKGAKV-HTAPYJJXSA-N 2 0 338.495 4.182 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000459723561 1046864543 /nfs/dbraw/zinc/86/45/43/1046864543.db2.gz ADDZODQHPOSTON-LJISPDSOSA-N 2 0 326.937 4.215 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCC[NH2+][C@@H](C)c2ccc(OC)cc2)cc1 ZINC000537027500 1046904401 /nfs/dbraw/zinc/90/44/01/1046904401.db2.gz AENGEHHHMVFVJX-CALCHBBNSA-N 2 0 342.483 4.095 20 0 EIADRP C(=C/c1ccc(OCc2ccccc2)cc1)\C[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000666858094 1047009227 /nfs/dbraw/zinc/00/92/27/1047009227.db2.gz WTFDOFJTMUVMFY-FAZYEBOESA-N 2 0 336.479 4.011 20 0 EIADRP C[NH+]1CCC(C[N@@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000788011366 1047078382 /nfs/dbraw/zinc/07/83/82/1047078382.db2.gz FXPWGXGAANVHQF-QGZVFWFLSA-N 2 0 327.299 4.472 20 0 EIADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)[C@H](C)Oc1ccc(Cl)cc1Cl ZINC000537303719 1047085366 /nfs/dbraw/zinc/08/53/66/1047085366.db2.gz IVOYGQAYMOPURI-STQMWFEESA-N 2 0 343.298 4.001 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCc3nc(Cl)ccc32)cc1 ZINC000806127152 1047147946 /nfs/dbraw/zinc/14/79/46/1047147946.db2.gz ASEIAXDIUYQRAX-SFHVURJKSA-N 2 0 343.902 4.354 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3ccc(Cl)nc32)c1 ZINC000788643679 1047246475 /nfs/dbraw/zinc/24/64/75/1047246475.db2.gz KVJUNDPGPRUFDZ-GOSISDBHSA-N 2 0 343.902 4.352 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCCc3ccc(O)cc32)cc1 ZINC000327729803 1047393424 /nfs/dbraw/zinc/39/34/24/1047393424.db2.gz CTONRHIGORYBRN-JOCHJYFZSA-N 2 0 338.495 4.401 20 0 EIADRP FC(F)(F)[C@H]1CCC[C@@H]([NH2+]C2CC[NH+](CC3CCCC3)CC2)C1 ZINC000129558355 1047430539 /nfs/dbraw/zinc/43/05/39/1047430539.db2.gz XDIOEDIIAWMGDD-DOTOQJQBSA-N 2 0 332.454 4.352 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000129651144 1047456535 /nfs/dbraw/zinc/45/65/35/1047456535.db2.gz MGBXCGXGFDUUGO-YHUYYLMFSA-N 2 0 332.454 4.350 20 0 EIADRP C[C@@H]1CC[C@@H]([NH+]2CCC([NH3+])(Cc3ccccc3C(F)(F)F)CC2)C1 ZINC001170121535 1047482208 /nfs/dbraw/zinc/48/22/08/1047482208.db2.gz MXHWNUBAXLWJRZ-GDBMZVCRSA-N 2 0 340.433 4.230 20 0 EIADRP C[C@H]([NH2+][C@H]1CCSC(C)(C)C1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000897796003 1047485174 /nfs/dbraw/zinc/48/51/74/1047485174.db2.gz VUSHWYNCVIPERR-UHOSZYNNSA-N 2 0 332.557 4.161 20 0 EIADRP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000129754494 1047500400 /nfs/dbraw/zinc/50/04/00/1047500400.db2.gz ZVDGAYLDCXNRIA-PXNSSMCTSA-N 2 0 340.511 4.287 20 0 EIADRP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000129803323 1047509308 /nfs/dbraw/zinc/50/93/08/1047509308.db2.gz OOAHYCYVKPMSAQ-MGPQQGTHSA-N 2 0 327.299 4.141 20 0 EIADRP Fc1ccc([C@H]([NH2+]CCCCC[NH+]2CCCC2)c2ccccn2)cc1 ZINC000556234295 1047598210 /nfs/dbraw/zinc/59/82/10/1047598210.db2.gz WFSAURIJCRAMFX-NRFANRHFSA-N 2 0 341.474 4.166 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1ccncc1F ZINC000556235738 1047601154 /nfs/dbraw/zinc/60/11/54/1047601154.db2.gz GTDFTCVXINKQGG-IRXDYDNUSA-N 2 0 341.474 4.446 20 0 EIADRP C[NH+](C)C1CCC([NH2+]CCCCCCCCCCCCO)CC1 ZINC001168299858 1047710183 /nfs/dbraw/zinc/71/01/83/1047710183.db2.gz OKAOUNKVGOYXBK-UHFFFAOYSA-N 2 0 326.569 4.342 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H](c2cncc(C(F)(F)F)c2)C2CC2)CC1 ZINC001168306309 1047788564 /nfs/dbraw/zinc/78/85/64/1047788564.db2.gz WEDBBTCJAWMBSS-OFLPRAFFSA-N 2 0 341.421 4.014 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3cccc4[nH]ccc43)CC2)CC1 ZINC000131088872 1047826072 /nfs/dbraw/zinc/82/60/72/1047826072.db2.gz OPLQWQBUFKQEMY-UHFFFAOYSA-N 2 0 325.500 4.301 20 0 EIADRP C[NH+]1CCC(C2CC[NH+]([C@@H]3CCc4c(Cl)cccc4C3)CC2)CC1 ZINC001171049919 1047845642 /nfs/dbraw/zinc/84/56/42/1047845642.db2.gz OLZZIWWOPBCVFN-LJQANCHMSA-N 2 0 346.946 4.251 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000131271009 1047851768 /nfs/dbraw/zinc/85/17/68/1047851768.db2.gz ZGFFCWDEUZLLAV-HOTGVXAUSA-N 2 0 345.531 4.077 20 0 EIADRP [NH3+]Cc1ccccc1C[NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171066191 1047940830 /nfs/dbraw/zinc/94/08/30/1047940830.db2.gz IIJRFDNCRGCGFY-MRXNPFEDSA-N 2 0 335.278 4.099 20 0 EIADRP CC1(C)[C@@H]2C[C@@H]([NH+]3CCC([NH3+])(Cc4cccc(Cl)c4)CC3)C[C@@H]21 ZINC001170740980 1047961991 /nfs/dbraw/zinc/96/19/91/1047961991.db2.gz WJGWLYKCHOSJFY-NNZMDNLPSA-N 2 0 332.919 4.110 20 0 EIADRP [NH3+]CCCCCCC[NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171067189 1047964955 /nfs/dbraw/zinc/96/49/55/1047964955.db2.gz UDBXHJLQKIGBEJ-OAHLLOKOSA-N 2 0 329.315 4.350 20 0 EIADRP COc1ccccc1C[N@H+]([C@H]1C[C@@H]2[C@H](C1)C2(C)C)[C@H]1CC[C@H]([NH3+])CC1 ZINC001170738474 1047965792 /nfs/dbraw/zinc/96/57/92/1047965792.db2.gz MSDAQQRAEUUGSV-CCQCEHTISA-N 2 0 342.527 4.202 20 0 EIADRP Cc1ccc2c(C[N@H+](C)C[C@H]3CC[NH+](Cc4ccccc4)C3)c[nH]c2c1 ZINC001136974636 1048005891 /nfs/dbraw/zinc/00/58/91/1048005891.db2.gz GYPYLKYHJZLMED-HXUWFJFHSA-N 2 0 347.506 4.430 20 0 EIADRP c1c[nH]c([C@@H]([NH2+]CCCCC[NH+]2CCCCC2)C2CCCCC2)n1 ZINC000556870417 1048090095 /nfs/dbraw/zinc/09/00/95/1048090095.db2.gz FBSGERWRDKELAA-IBGZPJMESA-N 2 0 332.536 4.277 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CCc2nc(C3CCCCC3)cs2)[C@H]2CCC[C@@H]21 ZINC000556886240 1048106355 /nfs/dbraw/zinc/10/63/55/1048106355.db2.gz KDZMNKMJCSMBSV-AOIWGVFYSA-N 2 0 347.572 4.196 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@H]2CCc3cc(Cl)ccc3C2)CC1(C)C ZINC001171103392 1048187171 /nfs/dbraw/zinc/18/71/71/1048187171.db2.gz ALGJGDUSYWJVIG-KRWDZBQOSA-N 2 0 334.935 4.438 20 0 EIADRP CC(C)C[NH+]1CCC(C[NH2+][C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171107524 1048208314 /nfs/dbraw/zinc/20/83/14/1048208314.db2.gz CBFLRFDOUREAHZ-HXUWFJFHSA-N 2 0 334.935 4.155 20 0 EIADRP CCn1c2ccccc2nc1[C@@H]1CCC[N@@H+]1CCCCCCC[NH3+] ZINC000844221941 1048225309 /nfs/dbraw/zinc/22/53/09/1048225309.db2.gz OSHKXHSAYDNMMN-IBGZPJMESA-N 2 0 328.504 4.102 20 0 EIADRP Clc1ccc2c(c1)CC[C@H]([NH2+]CC1CC[NH+](C3CCC3)CC1)C2 ZINC001171113036 1048245598 /nfs/dbraw/zinc/24/55/98/1048245598.db2.gz YUEDCOJVUFFXII-IBGZPJMESA-N 2 0 332.919 4.051 20 0 EIADRP C[C@H](CC[N@@H+]1CCC[C@@]2(CC2(F)F)C1)[NH+]1CCC[C@]2(CC2(F)F)C1 ZINC000844437257 1048333497 /nfs/dbraw/zinc/33/34/97/1048333497.db2.gz MTLKTALOLQNCTL-OAGGEKHMSA-N 2 0 348.428 4.007 20 0 EIADRP C[N@H+](C1CCC([NH3+])CC1)[C@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171143548 1048442566 /nfs/dbraw/zinc/44/25/66/1048442566.db2.gz IQYDDNQYRZURMP-NRXISQOPSA-N 2 0 327.299 4.052 20 0 EIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cncc2ccccc21 ZINC000809739856 1048513241 /nfs/dbraw/zinc/51/32/41/1048513241.db2.gz VDIKFNANMWIEKW-UHFFFAOYSA-N 2 0 333.479 4.319 20 0 EIADRP C[N@H+](CC1CC[NH+](C)CC1)[C@@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171163042 1048600068 /nfs/dbraw/zinc/60/00/68/1048600068.db2.gz MFYPSUXROBIXCN-MRXNPFEDSA-N 2 0 341.326 4.124 20 0 EIADRP CC[NH+]1CCC(CC2CC[NH+](Cc3nc(C)c(C)s3)CC2)CC1 ZINC001144374501 1048621746 /nfs/dbraw/zinc/62/17/46/1048621746.db2.gz ADRREGLVNATCNW-UHFFFAOYSA-N 2 0 335.561 4.094 20 0 EIADRP C[C@H]([NH2+]CC[C@]1(C)C[C@]1(F)Cl)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000846036811 1048800984 /nfs/dbraw/zinc/80/09/84/1048800984.db2.gz MKEGJTXCXXRTEE-JCHJZTRSSA-N 2 0 338.898 4.191 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCCc2sccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000134969342 1049048620 /nfs/dbraw/zinc/04/86/20/1049048620.db2.gz VFOXEOGOZRPTLL-HNAYVOBHSA-N 2 0 344.524 4.417 20 0 EIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H](c1ccccc1)C1CCOCC1 ZINC000817893263 1049053039 /nfs/dbraw/zinc/05/30/39/1049053039.db2.gz DENAWHDATNESNL-JRGCBEDISA-N 2 0 330.516 4.055 20 0 EIADRP C[C@H]([NH3+])C[C@H](C)[NH2+]CC(C)(C)Sc1ccc(Br)cc1 ZINC000817897291 1049055380 /nfs/dbraw/zinc/05/53/80/1049055380.db2.gz JQXQYJHLSUXHMS-RYUDHWBXSA-N 2 0 345.350 4.035 20 0 EIADRP CC(C)c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(CC[NH3+])cc1)CCCO2 ZINC000817949208 1049064665 /nfs/dbraw/zinc/06/46/65/1049064665.db2.gz NWSWFDRRUYTKPC-NRFANRHFSA-N 2 0 338.495 4.315 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CC2(C)CC[NH2+]CC2)ccc1SC(F)F ZINC000817964987 1049073016 /nfs/dbraw/zinc/07/30/16/1049073016.db2.gz MARBSRPMIPWPBG-GFCCVEGCSA-N 2 0 344.471 4.050 20 0 EIADRP COc1cc([C@@H](C)[NH2+][C@H](C)CCCC[NH3+])ccc1SC(F)F ZINC000817976472 1049074589 /nfs/dbraw/zinc/07/45/89/1049074589.db2.gz ZEDOZDKDCYXEGG-VXGBXAGGSA-N 2 0 332.460 4.178 20 0 EIADRP COc1cc(C)c([C@@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cc1C ZINC000817982857 1049077323 /nfs/dbraw/zinc/07/73/23/1049077323.db2.gz IRWCKGUGDSAVRA-YLJYHZDGSA-N 2 0 326.484 4.443 20 0 EIADRP C[NH+](C)Cc1ccc(CC[NH2+][C@H]2CCc3cccc(Cl)c3C2)cc1 ZINC001170903173 1049143857 /nfs/dbraw/zinc/14/38/57/1049143857.db2.gz TYIIGVXUZIPPIB-IBGZPJMESA-N 2 0 342.914 4.091 20 0 EIADRP Clc1cccc2c1C[C@H]([NH2+]C1CC[NH+](CC3CCC3)CC1)CC2 ZINC001170910678 1049181565 /nfs/dbraw/zinc/18/15/65/1049181565.db2.gz MSRLEZWVFUDHAF-GOSISDBHSA-N 2 0 332.919 4.051 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2ccc(-c3ccccc3)o2)cc1F ZINC000136083487 1049324643 /nfs/dbraw/zinc/32/46/43/1049324643.db2.gz HJPDFTUKKWFZBQ-UHFFFAOYSA-N 2 0 338.426 4.437 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@@H]2CCc3c(F)cc(F)cc3C2)CC1 ZINC001171359579 1049511263 /nfs/dbraw/zinc/51/12/63/1049511263.db2.gz FCVAHWPHBHCKKD-KZNAEPCWSA-N 2 0 336.470 4.065 20 0 EIADRP Fc1cccc2c1C[C@@H]([NH2+]CC1CC[NH+](C3CCCCC3)CC1)CC2 ZINC001170955127 1049576444 /nfs/dbraw/zinc/57/64/44/1049576444.db2.gz JRAQNJLPFKOPJN-IBGZPJMESA-N 2 0 344.518 4.317 20 0 EIADRP CCc1noc(C)c1[C@@H](C)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000773099520 1049580950 /nfs/dbraw/zinc/58/09/50/1049580950.db2.gz REYILRUSPLUWAO-FAEJEUNOSA-N 2 0 333.520 4.239 20 0 EIADRP CCC1(C[NH2+][C@H](C)C[C@@H]2CCOC2)CC[NH+](Cc2ccccc2)CC1 ZINC000773105038 1049584921 /nfs/dbraw/zinc/58/49/21/1049584921.db2.gz HHJNZRJZMNZCKT-CTNGQTDRSA-N 2 0 344.543 4.084 20 0 EIADRP Fc1cccc2c1CC[C@H]([NH2+]C1CC[NH+](CC3CCCCC3)CC1)C2 ZINC001171411833 1049645116 /nfs/dbraw/zinc/64/51/16/1049645116.db2.gz OTKFVFSYICOKRE-FQEVSTJZSA-N 2 0 344.518 4.317 20 0 EIADRP Fc1cccc2c1C[C@@H]([NH2+]C1CC[NH+](CC3CCCCC3)CC1)CC2 ZINC001170967772 1049651787 /nfs/dbraw/zinc/65/17/87/1049651787.db2.gz ASFFCDTUROLHJU-FQEVSTJZSA-N 2 0 344.518 4.317 20 0 EIADRP Fc1cccc2c1CC[C@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001171434019 1049674353 /nfs/dbraw/zinc/67/43/53/1049674353.db2.gz PMPLLEMGYBUIAV-OALUTQOASA-N 2 0 330.491 4.023 20 0 EIADRP Fc1cc2c(cc1F)C[C@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)CC2 ZINC001171467439 1049725301 /nfs/dbraw/zinc/72/53/01/1049725301.db2.gz VFXTUBGIJGSVBQ-LJQANCHMSA-N 2 0 348.481 4.066 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CCOc2cccc3ccoc32)CC1(C)C ZINC001171629457 1049762281 /nfs/dbraw/zinc/76/22/81/1049762281.db2.gz RVEMPYPTASTANS-UHFFFAOYSA-N 2 0 330.472 4.053 20 0 EIADRP Cc1cc(C)cc(OC[C@H](C)[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)c1 ZINC001171614502 1049764871 /nfs/dbraw/zinc/76/48/71/1049764871.db2.gz ZJPUOSZBHMSBJL-KRWDZBQOSA-N 2 0 332.532 4.312 20 0 EIADRP C[NH+]1C(C)(C)CC(n2cc(CC[NH3+])c3cc(F)ccc32)CC1(C)C ZINC001171619086 1049766403 /nfs/dbraw/zinc/76/64/03/1049766403.db2.gz HIVNFJBPPUKAGB-UHFFFAOYSA-N 2 0 331.479 4.106 20 0 EIADRP Cc1cccc2c(CC[NH3+])cn(C3CC(C)(C)[NH+](C)C(C)(C)C3)c21 ZINC001171618816 1049766654 /nfs/dbraw/zinc/76/66/54/1049766654.db2.gz DDQDKVDDBAOXRD-UHFFFAOYSA-N 2 0 327.516 4.275 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]Cc2ccccc2-c2cccnc2)CC1(C)C ZINC001171623503 1049768123 /nfs/dbraw/zinc/76/81/23/1049768123.db2.gz ARZCICGHMBOMPY-UHFFFAOYSA-N 2 0 337.511 4.490 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+][C@@H]2CCO[C@@H](c3ccccc3)C2)CC1(C)C ZINC001171622891 1049768164 /nfs/dbraw/zinc/76/81/64/1049768164.db2.gz BMHBLKKRDRICSH-IEBWSBKVSA-N 2 0 330.516 4.148 20 0 EIADRP COc1ccccc1CC1(C[NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)CC1 ZINC001171627521 1049769654 /nfs/dbraw/zinc/76/96/54/1049769654.db2.gz UNQVFHTWZAAOEQ-UHFFFAOYSA-N 2 0 344.543 4.259 20 0 EIADRP COc1ccccc1[C@@H]1CCC[N@@H+]1C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171638506 1049779059 /nfs/dbraw/zinc/77/90/59/1049779059.db2.gz ZSUMWZIEKATDDF-SFHVURJKSA-N 2 0 330.516 4.484 20 0 EIADRP COc1cccc([C@H]2CCC[N@@H+]2C2CC(C)(C)[NH+](C)C(C)(C)C2)c1 ZINC001171639567 1049779573 /nfs/dbraw/zinc/77/95/73/1049779573.db2.gz PGPRDRHHXAUKLQ-LJQANCHMSA-N 2 0 330.516 4.484 20 0 EIADRP COc1ccccc1C[C@H](C)[N@H+](C)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171642753 1049781024 /nfs/dbraw/zinc/78/10/24/1049781024.db2.gz MEYTYBSFHZVVGH-INIZCTEOSA-N 2 0 332.532 4.209 20 0 EIADRP C[NH+]1C(C)(C)CC([NH+]2CCC(c3ccc(O)cc3)CC2)CC1(C)C ZINC001171642540 1049781416 /nfs/dbraw/zinc/78/14/16/1049781416.db2.gz KTGRYKVGCJWMAX-UHFFFAOYSA-N 2 0 330.516 4.223 20 0 EIADRP C[C@@H]1C[C@@H](n2cc(CCC[NH3+])c3ccccc32)C[N@@H+]1Cc1ccccc1 ZINC001171724900 1049785039 /nfs/dbraw/zinc/78/50/39/1049785039.db2.gz DWJZEQKCPYGLPQ-WIYYLYMNSA-N 2 0 347.506 4.368 20 0 EIADRP Cc1cc2cc(C[NH3+])ccc2n1[C@H]1C[C@@H](C)[N@@H+](Cc2ccccc2)C1 ZINC001171727134 1049785421 /nfs/dbraw/zinc/78/54/21/1049785421.db2.gz QCDLNLPDTIOJRR-IERDGZPVSA-N 2 0 333.479 4.244 20 0 EIADRP C[C@@H]1C[C@@H](n2c3ccccc3c3c2CC[NH2+]C3)C[N@@H+]1Cc1ccccc1 ZINC001171758560 1049789188 /nfs/dbraw/zinc/78/91/88/1049789188.db2.gz YFEPCTJRVFZIBL-IEBWSBKVSA-N 2 0 345.490 4.123 20 0 EIADRP Fc1cccc2c1C[C@H]([NH2+]CC1CC[NH+](CC3CCCCC3)CC1)C2 ZINC001171785051 1049803879 /nfs/dbraw/zinc/80/38/79/1049803879.db2.gz JCVAUZJYASCTMP-HXUWFJFHSA-N 2 0 344.518 4.175 20 0 EIADRP CCO[C@H](CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)C ZINC000245652578 1049812520 /nfs/dbraw/zinc/81/25/20/1049812520.db2.gz CWXFAGRQCRRPFQ-CIAFKFPVSA-N 2 0 344.543 4.223 20 0 EIADRP CC(C)[NH+](CCN[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)C(C)C ZINC001171969093 1049833619 /nfs/dbraw/zinc/83/36/19/1049833619.db2.gz TUKRJUZSORFGIB-NRFANRHFSA-N 2 0 345.575 4.138 20 0 EIADRP CC1(C)C[C@H](n2ccc3cc(C[NH3+])cnc32)CC[N@@H+]1Cc1ccccc1 ZINC001171971364 1049835221 /nfs/dbraw/zinc/83/52/21/1049835221.db2.gz HCLIRKYLQIUHLV-HXUWFJFHSA-N 2 0 348.494 4.111 20 0 EIADRP CC1(C)C[C@H](Nc2ccc(C[NH3+])c(F)c2)CC[N@@H+]1Cc1ccccc1 ZINC001171978853 1049838713 /nfs/dbraw/zinc/83/87/13/1049838713.db2.gz MKHUWCKTXUDMJQ-LJQANCHMSA-N 2 0 341.474 4.140 20 0 EIADRP CC1(C)C[C@H]([NH+]2CC[C@]3(C2)CCCCO3)CC[N@@H+]1Cc1ccccc1 ZINC001171981731 1049838921 /nfs/dbraw/zinc/83/89/21/1049838921.db2.gz NGCUDPYJFMHABE-IRLDBZIGSA-N 2 0 342.527 4.075 20 0 EIADRP CC1(C)C[C@@H]([NH2+][C@@H]2CCCc3ncccc32)CC[N@@H+]1Cc1ccccc1 ZINC001171982337 1049839336 /nfs/dbraw/zinc/83/93/36/1049839336.db2.gz HJOUFBCACLODOJ-SIKLNZKXSA-N 2 0 349.522 4.492 20 0 EIADRP C[NH2+]Cc1cccc(N[C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)c1 ZINC001171986266 1049839696 /nfs/dbraw/zinc/83/96/96/1049839696.db2.gz GJNIZFLXRAPSQO-NRFANRHFSA-N 2 0 337.511 4.261 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CCC[C@H]2C[C@@H]([NH2+][C@H]2CCc4ncccc42)C3)cc1 ZINC001172077022 1049845290 /nfs/dbraw/zinc/84/52/90/1049845290.db2.gz OGECTQHXZGKJCB-SRYPRDQNSA-N 2 0 347.506 4.244 20 0 EIADRP FC1(F)C[C@@]12CC[N@@H+]([C@@H]1C[C@H]3CCC[C@@H](C1)[NH+]3Cc1ccccc1)C2 ZINC001172074408 1049845394 /nfs/dbraw/zinc/84/53/94/1049845394.db2.gz IRDZIINYEOOPCE-IYWMVGAKSA-N 2 0 346.465 4.303 20 0 EIADRP c1cc2c(o1)CCN([C@@H]1C[C@H]3CCC[C@@H](C1)[N@H+]3Cc1ccccc1)C2 ZINC001172081318 1049848071 /nfs/dbraw/zinc/84/80/71/1049848071.db2.gz FERKYOBUOFAEEA-WKCHPHFGSA-N 2 0 336.479 4.223 20 0 EIADRP Cc1ccc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)n1C ZINC001172063932 1049851355 /nfs/dbraw/zinc/85/13/55/1049851355.db2.gz FCVXAMZXCIUHEX-MZADTFQBSA-N 2 0 337.511 4.009 20 0 EIADRP c1csc(C[NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172068447 1049852549 /nfs/dbraw/zinc/85/25/49/1049852549.db2.gz QUDDMHQPDZYSJR-REPLKXPHSA-N 2 0 326.509 4.423 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C)c1ccc(Br)s1 ZINC001172103747 1049857329 /nfs/dbraw/zinc/85/73/29/1049857329.db2.gz XDUHJBGCTDZDSX-ZDEQEGDKSA-N 2 0 343.334 4.177 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC1(Cc3ccccc3Cl)CC1)C2 ZINC001172110945 1049859108 /nfs/dbraw/zinc/85/91/08/1049859108.db2.gz MDZOVINFCMWIJX-NNZMDNLPSA-N 2 0 332.919 4.268 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]C[C@@H](c1ccc(Cl)cc1)C1CC1)C2 ZINC001172114355 1049859390 /nfs/dbraw/zinc/85/93/90/1049859390.db2.gz QVDJJZHRLFMOAD-YSTOQKLRSA-N 2 0 332.919 4.439 20 0 EIADRP c1ccc2c(c1)C[C@@H]([NH2+]CC1CC[NH+](C3CCCCC3)CC1)CS2 ZINC001172185446 1049859559 /nfs/dbraw/zinc/85/95/59/1049859559.db2.gz BXWIPAKRVQHLNM-LJQANCHMSA-N 2 0 344.568 4.338 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)[C@H]2CSc3ccccc3C2)CC1 ZINC001172203527 1049863625 /nfs/dbraw/zinc/86/36/25/1049863625.db2.gz XMQPAJKMAFMGFM-VAMGGRTRSA-N 2 0 344.568 4.466 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+][C@@H]3COC(C)(C)C3)[C@@H](C)C2)CC[C@H]1[NH3+] ZINC001172277478 1049870412 /nfs/dbraw/zinc/87/04/12/1049870412.db2.gz IRTPHJZRARPLHH-YBRIYBKASA-N 2 0 336.564 4.102 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[N@@H+]1CC[C@H]2C[NH+](Cc3ccccc3)C[C@H]2C1 ZINC001172344324 1049890184 /nfs/dbraw/zinc/89/01/84/1049890184.db2.gz AOXQDIUGAREQQK-LGGPRVQUSA-N 2 0 344.543 4.034 20 0 EIADRP CC[C@@H](CC(C)C)[NH+]1CCC2(C[C@@H]([N@H+](C)Cc3ccco3)CO2)CC1 ZINC001172402922 1049898513 /nfs/dbraw/zinc/89/85/13/1049898513.db2.gz PSRIQKLDUMVNBS-RBUKOAKNSA-N 2 0 348.531 4.160 20 0 EIADRP CC(C)OCC[C@@H](C)[NH+]1CCC2(CC[C@H]2[N@H+](C)Cc2ccco2)CC1 ZINC001172446147 1049914365 /nfs/dbraw/zinc/91/43/65/1049914365.db2.gz ISHMXWZCLOJJIJ-UYAOXDASSA-N 2 0 348.531 4.160 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC[C@@H]1CCC[N@@H+]1C ZINC001172568174 1049937864 /nfs/dbraw/zinc/93/78/64/1049937864.db2.gz OXUPDLNJZHBXJM-JSGCOSHPSA-N 2 0 330.850 4.013 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H](C)CCc2c(F)cc(Cl)cc2F)CC1 ZINC001172568442 1049938444 /nfs/dbraw/zinc/93/84/44/1049938444.db2.gz QWINRGYQODGORG-CYBMUJFWSA-N 2 0 344.877 4.261 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CCC1CC[NH+](C)CC1 ZINC001172577627 1049950912 /nfs/dbraw/zinc/95/09/12/1049950912.db2.gz VYCLIHRTYYYLFH-ZDUSSCGKSA-N 2 0 344.877 4.261 20 0 EIADRP C[N@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)C1CC(C)(C)OC(C)(C)C1 ZINC001172658886 1049958008 /nfs/dbraw/zinc/95/80/08/1049958008.db2.gz GKZXFLJVAXQIBF-LJQANCHMSA-N 2 0 344.543 4.177 20 0 EIADRP Clc1ccc2c(c1)C[C@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)C2 ZINC001172717921 1049965091 /nfs/dbraw/zinc/96/50/91/1049965091.db2.gz UKWKRDSFVGELST-HXUWFJFHSA-N 2 0 332.919 4.051 20 0 EIADRP CC(C)N1CCOC[C@]2(CCC[N@@H+](C3CCC4(CCCC4)CC3)C2)C1 ZINC001172727173 1049967506 /nfs/dbraw/zinc/96/75/06/1049967506.db2.gz UWMJYHYTYAGFGO-JOCHJYFZSA-N 2 0 348.575 4.312 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H]1CCN(C)[C@@H](C)C1 ZINC000247105372 1050013207 /nfs/dbraw/zinc/01/32/07/1050013207.db2.gz SQZFCIIOPIMXMQ-ZQIUZPCESA-N 2 0 329.513 4.252 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(OC)cc1 ZINC000248399827 1050053462 /nfs/dbraw/zinc/05/34/62/1050053462.db2.gz KIMIAYUJTQNZJD-MDKPJZGXSA-N 2 0 330.516 4.389 20 0 EIADRP FC(F)(F)C1CCC(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)CC1 ZINC000248762409 1050077769 /nfs/dbraw/zinc/07/77/69/1050077769.db2.gz WIUANNIINMIKRO-HDWXEKECSA-N 2 0 344.465 4.304 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000248894208 1050083225 /nfs/dbraw/zinc/08/32/25/1050083225.db2.gz ZMTOUURPIPFELT-CMKODMSKSA-N 2 0 334.548 4.111 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC001172839015 1050177716 /nfs/dbraw/zinc/17/77/16/1050177716.db2.gz AFMHQWGGVJMHFV-AWEZNQCLSA-N 2 0 334.866 4.262 20 0 EIADRP Cc1cc(C[NH2+]CCCC[N@H+]2CCCC[C@H]2C)cc2cccnc12 ZINC001177299696 1050180777 /nfs/dbraw/zinc/18/07/77/1050180777.db2.gz ZJVOVDCXQYQILJ-GOSISDBHSA-N 2 0 325.500 4.287 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C)CC2 ZINC001172843748 1050182066 /nfs/dbraw/zinc/18/20/66/1050182066.db2.gz OKODCFULFVWSGI-BHDDXSALSA-N 2 0 326.528 4.191 20 0 EIADRP CC(C)C[NH+]1CCC(C[NH2+][C@@H](C)Cc2c(F)cccc2Cl)CC1 ZINC001172844703 1050183510 /nfs/dbraw/zinc/18/35/10/1050183510.db2.gz DKFCXTLYXYBQNS-HNNXBMFYSA-N 2 0 340.914 4.368 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)[NH2+]C1CC[NH+](CC2CCC2)CC1 ZINC001172847860 1050186223 /nfs/dbraw/zinc/18/62/23/1050186223.db2.gz NOXJORYEXQIURK-AWEZNQCLSA-N 2 0 338.898 4.264 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[N@H+](CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172848089 1050186357 /nfs/dbraw/zinc/18/63/57/1050186357.db2.gz QAXZUNQXGPYOIJ-FVQBIDKESA-N 2 0 338.898 4.392 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+]C2CCC(C3CCC3)CC2)c1 ZINC001177318933 1050189970 /nfs/dbraw/zinc/18/99/70/1050189970.db2.gz LHHFTDLPZBWDES-UHFFFAOYSA-N 2 0 330.516 4.076 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)[C@@H](C)Cc2c(F)cccc2Cl)CC1 ZINC001172851562 1050190798 /nfs/dbraw/zinc/19/07/98/1050190798.db2.gz APWSMVTYBKLFAF-HNNXBMFYSA-N 2 0 340.914 4.462 20 0 EIADRP C[C@H](Cc1ccc(F)cc1Cl)[NH+]1C(C)(C)CC([NH3+])CC1(C)C ZINC001172860428 1050198862 /nfs/dbraw/zinc/19/88/62/1050198862.db2.gz CVUBMNMWQGUDRV-GFCCVEGCSA-N 2 0 326.887 4.390 20 0 EIADRP C[C@@H](CSc1ccc(Cl)cc1)[NH2+]CCC1CC[NH+](C)CC1 ZINC001172869666 1050207318 /nfs/dbraw/zinc/20/73/18/1050207318.db2.gz DYAQOBCQPXBRPF-AWEZNQCLSA-N 2 0 326.937 4.142 20 0 EIADRP C[C@@H](CSc1ccc(Cl)cc1)[NH+]1CCN(c2cc[nH+]cc2)CC1 ZINC001172878834 1050220998 /nfs/dbraw/zinc/22/09/98/1050220998.db2.gz VRBHJZKBNZZWEZ-HNNXBMFYSA-N 2 0 347.915 4.038 20 0 EIADRP CO[C@H]1CCC[C@@H]([N@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172927986 1050238314 /nfs/dbraw/zinc/23/83/14/1050238314.db2.gz IETBPSYETATTOD-NCYKPQTJSA-N 2 0 330.516 4.025 20 0 EIADRP COc1ccc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c(C)c1 ZINC001177562114 1050252967 /nfs/dbraw/zinc/25/29/67/1050252967.db2.gz IAUPSJHJZVEBOJ-UHFFFAOYSA-N 2 0 344.524 4.067 20 0 EIADRP [NH3+][C@@H]1CC[N@H+](Cc2ccc(Oc3ccc(Cl)cc3)cc2)CC[C@@H]1F ZINC001206187040 1050265804 /nfs/dbraw/zinc/26/58/04/1050265804.db2.gz SPPOBVFIHDKCNA-RBUKOAKNSA-N 2 0 348.849 4.394 20 0 EIADRP CC[C@H]1CCC[C@@H]([NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)CC1 ZINC001177673901 1050273958 /nfs/dbraw/zinc/27/39/58/1050273958.db2.gz BMGWQLWKDLZXQU-AZUAARDMSA-N 2 0 332.532 4.466 20 0 EIADRP C[C@H](Cc1ccc(OC(F)(F)F)cc1)[NH2+]C1CCC(CC[NH3+])CC1 ZINC001173075714 1050291459 /nfs/dbraw/zinc/29/14/59/1050291459.db2.gz MFQHWPQRZXEYDU-VQCLRJIVSA-N 2 0 344.421 4.013 20 0 EIADRP COc1cc(C[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)cc2ccccc21 ZINC001177823494 1050298106 /nfs/dbraw/zinc/29/81/06/1050298106.db2.gz VELWUQKCZMWDFK-HXUWFJFHSA-N 2 0 328.500 4.304 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](CCO)c2ccc(Cl)cc2)CC1 ZINC001173101285 1050301396 /nfs/dbraw/zinc/30/13/96/1050301396.db2.gz FRLUXRBRMVPHSR-ACBHZAAOSA-N 2 0 338.923 4.006 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2(c3cccc(F)c3)CCOCC2)CC1 ZINC001173107246 1050306829 /nfs/dbraw/zinc/30/68/29/1050306829.db2.gz ZJMVDRDITQEBCG-UHFFFAOYSA-N 2 0 348.506 4.074 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2CC[NH+](C3CCCCC3)CC2)CC1 ZINC001173107576 1050307335 /nfs/dbraw/zinc/30/73/35/1050307335.db2.gz XHSZSRUSHBFDIX-UHFFFAOYSA-N 2 0 335.580 4.026 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@@H](Oc3ccc(C)cc3)C2)CC1 ZINC001173112156 1050310932 /nfs/dbraw/zinc/31/09/32/1050310932.db2.gz RGUOUWLDKZGXCI-QETWGEEDSA-N 2 0 344.543 4.491 20 0 EIADRP CC[C@H]1CC[C@H]([NH+]2CCC3(CC([N@H+](C)Cc4ccncc4)C3)CC2)C1 ZINC001173278993 1050408498 /nfs/dbraw/zinc/40/84/98/1050408498.db2.gz NVMAZKALAOKVRT-ICSRJNTNSA-N 2 0 341.543 4.337 20 0 EIADRP [NH3+]C1(Cc2ccccn2)CC[NH+]([C@@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173342622 1050431619 /nfs/dbraw/zinc/43/16/19/1050431619.db2.gz DAEUCYSGCQJWCC-HXUWFJFHSA-N 2 0 341.543 4.311 20 0 EIADRP Cc1ccccc1N(C)c1ccc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)cc1 ZINC001206200341 1050455482 /nfs/dbraw/zinc/45/54/82/1050455482.db2.gz RDIFAKHMJAFRJT-WOJBJXKFSA-N 2 0 341.474 4.024 20 0 EIADRP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC001173548489 1050486030 /nfs/dbraw/zinc/48/60/30/1050486030.db2.gz CGMKKNLJRZBNCQ-KBXCAEBGSA-N 2 0 341.326 4.342 20 0 EIADRP CC[NH+]1C[C@@H]2C[NH+]([C@H](C)CCc3ccc(Cl)c(Cl)c3)C[C@H]2C1 ZINC001173551152 1050488841 /nfs/dbraw/zinc/48/88/41/1050488841.db2.gz QYJWWIJXKUVYGU-FVQBIDKESA-N 2 0 341.326 4.198 20 0 EIADRP C[N@@H+]1CCC[C@H](CC[NH2+]C2CCC3(CCc4ccccc43)CC2)C1 ZINC001173687804 1050539496 /nfs/dbraw/zinc/53/94/96/1050539496.db2.gz TZKDMTVMDFLNQY-HOHBBMLPSA-N 2 0 326.528 4.135 20 0 EIADRP C[N@H+](C1CC1)C1CC[NH+](C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173691075 1050543938 /nfs/dbraw/zinc/54/39/38/1050543938.db2.gz FVXXEUKMRIOPSI-UHFFFAOYSA-N 2 0 338.539 4.372 20 0 EIADRP COC[C@H](CC(C)(C)C)[NH2+][C@@H]1CCN(Cc2ccccc2)C2(CC2)C1 ZINC001179034368 1050622743 /nfs/dbraw/zinc/62/27/43/1050622743.db2.gz FCKNKYXZSNDFQU-UXHICEINSA-N 2 0 344.543 4.224 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2cnc(-c3cccs3)s2)CC1 ZINC000093688599 1050660730 /nfs/dbraw/zinc/66/07/30/1050660730.db2.gz MDNFLHRBQZEDDZ-UHFFFAOYSA-N 2 0 349.569 4.425 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2cnc(-c3ccsc3)s2)CC1 ZINC000093688544 1050661699 /nfs/dbraw/zinc/66/16/99/1050661699.db2.gz SFSPHEXJCSKYCX-UHFFFAOYSA-N 2 0 349.569 4.425 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+]C(C2CCCC2)C2CCCC2)cc1 ZINC001179645251 1050735305 /nfs/dbraw/zinc/73/53/05/1050735305.db2.gz KPHFMPXBMZKBRV-UHFFFAOYSA-N 2 0 344.543 4.466 20 0 EIADRP Clc1ccc(C[NH2+][C@@H]2CC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]3C2)o1 ZINC001179771853 1050767299 /nfs/dbraw/zinc/76/72/99/1050767299.db2.gz ONNNXMDUSDDZNF-FGTMMUONSA-N 2 0 344.886 4.323 20 0 EIADRP C[C@]1(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)CCCS1 ZINC001179864192 1050809928 /nfs/dbraw/zinc/80/99/28/1050809928.db2.gz UUAYLZCESMAYMU-RTWAWAEBSA-N 2 0 344.568 4.260 20 0 EIADRP CC[N@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)CC1CCC(OC)CC1 ZINC001179945233 1050827995 /nfs/dbraw/zinc/82/79/95/1050827995.db2.gz GFLSUABDPQGTIF-ATKRNPRHSA-N 2 0 344.543 4.036 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cc3ccc(C)cc3[nH]2)CC1 ZINC001180125164 1050892144 /nfs/dbraw/zinc/89/21/44/1050892144.db2.gz TZQGOOFBLIFZMB-UHFFFAOYSA-N 2 0 327.516 4.420 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc3ccc(F)c(F)c3n2)CC1 ZINC001180166428 1050907863 /nfs/dbraw/zinc/90/78/63/1050907863.db2.gz NTJTWTCRFMXZLA-UHFFFAOYSA-N 2 0 347.453 4.065 20 0 EIADRP C[N@H+](CC(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C)C1CCCC1 ZINC001180630966 1051054482 /nfs/dbraw/zinc/05/44/82/1051054482.db2.gz UBLXTRMHGGMSRK-UHFFFAOYSA-N 2 0 342.508 4.446 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H](C)SC)cc1C[NH+]1CCCCC1 ZINC000183378231 1051102532 /nfs/dbraw/zinc/10/25/32/1051102532.db2.gz WTMDLUBOAOHFFD-HZPDHXFCSA-N 2 0 336.545 4.083 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ccoc2C)ccc1OC ZINC000775381221 1051175028 /nfs/dbraw/zinc/17/50/28/1051175028.db2.gz BLSCKCGNQQZFPT-HNNXBMFYSA-N 2 0 330.472 4.289 20 0 EIADRP C[C@@H](C[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000544573859 1051187881 /nfs/dbraw/zinc/18/78/81/1051187881.db2.gz ZKSAYQHFDGPYIQ-ZWKOTPCHSA-N 2 0 326.484 4.081 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccc(F)c(OC)c2)c1 ZINC000153596986 1051202202 /nfs/dbraw/zinc/20/22/02/1051202202.db2.gz YNECNRLQPPUNHT-OAHLLOKOSA-N 2 0 330.447 4.137 20 0 EIADRP CC(C)c1ccc(CC[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC001181349097 1051214142 /nfs/dbraw/zinc/21/41/42/1051214142.db2.gz KMVCVSOXXRSHGM-JOCHJYFZSA-N 2 0 336.523 4.464 20 0 EIADRP CC1CC[NH+](Cc2ccccc2C[NH2+]Cc2ccc(O)c(F)c2)CC1 ZINC001181455305 1051229274 /nfs/dbraw/zinc/22/92/74/1051229274.db2.gz IBHQOLFFSQHPRF-UHFFFAOYSA-N 2 0 342.458 4.053 20 0 EIADRP C[NH+](C)CCCC[NH2+]Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1 ZINC000620761003 1051280820 /nfs/dbraw/zinc/28/08/20/1051280820.db2.gz LBYWEIRNEBWXJP-UHFFFAOYSA-N 2 0 340.389 4.397 20 0 EIADRP CCCC[N@H+](CC1(Br)CC1)C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001174983171 1051304949 /nfs/dbraw/zinc/30/49/49/1051304949.db2.gz FFWUXEFCJZAMLX-UHFFFAOYSA-N 2 0 345.369 4.325 20 0 EIADRP c1ccc([C@H]([NH2+]CCCCC[NH+]2CCCCC2)C2CCOCC2)cc1 ZINC000775443203 1051380873 /nfs/dbraw/zinc/38/08/73/1051380873.db2.gz XPPWYKXVNRPMHU-QFIPXVFZSA-N 2 0 344.543 4.400 20 0 EIADRP CS[C@@H]1CC[N@H+](C[C@@]2(C(C)(C)C)CC[NH+](Cc3ccccc3)C2)C1 ZINC001182063338 1051389585 /nfs/dbraw/zinc/38/95/85/1051389585.db2.gz TXTZABLRTDWYBG-CTNGQTDRSA-N 2 0 346.584 4.362 20 0 EIADRP C[C@H](CCc1ccccc1)[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001191233024 1051405489 /nfs/dbraw/zinc/40/54/89/1051405489.db2.gz KEEDDUCXBREVGG-NFBKMPQASA-N 2 0 336.523 4.462 20 0 EIADRP CC(C)[C@@H]1CC[N@H+](CCC[NH+]2CCC(Cc3ccccc3)CC2)C1 ZINC001191541332 1051478240 /nfs/dbraw/zinc/47/82/40/1051478240.db2.gz SKFVNYVOLJITTQ-JOCHJYFZSA-N 2 0 328.544 4.309 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](CCc2cccc(F)c2)CC1 ZINC001191550811 1051486564 /nfs/dbraw/zinc/48/65/64/1051486564.db2.gz MFFWAIPPKWYRLV-GOSISDBHSA-N 2 0 332.507 4.345 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](CCc2ccccc2F)CC1 ZINC001191550865 1051486938 /nfs/dbraw/zinc/48/69/38/1051486938.db2.gz NOWXUIUICXLKJG-SFHVURJKSA-N 2 0 332.507 4.345 20 0 EIADRP CC(C)[N@H+](Cc1cccc(CN2CCOCC2)c1)C1CCCCC1 ZINC001191871884 1051574616 /nfs/dbraw/zinc/57/46/16/1051574616.db2.gz ZZFIEDJGCLHKIF-UHFFFAOYSA-N 2 0 330.516 4.062 20 0 EIADRP CC(C)C[N@H+](C)CCC[NH2+][C@@H](C)Cc1ccccc1C(F)(F)F ZINC001182714016 1051681582 /nfs/dbraw/zinc/68/15/82/1051681582.db2.gz KAQYUEWASHVXBD-HNNXBMFYSA-N 2 0 330.438 4.204 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc2ccccc2c1OC(F)F ZINC000158109537 1051711418 /nfs/dbraw/zinc/71/14/18/1051711418.db2.gz STNZCQWGZNPLOD-GJZGRUSLSA-N 2 0 348.437 4.434 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+]C[C@@H]2CCC[N@H+](C)C2)cc1 ZINC000158142213 1051720616 /nfs/dbraw/zinc/72/06/16/1051720616.db2.gz BJFQOAQJUJBIEY-ROUUACIJSA-N 2 0 338.495 4.355 20 0 EIADRP CC[N@H+](CCC1CC[NH+](CC2(O)CCCCCC2)CC1)CC(C)C ZINC001192489293 1051756076 /nfs/dbraw/zinc/75/60/76/1051756076.db2.gz CTJDYAFFNRTUTL-UHFFFAOYSA-N 2 0 338.580 4.152 20 0 EIADRP COC1(C[C@@H](C)[NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CCC1 ZINC001183145736 1051793198 /nfs/dbraw/zinc/79/31/98/1051793198.db2.gz MZYQDAUMPRTUMQ-LJQANCHMSA-N 2 0 344.543 4.226 20 0 EIADRP CC(C)CC[NH+]1CCC([NH2+]CCc2c[nH]c3c2cccc3Cl)CC1 ZINC001183170062 1051800553 /nfs/dbraw/zinc/80/05/53/1051800553.db2.gz HNJSDBGOVNWNFQ-UHFFFAOYSA-N 2 0 347.934 4.464 20 0 EIADRP C[C@H](CCc1ccc(Cl)s1)[NH2+]C[C@@H]1CCN1C1CCCC1 ZINC001183227245 1051808049 /nfs/dbraw/zinc/80/80/49/1051808049.db2.gz PTNLIUJZAMRSIA-HIFRSBDPSA-N 2 0 326.937 4.329 20 0 EIADRP CCC1([NH+]2CCCC2)CCN(C/C=C\c2ccc(F)c(F)c2)CC1 ZINC001183238842 1051809946 /nfs/dbraw/zinc/80/99/46/1051809946.db2.gz QHTAXWFXPAHODJ-WAYWQWQTSA-N 2 0 334.454 4.318 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccc(Cl)cc1 ZINC001192910837 1051832152 /nfs/dbraw/zinc/83/21/52/1051832152.db2.gz XQYZOADOENEWSS-UHFFFAOYSA-N 2 0 343.902 4.474 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+][C@H]1CC[C@@](C)(c2ccccc2)C1)c1cccnc1 ZINC001183919253 1051928227 /nfs/dbraw/zinc/92/82/27/1051928227.db2.gz HXVPKHKAUOOSPB-FDFHNCONSA-N 2 0 337.511 4.174 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCC(C)(C)CO1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001184045758 1051944242 /nfs/dbraw/zinc/94/42/42/1051944242.db2.gz QCTHVMYNINRUCM-JBACZVJFSA-N 2 0 344.543 4.082 20 0 EIADRP FC1(F)C[C@@H]1CC[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000621768925 1051944491 /nfs/dbraw/zinc/94/44/91/1051944491.db2.gz WRLQDDHEMYHMCH-INDMIFKZSA-N 2 0 334.454 4.065 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]C/C=C\c2ccc(OCc3ccccc3)cc2)C1 ZINC000414913737 1051981902 /nfs/dbraw/zinc/98/19/02/1051981902.db2.gz JPUQDRZYYVKOQO-IZRQAOQISA-N 2 0 336.479 4.138 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]CCc2ccc(-c3csc(C)n3)s2)[C@H](C)C1 ZINC000164467630 1052031635 /nfs/dbraw/zinc/03/16/35/1052031635.db2.gz UPSCYLKKUSDFQV-CZUORRHYSA-N 2 0 349.569 4.042 20 0 EIADRP c1ccc(C[NH+]2C[C@@H]3C[N@@H+](CCSC4CCCCC4)C[C@@H]3C2)cc1 ZINC001193990276 1052041550 /nfs/dbraw/zinc/04/15/50/1052041550.db2.gz MSZLVFSBGNAZCS-BGYRXZFFSA-N 2 0 344.568 4.116 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(OCC[NH+](C)C)c2)cc1 ZINC000165897857 1052079374 /nfs/dbraw/zinc/07/93/74/1052079374.db2.gz YNTVLNYTPFCHOU-ROUUACIJSA-N 2 0 326.484 4.347 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000166070561 1052081747 /nfs/dbraw/zinc/08/17/47/1052081747.db2.gz VWBXYYKZJJVMQK-UNMCSNQZSA-N 2 0 338.495 4.006 20 0 EIADRP CC(C)(C)n1cncc1[C@@H]1CCC[N@H+](Cc2cc(O)ccc2Cl)C1 ZINC001176992024 1052213472 /nfs/dbraw/zinc/21/34/72/1052213472.db2.gz WJSYFKBHWBBBOL-CQSZACIVSA-N 2 0 347.890 4.377 20 0 EIADRP COc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c(C)c1 ZINC001177127715 1052227491 /nfs/dbraw/zinc/22/74/91/1052227491.db2.gz KKGOYECHEPRBQQ-UHFFFAOYSA-N 2 0 338.495 4.279 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cccs1 ZINC000171130924 1052396053 /nfs/dbraw/zinc/39/60/53/1052396053.db2.gz DEZJAFYFDGRPGX-SFHVURJKSA-N 2 0 332.513 4.320 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccc(OC(F)F)cc1 ZINC000171128143 1052396545 /nfs/dbraw/zinc/39/65/45/1052396545.db2.gz UOQRJMCCWNCNNC-CQSZACIVSA-N 2 0 334.410 4.200 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1cccc(OC(F)F)c1 ZINC000171129191 1052396715 /nfs/dbraw/zinc/39/67/15/1052396715.db2.gz OKXVVZURGCCIEP-AWEZNQCLSA-N 2 0 334.410 4.200 20 0 EIADRP C[C@H](CCc1ccco1)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000379903739 1052565311 /nfs/dbraw/zinc/56/53/11/1052565311.db2.gz IIFFGIZEADSVOW-QWFCFKBJSA-N 2 0 326.484 4.101 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cnc(-c3ccccc3)[nH]2)c1 ZINC000175982154 1052603097 /nfs/dbraw/zinc/60/30/97/1052603097.db2.gz XKKAIGYNUJSVEB-UHFFFAOYSA-N 2 0 348.494 4.207 20 0 EIADRP C[C@@H](C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccccc1 ZINC000671313117 1052616116 /nfs/dbraw/zinc/61/61/16/1052616116.db2.gz ZRICXCHIZBVQSH-SFHVURJKSA-N 2 0 338.495 4.053 20 0 EIADRP C[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)CC1(C)C ZINC000623512572 1052667550 /nfs/dbraw/zinc/66/75/50/1052667550.db2.gz NDWUPDWBVIOXQX-DJIMGWMZSA-N 2 0 340.433 4.414 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000178087243 1052698078 /nfs/dbraw/zinc/69/80/78/1052698078.db2.gz FTPJJTSEJRMVEO-YCRPNKLZSA-N 2 0 342.458 4.104 20 0 EIADRP c1nc2c(s1)CCC[C@@H]2[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000623873763 1052827379 /nfs/dbraw/zinc/82/73/79/1052827379.db2.gz QRLULYUQPNEKJR-SFHVURJKSA-N 2 0 341.524 4.022 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H]2CCCc3c4cc(Cl)ccc4[nH]c32)CC[N@@H+]1C ZINC000623898297 1052832225 /nfs/dbraw/zinc/83/22/25/1052832225.db2.gz FAOWKUYTOFTHMU-DFHBCGBQSA-N 2 0 331.891 4.271 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCCc4scnc43)CC2)CC1 ZINC000623923902 1052838787 /nfs/dbraw/zinc/83/87/87/1052838787.db2.gz NWSAHIUWGKARPC-OFLPRAFFSA-N 2 0 333.545 4.153 20 0 EIADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(F)cc1C(F)(F)F ZINC000623957666 1052841918 /nfs/dbraw/zinc/84/19/18/1052841918.db2.gz PYPUZDJPIFHTKD-LBPRGKRZSA-N 2 0 332.385 4.227 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(F)cc1C(F)(F)F ZINC000623998522 1052850163 /nfs/dbraw/zinc/85/01/63/1052850163.db2.gz VGRQYMPDUIEVFD-LBPRGKRZSA-N 2 0 332.385 4.370 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1cc(-c2ccccc2)n(C)n1 ZINC000623989947 1052851235 /nfs/dbraw/zinc/85/12/35/1052851235.db2.gz NGUQOCCOLRWRJV-SFHVURJKSA-N 2 0 340.515 4.004 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000624124052 1052868608 /nfs/dbraw/zinc/86/86/08/1052868608.db2.gz VZJICWSWENQDBP-LJISPDSOSA-N 2 0 326.937 4.215 20 0 EIADRP CCc1c2cc(C)ccc2oc1[C@@H](C)[NH2+]C1CCN(CCOC)CC1 ZINC000181581988 1052888327 /nfs/dbraw/zinc/88/83/27/1052888327.db2.gz XZCBGKBVRYNBAG-MRXNPFEDSA-N 2 0 344.499 4.065 20 0 EIADRP CCC[NH+]1CCC([NH2+]CCc2nc(C3CCCCC3)cs2)CC1 ZINC000183292056 1052969550 /nfs/dbraw/zinc/96/95/50/1052969550.db2.gz BMKHPOWDNXATLO-UHFFFAOYSA-N 2 0 335.561 4.197 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)cc1 ZINC000850174446 1053081568 /nfs/dbraw/zinc/08/15/68/1053081568.db2.gz QVXXRKVQFDYKOY-QZTJIDSGSA-N 2 0 329.513 4.081 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)cc1 ZINC000850174444 1053082813 /nfs/dbraw/zinc/08/28/13/1053082813.db2.gz QVXXRKVQFDYKOY-MSOLQXFVSA-N 2 0 329.513 4.081 20 0 EIADRP FC1(F)CCCC[C@@H]1C[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000381796051 1053097016 /nfs/dbraw/zinc/09/70/16/1053097016.db2.gz BNLINQCEQLABKV-MTQWCTHYSA-N 2 0 348.481 4.312 20 0 EIADRP C[C@@H](Nc1ccc(C[NH+](C)C)c(F)c1)c1cccc(C[NH+](C)C)c1 ZINC000864006270 1053125608 /nfs/dbraw/zinc/12/56/08/1053125608.db2.gz RALYIRJRTVVYPQ-OAHLLOKOSA-N 2 0 329.463 4.122 20 0 EIADRP Cc1c([C@@H](C)NCCC[N@@H+]2CCCC[C@@H]2C)cnn1-c1ccccc1 ZINC000764627583 1053238312 /nfs/dbraw/zinc/23/83/12/1053238312.db2.gz JKQFUUUMTAZEOM-ZWKOTPCHSA-N 2 0 340.515 4.096 20 0 EIADRP Cc1c([C@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cnn1-c1ccccc1 ZINC000764770138 1053303056 /nfs/dbraw/zinc/30/30/56/1053303056.db2.gz WLVUBTHOYSREFF-KRWDZBQOSA-N 2 0 348.494 4.093 20 0 EIADRP COc1ccc(CC[C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000764961012 1053399774 /nfs/dbraw/zinc/39/97/74/1053399774.db2.gz GJEVUWXMXUFTJL-MOPGFXCFSA-N 2 0 332.532 4.118 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1cnn(-c2ccccc2)c1 ZINC000764963263 1053401463 /nfs/dbraw/zinc/40/14/63/1053401463.db2.gz BYUMVQISMVIFMI-IBGZPJMESA-N 2 0 340.515 4.035 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1cccc(F)c1 ZINC000765358987 1053513657 /nfs/dbraw/zinc/51/36/57/1053513657.db2.gz JLFRFOQWVDDVNN-SJORKVTESA-N 2 0 344.474 4.220 20 0 EIADRP CC[NH+](CC)Cc1ccccc1CNCc1c(Cl)n[nH]c1C1CC1 ZINC000921514304 1053562269 /nfs/dbraw/zinc/56/22/69/1053562269.db2.gz XYVYOWQUXFJVGS-UHFFFAOYSA-N 2 0 346.906 4.072 20 0 EIADRP c1cc2ccc(C[NH2+]C[C@H]3CCC[N@H+](Cc4ccccc4)C3)cc2[nH]1 ZINC000386050271 1053574900 /nfs/dbraw/zinc/57/49/00/1053574900.db2.gz BUGQAOJMHWNZCK-HXUWFJFHSA-N 2 0 333.479 4.170 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2c(Cl)ccc3cccnc32)CC1 ZINC000865765259 1053587959 /nfs/dbraw/zinc/58/79/59/1053587959.db2.gz NVCSZKUCLAYZPG-UHFFFAOYSA-N 2 0 331.891 4.241 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2ccc(-c3ccncc3)cc2F)CC1 ZINC000865765029 1053588299 /nfs/dbraw/zinc/58/82/99/1053588299.db2.gz IXJDUGWLRKHEMO-UHFFFAOYSA-N 2 0 341.474 4.240 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](c2ccccn2)C(C)C)cc1 ZINC000866219474 1053654718 /nfs/dbraw/zinc/65/47/18/1053654718.db2.gz PGQHNFRVJCXAEZ-OAQYLSRUSA-N 2 0 325.500 4.410 20 0 EIADRP CC(C)[C@H]([NH2+]C[C@H]1CCCN(Cc2cccs2)C1)c1ccccn1 ZINC000866250511 1053665568 /nfs/dbraw/zinc/66/55/68/1053665568.db2.gz CXGHKKDMMLKPRJ-XLIONFOSSA-N 2 0 343.540 4.342 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(OC)cc1 ZINC000386441160 1053730088 /nfs/dbraw/zinc/73/00/88/1053730088.db2.gz PULPQTXNCZANRX-KNQAVFIVSA-N 2 0 338.495 4.258 20 0 EIADRP COCc1cc([C@@H](C)[NH2+]CCC2CC[NH+](C(C)C)CC2)ccc1OC ZINC000866467823 1053741506 /nfs/dbraw/zinc/74/15/06/1053741506.db2.gz RIORCJJDCQLGQY-QGZVFWFLSA-N 2 0 348.531 4.003 20 0 EIADRP C[C@H](Cc1cccs1)[NH2+]C[C@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000690007588 1053742147 /nfs/dbraw/zinc/74/21/47/1053742147.db2.gz SPBAGCJURPZFBJ-XLIONFOSSA-N 2 0 328.525 4.181 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@@H](c2ccc(F)cc2)c2cccnc2)CC1 ZINC000866518012 1053764050 /nfs/dbraw/zinc/76/40/50/1053764050.db2.gz QYPOSLPKXXGDTR-KBWCOIMZSA-N 2 0 341.474 4.163 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@H](c2ccc(F)cc2)c2cccnc2)CC1 ZINC000866518013 1053764894 /nfs/dbraw/zinc/76/48/94/1053764894.db2.gz QYPOSLPKXXGDTR-NYLDSWQDSA-N 2 0 341.474 4.163 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)CC1 ZINC000866516663 1053765175 /nfs/dbraw/zinc/76/51/75/1053765175.db2.gz RWRZWJWUYPESLZ-RCKXYERXSA-N 2 0 330.516 4.007 20 0 EIADRP CC(F)(F)C(C)(C)C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000866543975 1053777210 /nfs/dbraw/zinc/77/72/10/1053777210.db2.gz CHJZQISPFGRNGJ-NNZMDNLPSA-N 2 0 336.470 4.453 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2nccc3c2CCCC3)c1 ZINC000921609290 1053920671 /nfs/dbraw/zinc/92/06/71/1053920671.db2.gz YXOLHUCYXCROHC-UHFFFAOYSA-N 2 0 337.511 4.090 20 0 EIADRP CC(C)[N@H+](C)Cc1cc(O[C@H]2CC[NH+](C[C@H](C)C(C)(C)C)C2)ccn1 ZINC000856558422 1054085273 /nfs/dbraw/zinc/08/52/73/1054085273.db2.gz IGNGOVBHKKLAIH-PXNSSMCTSA-N 2 0 347.547 4.057 20 0 EIADRP Fc1ccc(/C=C\C[NH2+]C[C@H](c2ccccc2)N2CCCC2)c(F)c1 ZINC001198967733 1054314392 /nfs/dbraw/zinc/31/43/92/1054314392.db2.gz BZNJKGZGBBDBFQ-DFOOEPSASA-N 2 0 342.433 4.405 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000872022898 1054337888 /nfs/dbraw/zinc/33/78/88/1054337888.db2.gz MUKXMIWSGNLERX-HXUWFJFHSA-N 2 0 330.516 4.108 20 0 EIADRP C[C@@H](C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)Cc1ccc(C(C)(C)C)cc1 ZINC001199197846 1054362141 /nfs/dbraw/zinc/36/21/41/1054362141.db2.gz KIQHFATWCUYHLE-IEBWSBKVSA-N 2 0 328.544 4.237 20 0 EIADRP CCO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)C1 ZINC001199265868 1054376705 /nfs/dbraw/zinc/37/67/05/1054376705.db2.gz FANKTOINVGYHLA-STZQEDGTSA-N 2 0 344.543 4.498 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+]Cc2ccc3ccc(F)c(F)c3n2)C1 ZINC001199344870 1054388796 /nfs/dbraw/zinc/38/87/96/1054388796.db2.gz LSFOQKLXGCJHPL-OAHLLOKOSA-N 2 0 347.453 4.115 20 0 EIADRP CC(C)Cc1ncc(C[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)s1 ZINC001199319965 1054391120 /nfs/dbraw/zinc/39/11/20/1054391120.db2.gz GIRMPLDZZQFKRL-IRXDYDNUSA-N 2 0 337.577 4.189 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+]C[C@@H]1CCCC[C@@H]1C ZINC001199329503 1054392722 /nfs/dbraw/zinc/39/27/22/1054392722.db2.gz UFZNKQAFFSCIME-OALUTQOASA-N 2 0 332.532 4.323 20 0 EIADRP CC(C)C[C@@H]1CCC[C@H]([NH2+]Cc2ccc(OCC[NH+](C)C)cc2)C1 ZINC001199384053 1054402428 /nfs/dbraw/zinc/40/24/28/1054402428.db2.gz NOZNVTCQPIBVLT-PMACEKPBSA-N 2 0 332.532 4.322 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccc(SC(F)F)cc1 ZINC000858490896 1054498592 /nfs/dbraw/zinc/49/85/92/1054498592.db2.gz RUNKDZPYWUVZSI-KGLIPLIRSA-N 2 0 328.472 4.384 20 0 EIADRP COc1cc([C@@H](C)[NH2+][C@H]2CC[C@H](C[NH3+])CC2)ccc1SC(F)F ZINC000873240107 1054512641 /nfs/dbraw/zinc/51/26/41/1054512641.db2.gz JVGNYOJKTQEITG-YRGRVCCFSA-N 2 0 344.471 4.178 20 0 EIADRP CSc1cccc([C@H]([NH2+]C[C@H]2C[C@@H]([NH3+])C2)c2cc(F)ccc2F)c1 ZINC000873250186 1054515664 /nfs/dbraw/zinc/51/56/64/1054515664.db2.gz FJTVXWJUDIXGCC-HGQUKEQDSA-N 2 0 348.462 4.103 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(SCC(F)F)cc1)C1CC[NH2+]CC1 ZINC000873267927 1054517557 /nfs/dbraw/zinc/51/75/57/1054517557.db2.gz MGCQVBRNYZJGLG-QWHCGFSZSA-N 2 0 328.472 4.083 20 0 EIADRP CSc1ccc(CN[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)o1 ZINC001200880372 1054566035 /nfs/dbraw/zinc/56/60/35/1054566035.db2.gz SIMJNHSDFTZRMG-WBVHZDCISA-N 2 0 330.497 4.144 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)CC1 ZINC000776166998 1054800696 /nfs/dbraw/zinc/80/06/96/1054800696.db2.gz ILFIWIHCYNKINZ-QGZVFWFLSA-N 2 0 338.467 4.230 20 0 EIADRP CCC(CC)C[NH+]1CCC2(CCC[N@@H+]2Cc2c(C)noc2C)CC1 ZINC001201526298 1054843336 /nfs/dbraw/zinc/84/33/36/1054843336.db2.gz WIKSSBWESAFBAM-UHFFFAOYSA-N 2 0 333.520 4.158 20 0 EIADRP CCCC[C@H](CC)C[NH+]1CCC2(CCC[N@@H+]2Cc2cnn(C)c2)CC1 ZINC001201559546 1054849328 /nfs/dbraw/zinc/84/93/28/1054849328.db2.gz LFXAUYRXHMMPPZ-IBGZPJMESA-N 2 0 346.563 4.067 20 0 EIADRP CC(C)CC[NH+]1CCC(OC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001201630521 1054859504 /nfs/dbraw/zinc/85/95/04/1054859504.db2.gz VHOOEURRHRVSBT-UHFFFAOYSA-N 2 0 344.543 4.178 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](C[C@H]2CCOC2)CC1)c1ccc(C(C)(C)C)cc1 ZINC000173427989 1054944865 /nfs/dbraw/zinc/94/48/65/1054944865.db2.gz UNILHGHLMYOJJQ-QZTJIDSGSA-N 2 0 344.543 4.136 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CCO[C@@H](c2ccc(OC)cc2)C1 ZINC001168593015 1054947486 /nfs/dbraw/zinc/94/74/86/1054947486.db2.gz BPMFXOSESGFWAZ-HFSMHLIXSA-N 2 0 348.531 4.015 20 0 EIADRP CCCC[N@H+](C)CC1CCN(Cc2ncc(-c3cccs3)o2)CC1 ZINC000067485656 1055038398 /nfs/dbraw/zinc/03/83/98/1055038398.db2.gz DVIFJBMIVBCOSQ-UHFFFAOYSA-N 2 0 347.528 4.347 20 0 EIADRP C[N@H+](Cc1cccs1)[C@@H]1CCC[C@H]2C[NH+](CCC(F)(F)F)C[C@H]21 ZINC001202328550 1055142162 /nfs/dbraw/zinc/14/21/62/1055142162.db2.gz HNJRBGOQNWHGLN-NUEKZKHPSA-N 2 0 346.462 4.233 20 0 EIADRP CCCCC[C@H]([NH2+][C@@H]1CCN(C2CC[NH+](C)CC2)C1)c1ccccc1 ZINC000765943431 1056692150 /nfs/dbraw/zinc/69/21/50/1056692150.db2.gz KVJOECNMEVKNLP-IRLDBZIGSA-N 2 0 343.559 4.066 20 0 EIADRP Cc1cccc(O[C@@H]2CCCC[C@H]2[NH2+]C2CC[NH+](C(C)C)CC2)c1 ZINC000542935089 1056804421 /nfs/dbraw/zinc/80/44/21/1056804421.db2.gz ASQFHJLIRJWLPS-NHCUHLMSSA-N 2 0 330.516 4.147 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2cccc(COC)c2)CC1 ZINC000542945518 1056829497 /nfs/dbraw/zinc/82/94/97/1056829497.db2.gz SEFJASUFPWZVBY-UHFFFAOYSA-N 2 0 332.532 4.167 20 0 EIADRP CC1(C)CC([NH2+]Cc2ccccc2N2CCCCC2)CC(C)(C)[NH2+]1 ZINC000743503637 1059029754 /nfs/dbraw/zinc/02/97/54/1059029754.db2.gz INLPVEMPCUOJNO-UHFFFAOYSA-N 2 0 329.532 4.076 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH2+][C@H](C)c1cccc(O)c1)c1cccc(O)c1 ZINC000181548054 1059534101 /nfs/dbraw/zinc/53/41/01/1059534101.db2.gz JXVKKGMJRJJCIJ-IAGOWNOFSA-N 2 0 342.483 4.270 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(OCc2ccccc2)c1)C1CC[NH+](C)CC1 ZINC000381151882 1060208139 /nfs/dbraw/zinc/20/81/39/1060208139.db2.gz KWWJBUKAVLZJKL-GOSISDBHSA-N 2 0 338.495 4.086 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000386483112 1060270598 /nfs/dbraw/zinc/27/05/98/1060270598.db2.gz WLRQDPIDGSNHHW-QUCCMNQESA-N 2 0 338.495 4.258 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(SC(F)F)cc2)[C@H](C)C1 ZINC000746469516 1060373295 /nfs/dbraw/zinc/37/32/95/1060373295.db2.gz COFBAFZSOXPIOW-CZUORRHYSA-N 2 0 328.472 4.163 20 0 EIADRP COc1cc(C[N@H+](C)Cc2ccc(C[NH+](C)C)cc2)ccc1Cl ZINC001168839922 1060449217 /nfs/dbraw/zinc/44/92/17/1060449217.db2.gz ZDINCGDGGGNHDJ-UHFFFAOYSA-N 2 0 332.875 4.042 20 0 EIADRP Cc1ncn([C@@H](Cc2ccccc2)CC(C)C)c1CSCC[NH3+] ZINC001169058746 1060616300 /nfs/dbraw/zinc/61/63/00/1060616300.db2.gz KNDJPBRDCRURAZ-GOSISDBHSA-N 2 0 331.529 4.213 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CCc1cccc(Oc3ccccc3)c1)C2 ZINC001169095665 1060631518 /nfs/dbraw/zinc/63/15/18/1060631518.db2.gz QRTOBSZNGOHMRE-ACDBMABISA-N 2 0 336.479 4.236 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H]1CCCc3c(Br)cccc31)C2 ZINC001169118259 1060647840 /nfs/dbraw/zinc/64/78/40/1060647840.db2.gz GEZJYGDACRZKHT-AHXJXLJNSA-N 2 0 349.316 4.041 20 0 EIADRP CC1(C)C[C@H](Nc2ccc([C@@H]3CCC[NH2+]C3)cc2)C[C@@](C)(C[NH3+])C1 ZINC001169145231 1060665636 /nfs/dbraw/zinc/66/56/36/1060665636.db2.gz DGPYIKWOCHAIDI-SLYNCCJLSA-N 2 0 329.532 4.109 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](n1cc(C3CC[NH2+]CC3)c3cc(F)ccc31)C2 ZINC001169153608 1060671012 /nfs/dbraw/zinc/67/10/12/1060671012.db2.gz KHGWPUQTKRBMRS-PIIMJCKOSA-N 2 0 341.474 4.045 20 0 EIADRP C[C@@H]1C[N@H+](Cc2sccc2Oc2ccccc2)CCC[C@@H]1C[NH3+] ZINC001206003736 1060687379 /nfs/dbraw/zinc/68/73/79/1060687379.db2.gz LYSYUHUFUGITRA-HZPDHXFCSA-N 2 0 330.497 4.347 20 0 EIADRP Fc1ccc2c(c1)[C@H]([NH2+]C1CCN(c3cc[nH+]cc3)CC1)CCS2 ZINC000298267461 526373702 /nfs/dbraw/zinc/37/37/02/526373702.db2.gz GELYDTRYELVIRF-GOSISDBHSA-N 2 0 343.471 4.016 20 0 EIADRP c1ccc2c(c1)C=C(C[NH2+]CCCCCCC[NH+]1CCCC1)CO2 ZINC000729682365 1032131206 /nfs/dbraw/zinc/13/12/06/1032131206.db2.gz TUEIKUJTPZKICX-UHFFFAOYSA-N 2 0 328.500 4.098 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CC3(CCCCC3)Oc3ccccc32)C1 ZINC000532802084 1032320679 /nfs/dbraw/zinc/32/06/79/1032320679.db2.gz JFBNDSCQYMFGND-PKOBYXMFSA-N 2 0 328.500 4.145 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc(OC)cc1 ZINC000120894802 1032455538 /nfs/dbraw/zinc/45/55/38/1032455538.db2.gz WVHKSBASHJGCOJ-FQEVSTJZSA-N 2 0 330.447 4.137 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccccc1OC ZINC000120966440 1032481935 /nfs/dbraw/zinc/48/19/35/1032481935.db2.gz RRXYSKPCIZZFBL-IBGZPJMESA-N 2 0 330.447 4.137 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccccc1OC ZINC000120966576 1032482358 /nfs/dbraw/zinc/48/23/58/1032482358.db2.gz RRXYSKPCIZZFBL-LJQANCHMSA-N 2 0 330.447 4.137 20 0 EIADRP C[C@H](c1ccc(CN2CC[C@@H](C[NH+]3CCCC3)C2)cc1)C(F)(F)F ZINC000450427247 1032486778 /nfs/dbraw/zinc/48/67/78/1032486778.db2.gz FFOPRUKBJWKTEV-WBVHZDCISA-N 2 0 340.433 4.270 20 0 EIADRP CC[C@@H](C)Oc1cc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)ccc1OC ZINC000666755294 1032510257 /nfs/dbraw/zinc/51/02/57/1032510257.db2.gz KMCOEADNZASEOO-CVEARBPZSA-N 2 0 342.483 4.182 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1ccc(Oc2ccccc2)cn1 ZINC000643541173 1018788940 /nfs/dbraw/zinc/78/89/40/1018788940.db2.gz POWCPLWTFQRNRS-BBWFWOEESA-N 2 0 325.456 4.042 20 0 EIADRP CC(C)[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)CS1 ZINC000683108326 1018836354 /nfs/dbraw/zinc/83/63/54/1018836354.db2.gz BPQXJIZNJGCTKU-ZCNNSNEGSA-N 2 0 332.557 4.018 20 0 EIADRP C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccc(-c4ccc(F)cc4)s3)C2)C1 ZINC000430144599 1018844571 /nfs/dbraw/zinc/84/45/71/1018844571.db2.gz CCLDXDNBNLTLPO-IBGZPJMESA-N 2 0 330.472 4.082 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@H]2[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1F ZINC000643546706 1018895870 /nfs/dbraw/zinc/89/58/70/1018895870.db2.gz TUEZKMLWPLHCBB-JENIJYKNSA-N 2 0 346.490 4.125 20 0 EIADRP c1c2c(cc3c1OCCC[C@@H]3[NH2+][C@H]1CC[NH2+]C3(CCC3)C1)CCCC2 ZINC000643546502 1018895900 /nfs/dbraw/zinc/89/59/00/1018895900.db2.gz PMNWDVOCZAEYSC-ICSRJNTNSA-N 2 0 340.511 4.043 20 0 EIADRP CC[C@@H]([NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000643548400 1018927782 /nfs/dbraw/zinc/92/77/82/1018927782.db2.gz OUUMYHPVBGWAPB-GOEBONIOSA-N 2 0 342.405 4.301 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2cnc3ccc(C)cc3c2)CC1 ZINC001167078785 1019587306 /nfs/dbraw/zinc/58/73/06/1019587306.db2.gz VSHFMTWHMSKBFW-UHFFFAOYSA-N 2 0 339.527 4.487 20 0 EIADRP Cc1ccccc1C[NH+]1CCC(N[C@@H](C)c2ccc(Cl)cn2)CC1 ZINC000274875948 1019827089 /nfs/dbraw/zinc/82/70/89/1019827089.db2.gz GOMVNKIFWDYMKT-INIZCTEOSA-N 2 0 343.902 4.359 20 0 EIADRP C[NH+](C)[C@H]1CCC[N@H+](Cc2ccc(-c3ccc(F)cc3)s2)CC1 ZINC000432816805 1032872727 /nfs/dbraw/zinc/87/27/27/1032872727.db2.gz RKDGZEOXJLFNMS-KRWDZBQOSA-N 2 0 332.488 4.470 20 0 EIADRP CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547830240 1020775170 /nfs/dbraw/zinc/77/51/70/1020775170.db2.gz KLSCIUISJUWKSL-USXIJHARSA-N 2 0 328.422 4.218 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)C1 ZINC000655805901 1020976527 /nfs/dbraw/zinc/97/65/27/1020976527.db2.gz URAMQBWDRCDCCB-SCTDSRPQSA-N 2 0 328.500 4.143 20 0 EIADRP Cc1cnc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(C)c1 ZINC000655806796 1020977017 /nfs/dbraw/zinc/97/70/17/1020977017.db2.gz FBUWTRCFOGBUBR-DKUWSORSSA-N 2 0 349.522 4.026 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1)c1ccncc1F ZINC000340471631 1021080055 /nfs/dbraw/zinc/08/00/55/1021080055.db2.gz DTRAZAOCUZTCEX-QGZVFWFLSA-N 2 0 341.474 4.303 20 0 EIADRP Cc1ccncc1[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000683691506 1021099753 /nfs/dbraw/zinc/09/97/53/1021099753.db2.gz YNVFDSFOHIZERQ-AYWYSENESA-N 2 0 335.495 4.236 20 0 EIADRP Cc1ccccc1[C@H](CC(F)(F)F)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000683693639 1021104481 /nfs/dbraw/zinc/10/44/81/1021104481.db2.gz JMCXFBHOWNUIRW-PBHICJAKSA-N 2 0 328.422 4.308 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ccc3cnccc3c2)C1 ZINC000683765174 1021379186 /nfs/dbraw/zinc/37/91/86/1021379186.db2.gz FOPYSRJGTKNCJB-HDICACEKSA-N 2 0 325.500 4.083 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2ccc3cnccc3c2)C1 ZINC000683765177 1021379680 /nfs/dbraw/zinc/37/96/80/1021379680.db2.gz FOPYSRJGTKNCJB-ROUUACIJSA-N 2 0 325.500 4.083 20 0 EIADRP CCCO[C@H]1CCC[N@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC001167363523 1021732726 /nfs/dbraw/zinc/73/27/26/1021732726.db2.gz AUTMZCUEXLQQPK-QFIPXVFZSA-N 2 0 344.543 4.454 20 0 EIADRP CCc1ccccc1[C@H](N)C[NH2+][C@@H]1CCC[C@@H](c2ncccc2C)C1 ZINC000580302502 1021831184 /nfs/dbraw/zinc/83/11/84/1021831184.db2.gz WXTRPZISMMDWRZ-SFHLNBCPSA-N 2 0 337.511 4.268 20 0 EIADRP Clc1cc(C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)c(Cl)s1 ZINC000312766752 1021832372 /nfs/dbraw/zinc/83/23/72/1021832372.db2.gz GRQFFZMGDINNJJ-UHFFFAOYSA-N 2 0 342.295 4.209 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)cc1 ZINC000613259561 1021833669 /nfs/dbraw/zinc/83/36/69/1021833669.db2.gz IDWWLSJWMUCYDL-XUVXKRRUSA-N 2 0 330.516 4.076 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCc3ccc(OC)cc32)cc1 ZINC000173228526 1021872891 /nfs/dbraw/zinc/87/28/91/1021872891.db2.gz JQMGIHIHUPKGPJ-QFIPXVFZSA-N 2 0 338.495 4.314 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]CCn1ccnc1 ZINC000155688564 1021877951 /nfs/dbraw/zinc/87/79/51/1021877951.db2.gz JQHUSTAXBSWFKZ-LBPRGKRZSA-N 2 0 346.887 4.319 20 0 EIADRP C[C@@H]([NH2+][C@H]1CCc2nc[nH]c2C1)c1cc(F)c(Cl)cc1Cl ZINC000377799696 1022013790 /nfs/dbraw/zinc/01/37/90/1022013790.db2.gz YFXZWOGTRIJNDI-BDAKNGLRSA-N 2 0 328.218 4.064 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCCc2nc(C)sc21 ZINC000163786045 1022024132 /nfs/dbraw/zinc/02/41/32/1022024132.db2.gz HTFDMNFYMLUHEZ-SFHVURJKSA-N 2 0 343.540 4.461 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(Cl)c(F)c1 ZINC000398053766 1022052199 /nfs/dbraw/zinc/05/21/99/1022052199.db2.gz YTONRPZHVFJZJR-FOIQADDNSA-N 2 0 346.877 4.479 20 0 EIADRP CCOc1cccc2cc([C@H](C)[NH2+]CC[C@@H]3CCC[N@H+](C)C3)oc21 ZINC000414199447 1022103321 /nfs/dbraw/zinc/10/33/21/1022103321.db2.gz XBBOVPBWQIZPGU-HOTGVXAUSA-N 2 0 330.472 4.214 20 0 EIADRP CSc1ccc([C@@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)cc1 ZINC000069674885 1022172603 /nfs/dbraw/zinc/17/26/03/1022172603.db2.gz LHUADQINCUTFIL-MRXNPFEDSA-N 2 0 344.524 4.200 20 0 EIADRP CC[C@H]([NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000414219482 1022191704 /nfs/dbraw/zinc/19/17/04/1022191704.db2.gz HLPYLPSYNBSXTF-UTKZUKDTSA-N 2 0 326.484 4.429 20 0 EIADRP c1c[nH]c([C@@H]([NH2+]CCCCCCC[NH+]2CCCC2)c2ccccc2)n1 ZINC000275916568 1022196067 /nfs/dbraw/zinc/19/60/67/1022196067.db2.gz VIUIRVFKQZBZHB-FQEVSTJZSA-N 2 0 340.515 4.135 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](CCc2ccc(Cl)cc2)C1 ZINC001167424318 1022316853 /nfs/dbraw/zinc/31/68/53/1022316853.db2.gz HDRVFCXYGZVGRE-PKOBYXMFSA-N 2 0 334.935 4.469 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](C[C@H]2CC(C)(C)OC2(C)C)C1 ZINC001167424513 1022318942 /nfs/dbraw/zinc/31/89/42/1022318942.db2.gz KUTWADINFHPBPO-GUDVDZBRSA-N 2 0 336.564 4.167 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H]2CCCc3cc(OC(F)F)ccc32)CC1 ZINC000122968387 1022337188 /nfs/dbraw/zinc/33/71/88/1022337188.db2.gz YYNRRTFQWAUREU-SFHVURJKSA-N 2 0 338.442 4.129 20 0 EIADRP C[C@@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)CC(F)(F)F ZINC000414279001 1022388430 /nfs/dbraw/zinc/38/84/30/1022388430.db2.gz IPGHZFJQVORJMU-NRSFXHEJSA-N 2 0 340.433 4.360 20 0 EIADRP CCCCOc1ccc(C[N@H+](C)[C@H]2CCN(C)C[C@@H]2C)cc1OCC ZINC000580801444 1022509761 /nfs/dbraw/zinc/50/97/61/1022509761.db2.gz JFPYGVJEIBKKAX-HKUYNNGSSA-N 2 0 348.531 4.036 20 0 EIADRP Cn1cccc1C[NH2+]Cc1ccccc1-c1ccc(C[NH+](C)C)cc1 ZINC000161616675 1022510209 /nfs/dbraw/zinc/51/02/09/1022510209.db2.gz QSNCZYOLWVFIOS-UHFFFAOYSA-N 2 0 333.479 4.044 20 0 EIADRP CC(C)(C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cccnc1 ZINC000414324205 1022544168 /nfs/dbraw/zinc/54/41/68/1022544168.db2.gz BCNMWZZGNNLELM-DKUWSORSSA-N 2 0 349.522 4.144 20 0 EIADRP C[C@@H](CCc1ccco1)[NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000310846188 1022647020 /nfs/dbraw/zinc/64/70/20/1022647020.db2.gz IKTMIQOSVWWJRU-FPOVZHCZSA-N 2 0 340.511 4.493 20 0 EIADRP c1nc(-c2ccccc2)sc1C[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000647542781 1022778123 /nfs/dbraw/zinc/77/81/23/1022778123.db2.gz BSWGVIFTIVTDTG-MSOLQXFVSA-N 2 0 341.524 4.022 20 0 EIADRP c1cc(-c2nc(C[N@@H+]3CCC[C@H]([C@@H]4CCC[NH2+]C4)C3)cs2)cs1 ZINC000647542793 1022779344 /nfs/dbraw/zinc/77/93/44/1022779344.db2.gz BXMMMHGZBCDVMS-CABCVRRESA-N 2 0 347.553 4.083 20 0 EIADRP COc1ccc([C@@H](C)NCc2ccco2)cc1C[NH+]1CCCCC1 ZINC000182191927 1022782690 /nfs/dbraw/zinc/78/26/90/1022782690.db2.gz DJYQMGAXZBEQPU-MRXNPFEDSA-N 2 0 328.456 4.125 20 0 EIADRP C[NH+]1CCC2(CCCN2Cc2ccc(OC(F)F)c(Cl)c2)CC1 ZINC000472603063 1022814851 /nfs/dbraw/zinc/81/48/51/1022814851.db2.gz RQKNQBLJVCMXOB-UHFFFAOYSA-N 2 0 344.833 4.002 20 0 EIADRP Fc1ccc([C@@H]2C[C@@H]([NH2+]C3CC[NH+](C4CCCC4)CC3)CCO2)cc1 ZINC000363863318 1022867559 /nfs/dbraw/zinc/86/75/59/1022867559.db2.gz KMJMBPYEJWDPPE-FPOVZHCZSA-N 2 0 346.490 4.042 20 0 EIADRP Fc1ccc([C@H]2C[C@@H]([NH2+]C3CC[NH+](C4CCCC4)CC3)CCO2)cc1 ZINC000363863320 1022867614 /nfs/dbraw/zinc/86/76/14/1022867614.db2.gz KMJMBPYEJWDPPE-PZJWPPBQSA-N 2 0 346.490 4.042 20 0 EIADRP c1cc(C[NH+]2CCC(C[NH+]3CCCC3)CC2)cc(-c2ccncc2)c1 ZINC000152675223 1022943310 /nfs/dbraw/zinc/94/33/10/1022943310.db2.gz AWSLMKLVYBNCCT-UHFFFAOYSA-N 2 0 335.495 4.056 20 0 EIADRP CC(C)c1ccc(-c2ncc(C[N@@H+]3CCC[C@@H]([C@H](C)[NH3+])C3)s2)cc1 ZINC000430556796 1023004976 /nfs/dbraw/zinc/00/49/76/1023004976.db2.gz VKDCODRWJDXUEO-MAUKXSAKSA-N 2 0 343.540 4.493 20 0 EIADRP C[C@@H]([NH2+][C@@H](c1ccccc1)c1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC000396436947 1023017205 /nfs/dbraw/zinc/01/72/05/1023017205.db2.gz HBHBPEYWSNXXNA-IERDGZPVSA-N 2 0 326.459 4.235 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)C(c1ccccc1)c1ccccc1 ZINC000178158706 1023061834 /nfs/dbraw/zinc/06/18/34/1023061834.db2.gz NPHJKQROAITBMN-VLCRHTCISA-N 2 0 334.507 4.423 20 0 EIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1C[C@H]1c1cccs1 ZINC000417306294 1023254926 /nfs/dbraw/zinc/25/49/26/1023254926.db2.gz FZHGRGQPEUVKJJ-AYOQOUSVSA-N 2 0 341.524 4.141 20 0 EIADRP CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H](C)c2cccc(C[NH+](C)C)c2)c1 ZINC000924600429 1023332107 /nfs/dbraw/zinc/33/21/07/1023332107.db2.gz STNHVQYKPADABV-HZPDHXFCSA-N 2 0 339.483 4.118 20 0 EIADRP C[C@@H]([NH2+]CCc1nsc2ccccc21)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000660255321 1023389136 /nfs/dbraw/zinc/38/91/36/1023389136.db2.gz BAHHSGGXZQOSBJ-CVEARBPZSA-N 2 0 343.540 4.081 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cccc(OCc2ccccc2F)c1 ZINC000415020748 1023393360 /nfs/dbraw/zinc/39/33/60/1023393360.db2.gz XKHFMNTZUOXSFF-INIZCTEOSA-N 2 0 330.447 4.012 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1csc(-c2ccsc2)n1)c1ccccc1 ZINC000415046539 1023408566 /nfs/dbraw/zinc/40/85/66/1023408566.db2.gz CSFMUAHDGIDMAM-KRWDZBQOSA-N 2 0 343.521 4.441 20 0 EIADRP COc1cccc([C@H](N[C@@H]2CCC[NH2+]CC2)c2ccccc2Cl)c1 ZINC000415081247 1023430024 /nfs/dbraw/zinc/43/00/24/1023430024.db2.gz KMPMLBIQVCXSGS-UZLBHIALSA-N 2 0 344.886 4.170 20 0 EIADRP Cc1ccc(C)c([C@@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000656682344 1023434142 /nfs/dbraw/zinc/43/41/42/1023434142.db2.gz BIZSZECUNRCVBH-LJQANCHMSA-N 2 0 337.511 4.261 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+]C[C@@H]3C[C@H]3c3ccccc3)CC2)c1 ZINC000417896102 1023447300 /nfs/dbraw/zinc/44/73/00/1023447300.db2.gz PDNHCJVNFVQKCZ-FPOVZHCZSA-N 2 0 340.536 4.353 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCC[NH2+]1)c1ccc(C(F)(F)F)cc1 ZINC000415114449 1023448960 /nfs/dbraw/zinc/44/89/60/1023448960.db2.gz XTPASHBJPWWOON-BVPBIZIASA-N 2 0 340.433 4.319 20 0 EIADRP C[C@@H](C[N@H+](C)C[C@H]1CCC[NH+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500078110 1023491170 /nfs/dbraw/zinc/49/11/70/1023491170.db2.gz ZUTLUDNOUHBORZ-GJZGRUSLSA-N 2 0 328.422 4.083 20 0 EIADRP CCCC[N@H+](CCCN1CC[NH+](C(C)C)CC1)[C@H](C)c1ccccc1 ZINC000500126505 1023520582 /nfs/dbraw/zinc/52/05/82/1023520582.db2.gz ARRAKNZKPFDWMK-OAQYLSRUSA-N 2 0 345.575 4.266 20 0 EIADRP [NH3+][C@H]1CCO[C@H](C2CC[NH+](Cc3cccc(C4CCCC4)c3)CC2)C1 ZINC000656786180 1023525718 /nfs/dbraw/zinc/52/57/18/1023525718.db2.gz LWBYXUAVPOHDKZ-VXKWHMMOSA-N 2 0 342.527 4.063 20 0 EIADRP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)C1 ZINC000684370479 1023544934 /nfs/dbraw/zinc/54/49/34/1023544934.db2.gz VLQINWURUKZIDY-IOMROCGXSA-N 2 0 330.516 4.108 20 0 EIADRP C[C@@H]1OCC[C@H]1[NH2+][C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000549261832 1023583802 /nfs/dbraw/zinc/58/38/02/1023583802.db2.gz PKNWWFYWKOILJI-JFYUTPNLSA-N 2 0 348.918 4.021 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H](C)c1cnc(C)s1 ZINC000090403136 1023621048 /nfs/dbraw/zinc/62/10/48/1023621048.db2.gz JOLNPHZWJYPDMN-HNNXBMFYSA-N 2 0 347.528 4.023 20 0 EIADRP CC[NH+](CC)Cc1cc(OC)ccc1NCCC[N@@H+]1CCCC[C@@H]1C ZINC001167753920 1023636273 /nfs/dbraw/zinc/63/62/73/1023636273.db2.gz MNUVOSBNUYFTQS-SFHVURJKSA-N 2 0 347.547 4.213 20 0 EIADRP COCc1cc([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)ccc1OC ZINC000157937548 1023712593 /nfs/dbraw/zinc/71/25/93/1023712593.db2.gz HTLGHNLSZZZISO-MSOLQXFVSA-N 2 0 348.531 4.004 20 0 EIADRP CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1N[C@@H]1C[C@H]([NH3+])c2ccccc21 ZINC000390625715 1023735838 /nfs/dbraw/zinc/73/58/38/1023735838.db2.gz HXFSLUXDESUTEZ-BDTNDASRSA-N 2 0 349.522 4.022 20 0 EIADRP C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)c1ccc(Br)cc1 ZINC000020143208 1023739289 /nfs/dbraw/zinc/73/92/89/1023739289.db2.gz QOHNXXJVLGHNMF-GFCCVEGCSA-N 2 0 339.321 4.409 20 0 EIADRP c1cncc([C@@H]2CCC[C@H]([NH2+]C[C@H]3CCC[N@@H+]3C3CCCCC3)C2)c1 ZINC000500377307 1023765453 /nfs/dbraw/zinc/76/54/53/1023765453.db2.gz NZERMFBRINYJGQ-KAGYGMCKSA-N 2 0 341.543 4.495 20 0 EIADRP Cc1ncsc1C[NH+]1CC[C@H]2C[N@H+](CCCC(C)C)C[C@H]2CC1 ZINC001279520796 1023817208 /nfs/dbraw/zinc/81/72/08/1023817208.db2.gz FOCNRQZWBVMYRA-HDICACEKSA-N 2 0 335.561 4.032 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000500426889 1023822443 /nfs/dbraw/zinc/82/24/43/1023822443.db2.gz HEAJOVMDEXPFDW-SBHAEUEKSA-N 2 0 329.532 4.065 20 0 EIADRP CC[C@@H](CC(F)F)C[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C)s2)C1 ZINC000660496225 1023868873 /nfs/dbraw/zinc/86/88/73/1023868873.db2.gz FSTHSQXEIAAZCJ-HOTGVXAUSA-N 2 0 344.515 4.492 20 0 EIADRP CC(C)CCOc1ccc(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)cc1 ZINC000510541111 1024010052 /nfs/dbraw/zinc/01/00/52/1024010052.db2.gz ZEXDRIDAKWXHSM-SFHVURJKSA-N 2 0 327.472 4.214 20 0 EIADRP c1ccc(CSCC[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000430768290 1024021530 /nfs/dbraw/zinc/02/15/30/1024021530.db2.gz YODNPWGZJBPNBL-OAQYLSRUSA-N 2 0 340.536 4.032 20 0 EIADRP CCC1(C[NH2+][C@H](C)C2CCOCC2)CC[NH+](Cc2ccccc2)CC1 ZINC000537939777 1024059516 /nfs/dbraw/zinc/05/95/16/1024059516.db2.gz FBRAHUUEAWGCAB-LJQANCHMSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@@H](NC1CC[NH+](C2CCC2)CC1)c1ccc(-c2ccccc2)cn1 ZINC000651688372 1024208421 /nfs/dbraw/zinc/20/84/21/1024208421.db2.gz IMBIHSKYJIGWFO-QGZVFWFLSA-N 2 0 335.495 4.416 20 0 EIADRP Cc1cc(C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)ccc1Br ZINC000091467462 1024272230 /nfs/dbraw/zinc/27/22/30/1024272230.db2.gz FPXZYTRBMZDYIS-UHFFFAOYSA-N 2 0 339.321 4.156 20 0 EIADRP COc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCC[N@H+](CC(C)C)C2)cc1OC ZINC000090586755 1024445619 /nfs/dbraw/zinc/44/56/19/1024445619.db2.gz JFAXXFWUQAMPBR-MSOLQXFVSA-N 2 0 348.531 4.031 20 0 EIADRP Cc1noc(C)c1[C@H](C)C[NH2+][C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000090764496 1024469904 /nfs/dbraw/zinc/46/99/04/1024469904.db2.gz MTGXYVBRGLUJAF-JXXFODFXSA-N 2 0 341.499 4.038 20 0 EIADRP Fc1cc2c(c(F)c1)CC[C@H]2[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000684556846 1024657018 /nfs/dbraw/zinc/65/70/18/1024657018.db2.gz CRAJJJLTJLUNBK-HRAATJIYSA-N 2 0 342.433 4.064 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2cnc(-c3cccs3)s2)CC1 ZINC000092381210 1024800492 /nfs/dbraw/zinc/80/04/92/1024800492.db2.gz FRPSSBFAOHGTRV-UHFFFAOYSA-N 2 0 335.542 4.035 20 0 EIADRP Fc1ccc(/C=C\C[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1F ZINC000511926890 1024805453 /nfs/dbraw/zinc/80/54/53/1024805453.db2.gz MYQKHBSMGNFSCB-UTCJRWHESA-N 2 0 334.454 4.222 20 0 EIADRP COC1CCC(CC[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000548485645 1024838505 /nfs/dbraw/zinc/83/85/05/1024838505.db2.gz ASZZJZHNAJOVFY-KCUKBOBISA-N 2 0 344.543 4.082 20 0 EIADRP Cc1cc(F)ccc1C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000548488850 1024852004 /nfs/dbraw/zinc/85/20/04/1024852004.db2.gz FFYJFESXJUOHQT-UHFFFAOYSA-N 2 0 341.474 4.268 20 0 EIADRP COc1ccc2ccccc2c1C[NH+]1CCC(C[N@H+](C)C(C)C)CC1 ZINC000535811343 1024958325 /nfs/dbraw/zinc/95/83/25/1024958325.db2.gz HXVIBDJWNPPVMM-UHFFFAOYSA-N 2 0 340.511 4.401 20 0 EIADRP c1ccc2sc([C@H]3CCC[N@H+]3Cc3cccc4c3CC[NH2+]C4)nc2c1 ZINC000662257471 1025005636 /nfs/dbraw/zinc/00/56/36/1025005636.db2.gz CYCAZAZITDKTLI-LJQANCHMSA-N 2 0 349.503 4.279 20 0 EIADRP Cc1ccsc1[C@@H](C)[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000165176229 1025030857 /nfs/dbraw/zinc/03/08/57/1025030857.db2.gz IQNMLSPDBXWKPD-MRXNPFEDSA-N 2 0 332.513 4.238 20 0 EIADRP c1c(C2CC[NH+](CC3CCCCCC3)CC2)n[nH]c1C1CC[NH2+]CC1 ZINC000662326920 1025079720 /nfs/dbraw/zinc/07/97/20/1025079720.db2.gz HEQAPHCFDZUPSV-UHFFFAOYSA-N 2 0 344.547 4.027 20 0 EIADRP Clc1ccc2c(c1Cl)OCCC[C@@H]2[NH2+]CCCn1ccnc1 ZINC000151126747 1025264587 /nfs/dbraw/zinc/26/45/87/1025264587.db2.gz URNAYTCKQQXJRB-AWEZNQCLSA-N 2 0 340.254 4.084 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1)c1cc2ccncc2s1 ZINC000663463801 1025391116 /nfs/dbraw/zinc/39/11/16/1025391116.db2.gz BRZVAFHGHKPBGD-GDBMZVCRSA-N 2 0 329.513 4.069 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)C1 ZINC000663466309 1025392357 /nfs/dbraw/zinc/39/23/57/1025392357.db2.gz QWSPOIUYEAHDQO-PWRODBHTSA-N 2 0 341.543 4.128 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000519138843 1025523801 /nfs/dbraw/zinc/52/38/01/1025523801.db2.gz CQRACFAFEZBJSZ-KCXAZCMYSA-N 2 0 345.487 4.044 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(OCc2ccccc2)CC1 ZINC001167824175 1025571356 /nfs/dbraw/zinc/57/13/56/1025571356.db2.gz CLBCORSVWYINKU-LJQANCHMSA-N 2 0 332.532 4.178 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@@H](Oc2cccc(OC)c2)C1 ZINC001167824726 1025585396 /nfs/dbraw/zinc/58/53/96/1025585396.db2.gz FZDOOYYTJGQFCV-GHTZIAJQSA-N 2 0 348.531 4.049 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)n1c2ccc(C)cc2c2c1CC[NH2+]C2 ZINC001167826161 1025618591 /nfs/dbraw/zinc/61/85/91/1025618591.db2.gz NOPXOPKDEXIAHR-KRWDZBQOSA-N 2 0 327.516 4.278 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@H+](Cc1ccccc1)C1CCOCC1 ZINC001167826581 1025624661 /nfs/dbraw/zinc/62/46/61/1025624661.db2.gz QRYDAXUKWXVBOP-IBGZPJMESA-N 2 0 332.532 4.178 20 0 EIADRP C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)o1 ZINC000066973466 1025625170 /nfs/dbraw/zinc/62/51/70/1025625170.db2.gz YNZCPCWBIXTZNS-JXFKEZNVSA-N 2 0 342.483 4.023 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OC(C)(C)C)cc2)CC1 ZINC000156899126 1025720250 /nfs/dbraw/zinc/72/02/50/1025720250.db2.gz LLVBLDOIXNHRTQ-KRWDZBQOSA-N 2 0 348.531 4.015 20 0 EIADRP Clc1ccc(C2(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)cc1 ZINC001167966296 1025735252 /nfs/dbraw/zinc/73/52/52/1025735252.db2.gz SUWCTVCSXYZKDU-IHWFROFDSA-N 2 0 344.930 4.367 20 0 EIADRP COCc1csc(C[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)c1 ZINC000657297843 1025768424 /nfs/dbraw/zinc/76/84/24/1025768424.db2.gz OXCAQSYNJWIXPP-UHFFFAOYSA-N 2 0 344.524 4.170 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@H]1c1cccc(C(=O)OC)c1 ZINC001167834084 1025810698 /nfs/dbraw/zinc/81/06/98/1025810698.db2.gz HLINSFRWUMWWCZ-XLIONFOSSA-N 2 0 346.515 4.121 20 0 EIADRP Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000663598591 1025833867 /nfs/dbraw/zinc/83/38/67/1025833867.db2.gz XETBMLFWKIUUBR-OAHLLOKOSA-N 2 0 327.472 4.128 20 0 EIADRP CC[C@@H]1C[C@@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)CO1 ZINC000657304318 1025838291 /nfs/dbraw/zinc/83/82/91/1025838291.db2.gz YKRJZRDOGBWOPC-NHCUHLMSSA-N 2 0 338.495 4.072 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCO[C@@](C)(c2ccc(C)cc2)C1 ZINC001167837435 1025848029 /nfs/dbraw/zinc/84/80/29/1025848029.db2.gz KBKWXNQPJWVJCD-PZJWPPBQSA-N 2 0 332.532 4.053 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH+]1CCC(Oc2ccccc2OC)CC1 ZINC001167839521 1025850050 /nfs/dbraw/zinc/85/00/50/1025850050.db2.gz YVQIECRLWKTCEY-GOSISDBHSA-N 2 0 348.531 4.049 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(c2ccccc2OC)CC1 ZINC001167839514 1025851725 /nfs/dbraw/zinc/85/17/25/1025851725.db2.gz YQRFQSCWODGAFV-SFHVURJKSA-N 2 0 332.532 4.385 20 0 EIADRP C[C@H]1C[N@H+](CCC[NH2+][C@@H](c2ccccc2)C2CCCC2)CCCO1 ZINC000432404668 1025871254 /nfs/dbraw/zinc/87/12/54/1025871254.db2.gz FFCPEKVNRQKPJN-RXVVDRJESA-N 2 0 330.516 4.008 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)n1nc(C2CC[NH2+]CC2)c2ccccc21 ZINC001167840733 1025872878 /nfs/dbraw/zinc/87/28/78/1025872878.db2.gz IAJGMYMIVKSMMC-QGZVFWFLSA-N 2 0 342.531 4.186 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCC[C@H](C)C1)c1cncc(F)c1 ZINC000157645352 1025895481 /nfs/dbraw/zinc/89/54/81/1025895481.db2.gz KVWHHRTWTGHHJN-IRXDYDNUSA-N 2 0 341.474 4.303 20 0 EIADRP C[C@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1cccc(OC(F)F)c1 ZINC000319783454 1025923743 /nfs/dbraw/zinc/92/37/43/1025923743.db2.gz GVGYZWIQMXHPNC-GJZGRUSLSA-N 2 0 326.431 4.203 20 0 EIADRP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1cccc(OC(F)F)c1 ZINC000319783458 1025925908 /nfs/dbraw/zinc/92/59/08/1025925908.db2.gz GVGYZWIQMXHPNC-LSDHHAIUSA-N 2 0 326.431 4.203 20 0 EIADRP Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]CCC1CC[NH+](C)CC1 ZINC000431335522 1025938031 /nfs/dbraw/zinc/93/80/31/1025938031.db2.gz ZXGUIYFHCWFNFE-GOSISDBHSA-N 2 0 336.907 4.184 20 0 EIADRP Fc1cccc2c1CCC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167975192 1026218236 /nfs/dbraw/zinc/21/82/36/1026218236.db2.gz LGPDVTPZXAAVKM-KVSYXXJQSA-N 2 0 328.475 4.198 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]Cc2cccc(OC3CC3)c2F)c1 ZINC000657348402 1026221112 /nfs/dbraw/zinc/22/11/12/1026221112.db2.gz UWWOWBGHXKPVPQ-UHFFFAOYSA-N 2 0 342.458 4.108 20 0 EIADRP CCC[N@H+](C)C[C@H]1CC[NH+](CCCSc2ccccc2Cl)C1 ZINC001167558783 1026385083 /nfs/dbraw/zinc/38/50/83/1026385083.db2.gz SPVODWVLHROCBW-MRXNPFEDSA-N 2 0 340.964 4.486 20 0 EIADRP c1ccc([C@H](C[NH2+]Cc2cccc3cnccc32)N2CCCC2)cc1 ZINC000236662463 1026661477 /nfs/dbraw/zinc/66/14/77/1026661477.db2.gz LNMSGAZFNCNVTJ-QFIPXVFZSA-N 2 0 331.463 4.162 20 0 EIADRP c1cc(C[N@@H+]2CC[C@H](c3ccncc3)C2)cc(C[NH+]2CCCCC2)c1 ZINC000563363149 1026673415 /nfs/dbraw/zinc/67/34/15/1026673415.db2.gz HNTQOUVNFTVUPY-QFIPXVFZSA-N 2 0 335.495 4.057 20 0 EIADRP CCC[NH+]1CCN(c2ccccc2C[N@H+](C)[C@H](C)c2ccco2)CC1 ZINC000507212863 1026704867 /nfs/dbraw/zinc/70/48/67/1026704867.db2.gz PCIVDWDOLLKTDB-GOSISDBHSA-N 2 0 341.499 4.005 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@]1(C)Cc1ccccc1 ZINC000344938352 1026714727 /nfs/dbraw/zinc/71/47/27/1026714727.db2.gz UFVHNTWIVIBYLZ-JOCHJYFZSA-N 2 0 346.478 4.173 20 0 EIADRP C[N@@H+]1CCC[C@H]1CC[NH+]1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000511148326 1026750542 /nfs/dbraw/zinc/75/05/42/1026750542.db2.gz XOKFCLNKPINFAN-WMZOPIPTSA-N 2 0 340.433 4.369 20 0 EIADRP [NH3+][C@@H]1C[C@@H](NC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)c2ccccc21 ZINC000261629372 1026756611 /nfs/dbraw/zinc/75/66/11/1026756611.db2.gz VTYNMQHREBQRHS-UEVCKROQSA-N 2 0 349.522 4.023 20 0 EIADRP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000507443721 1026794888 /nfs/dbraw/zinc/79/48/88/1026794888.db2.gz NFGRFAPXHQGHHJ-CYBMUJFWSA-N 2 0 329.315 4.246 20 0 EIADRP CCCOc1ccc(C[NH2+][C@H]2CCN(C)[C@H](c3ccccc3)C2)cc1 ZINC000582560159 1026805441 /nfs/dbraw/zinc/80/54/41/1026805441.db2.gz CWFFKGAYMQIECV-UNMCSNQZSA-N 2 0 338.495 4.401 20 0 EIADRP CCCOc1ccc(C[NH2+][C@H]2CCN(C)[C@@H](c3ccccc3)C2)cc1 ZINC000582560158 1026806176 /nfs/dbraw/zinc/80/61/76/1026806176.db2.gz CWFFKGAYMQIECV-RBBKRZOGSA-N 2 0 338.495 4.401 20 0 EIADRP CCC1(C[NH2+][C@@H](C)[C@H]2CCCOC2)CC[NH+](Cc2ccccc2)CC1 ZINC000507472645 1026806787 /nfs/dbraw/zinc/80/67/87/1026806787.db2.gz RKXUIMNHSFQEMC-FPOVZHCZSA-N 2 0 344.543 4.084 20 0 EIADRP CCc1cccnc1[C@@H](C)[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000507520672 1026826839 /nfs/dbraw/zinc/82/68/39/1026826839.db2.gz SFKXZDIRAAPHOB-QGZVFWFLSA-N 2 0 325.500 4.335 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CCc2noc3ccccc32)CN1Cc1ccccc1 ZINC000657534857 1026990012 /nfs/dbraw/zinc/99/00/12/1026990012.db2.gz UPMSTOWQYFOGAD-GOSISDBHSA-N 2 0 349.478 4.013 20 0 EIADRP c1ccc2c(c1)cccc2CSCC[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000166278065 1027248112 /nfs/dbraw/zinc/24/81/12/1027248112.db2.gz PSHBKXVINBBEIP-WOJBJXKFSA-N 2 0 340.536 4.289 20 0 EIADRP Cc1ccc(C[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1Cl ZINC000657612964 1027290058 /nfs/dbraw/zinc/29/00/58/1027290058.db2.gz HAINVPQTQNMVDD-UHFFFAOYSA-N 2 0 343.902 4.045 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C2(c3ccc(N)cc3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168038992 1027314454 /nfs/dbraw/zinc/31/44/54/1027314454.db2.gz ASHSFRIRTNOHRH-OPMZPASUSA-N 2 0 349.522 4.289 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccccc1OC(F)(F)F ZINC000520206070 1027315125 /nfs/dbraw/zinc/31/51/25/1027315125.db2.gz VFAQCTYPZOWCSD-HNNXBMFYSA-N 2 0 344.421 4.329 20 0 EIADRP COc1ccc(CNC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)c(F)c1 ZINC000520238418 1027341761 /nfs/dbraw/zinc/34/17/61/1027341761.db2.gz IONOEQAHQIQFGQ-DNVCBOLYSA-N 2 0 348.487 4.069 20 0 EIADRP COc1ccc(CNC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)c(F)c1 ZINC000520238417 1027344439 /nfs/dbraw/zinc/34/44/39/1027344439.db2.gz IONOEQAHQIQFGQ-BEFAXECRSA-N 2 0 348.487 4.069 20 0 EIADRP C[C@@H](c1ccccn1)[NH+]1CCC2(CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000342874066 1027394436 /nfs/dbraw/zinc/39/44/36/1027394436.db2.gz KOAZBINNCWOIMV-IBGZPJMESA-N 2 0 335.495 4.131 20 0 EIADRP C/C(=C/c1ccccc1)C[NH2+]CCc1nccn1Cc1ccccc1 ZINC000102421206 1027442879 /nfs/dbraw/zinc/44/28/79/1027442879.db2.gz BQVUDKLVAYUCHI-MNDPQUGUSA-N 2 0 331.463 4.167 20 0 EIADRP c1ccc(CC[C@H]2CCC[C@@H]2[NH2+]C2CC([NH+]3CCCCC3)C2)cc1 ZINC000475548676 1027584179 /nfs/dbraw/zinc/58/41/79/1027584179.db2.gz NHTDLEWMVKHETP-XBCQCDMNSA-N 2 0 326.528 4.394 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@H]2CCOc3c(Cl)cccc32)ccc1F ZINC000120902813 1027614191 /nfs/dbraw/zinc/61/41/91/1027614191.db2.gz SIKPOFTWCRJQJP-SFHVURJKSA-N 2 0 348.849 4.154 20 0 EIADRP C[C@@H]([NH2+][C@H](CC(F)(F)F)c1ccc(F)cc1)C1CC[NH+](C)CC1 ZINC000090969072 1027639533 /nfs/dbraw/zinc/63/95/33/1027639533.db2.gz JFRPPHGBXUNQKX-MLGOLLRUSA-N 2 0 332.385 4.139 20 0 EIADRP COc1ccc([C@@H](C)[C@@H](C)[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)cc1OC ZINC000474877575 1027726129 /nfs/dbraw/zinc/72/61/29/1027726129.db2.gz KKDCIOPJBOOVKF-LSDHHAIUSA-N 2 0 348.531 4.095 20 0 EIADRP Fc1ccc(C2CC[NH+](C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CC2)cc1 ZINC001167995489 1027772446 /nfs/dbraw/zinc/77/24/46/1027772446.db2.gz HJBCJZQYCCMBHM-CBQGHPETSA-N 2 0 342.502 4.411 20 0 EIADRP Fc1ccccc1C1CC[NH+](C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167995641 1027791816 /nfs/dbraw/zinc/79/18/16/1027791816.db2.gz MDXDNCOOAWSMCF-YOFSQIOKSA-N 2 0 342.502 4.411 20 0 EIADRP C[C@@H]([NH2+]C[C@@]1(C)CCCN1Cc1ccccc1)C1CCSCC1 ZINC000474923261 1027802623 /nfs/dbraw/zinc/80/26/23/1027802623.db2.gz PIJRFVJUILHMQI-YLJYHZDGSA-N 2 0 332.557 4.162 20 0 EIADRP COc1ccc([C@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)cc1 ZINC001167995749 1027808263 /nfs/dbraw/zinc/80/82/63/1027808263.db2.gz PORMFVUPRTVAIQ-XQXKNUKBSA-N 2 0 340.511 4.238 20 0 EIADRP CC[N@H+](C)C[C@H]1CCN(c2cc[nH+]c3cc(C(F)(F)F)ccc32)C1 ZINC000125653942 1027881085 /nfs/dbraw/zinc/88/10/85/1027881085.db2.gz MADRLPMPTDQWFC-CYBMUJFWSA-N 2 0 337.389 4.032 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000443971987 1028216557 /nfs/dbraw/zinc/21/65/57/1028216557.db2.gz LPYFMWKWSQELHG-KRWDZBQOSA-N 2 0 328.431 4.049 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCC1CC[NH+](CCSC(F)(F)F)CC1 ZINC001167658850 1028225481 /nfs/dbraw/zinc/22/54/81/1028225481.db2.gz LKTRRRWTRJOXHM-AWEZNQCLSA-N 2 0 338.483 4.216 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCCCC[C@H]1c1ccncc1 ZINC000346188943 1028294236 /nfs/dbraw/zinc/29/42/36/1028294236.db2.gz YNRUWINBPZBRQB-NRFANRHFSA-N 2 0 347.466 4.088 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@@H](c3cccnc3)C3CCC3)C2)cc1 ZINC000280995063 1028314525 /nfs/dbraw/zinc/31/45/25/1028314525.db2.gz XETVQZPTLZQUOZ-NFBKMPQASA-N 2 0 349.522 4.077 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1CN1CC[C@@H]1c1ccc(Cl)cc1 ZINC000346194046 1028319234 /nfs/dbraw/zinc/31/92/34/1028319234.db2.gz XOKNLNMVBZUERY-LJQANCHMSA-N 2 0 338.842 4.176 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1cnn(C)c1 ZINC000125057114 1028339764 /nfs/dbraw/zinc/33/97/64/1028339764.db2.gz YATRPMKLTNETNF-OAQYLSRUSA-N 2 0 340.515 4.037 20 0 EIADRP CC1(C)CC[C@@H]([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)C1 ZINC000346548781 1028508873 /nfs/dbraw/zinc/50/88/73/1028508873.db2.gz DUHNXEOCVYCBMS-HXUWFJFHSA-N 2 0 344.543 4.226 20 0 EIADRP COCc1ccc(C[NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)o1 ZINC000126287460 1028572794 /nfs/dbraw/zinc/57/27/94/1028572794.db2.gz ICZSYQDOVDMADE-UHFFFAOYSA-N 2 0 342.483 4.092 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1)c1cncc(F)c1 ZINC000157019963 1028900756 /nfs/dbraw/zinc/90/07/56/1028900756.db2.gz CFJDLHKCFCWJRW-KRWDZBQOSA-N 2 0 341.474 4.303 20 0 EIADRP COCCC[C@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(F)cc1 ZINC000281880210 1028907431 /nfs/dbraw/zinc/90/74/31/1028907431.db2.gz GDUYVVSNFBZWAZ-NRFANRHFSA-N 2 0 344.474 4.145 20 0 EIADRP Cc1cc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)ccc1F ZINC000384105389 1028914059 /nfs/dbraw/zinc/91/40/59/1028914059.db2.gz XDIZUUDMUHNYBD-HXUWFJFHSA-N 2 0 326.459 4.136 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)[C@H](C)c1nc2ccccc2s1 ZINC000650753086 1029147374 /nfs/dbraw/zinc/14/73/74/1029147374.db2.gz GJMMVIMYLKZWAJ-QWHCGFSZSA-N 2 0 343.471 4.176 20 0 EIADRP COCCC1CC[NH+]([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168053294 1029157857 /nfs/dbraw/zinc/15/78/57/1029157857.db2.gz NCYBYCFUKZHZEF-HATOLVCRSA-N 2 0 344.543 4.177 20 0 EIADRP C[C@@H]1CC([N@@H+]2CC[C@H](c3cccnc3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168053366 1029159495 /nfs/dbraw/zinc/15/94/95/1029159495.db2.gz OEOPTENAXNXTEN-KNKQGSTJSA-N 2 0 349.522 4.313 20 0 EIADRP Cc1nc(-c2cc([C@@H](C)[NH2+]CCC3CC[NH2+]CC3)cs2)cs1 ZINC000650764316 1029280078 /nfs/dbraw/zinc/28/00/78/1029280078.db2.gz WAYZQQKAMFSXRE-GFCCVEGCSA-N 2 0 335.542 4.220 20 0 EIADRP c1nc(C2CCCC2)sc1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000657812808 1029471946 /nfs/dbraw/zinc/47/19/46/1029471946.db2.gz FNLLVXHIAGZNHT-UHFFFAOYSA-N 2 0 333.545 4.012 20 0 EIADRP C[C@@H](CCc1ccccc1F)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475279233 1029486583 /nfs/dbraw/zinc/48/65/83/1029486583.db2.gz XQWNNSPMYHPYEI-ICSRJNTNSA-N 2 0 340.486 4.259 20 0 EIADRP C[C@H](CCc1cccc(F)c1)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475272453 1029488796 /nfs/dbraw/zinc/48/87/96/1029488796.db2.gz BSHNFTOZHSPGPY-NQIIRXRSSA-N 2 0 340.486 4.259 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC000475281263 1029495770 /nfs/dbraw/zinc/49/57/70/1029495770.db2.gz PWKAYWQMCYOSJW-FUHWJXTLSA-N 2 0 336.470 4.312 20 0 EIADRP COc1ccc(C2CCC([NH2+]CC3CC[NH+](C4CC4)CC3)CC2)cc1 ZINC000446886949 1029631338 /nfs/dbraw/zinc/63/13/38/1029631338.db2.gz MEBAGHWNZQQNMS-UHFFFAOYSA-N 2 0 342.527 4.185 20 0 EIADRP C[C@@H]1CC([NH+]2CCC(C(F)F)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168065800 1029711773 /nfs/dbraw/zinc/71/17/73/1029711773.db2.gz YGDUHVALNFCFQE-HZPDHXFCSA-N 2 0 336.470 4.405 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657839223 1029739856 /nfs/dbraw/zinc/73/98/56/1029739856.db2.gz PLEIZMJYRLJVNW-BZUAXINKSA-N 2 0 339.474 4.428 20 0 EIADRP CC[C@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000657840124 1029755516 /nfs/dbraw/zinc/75/55/16/1029755516.db2.gz MGTNJZLLVVUNOZ-KZNAEPCWSA-N 2 0 340.433 4.243 20 0 EIADRP Cc1nc(C)c(C)c(NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)n1 ZINC000301697309 1029790755 /nfs/dbraw/zinc/79/07/55/1029790755.db2.gz QMVNBUGGXYRWDK-IHWFROFDSA-N 2 0 336.483 4.009 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cccc3cnccc32)C1 ZINC000248390307 1029807196 /nfs/dbraw/zinc/80/71/96/1029807196.db2.gz TWOMJUITTMQFJZ-OALUTQOASA-N 2 0 337.511 4.321 20 0 EIADRP COCc1ccc(C[NH2+][C@@H](C)c2ccc(-n3ccnc3C)cc2)cc1 ZINC000086279079 1029838776 /nfs/dbraw/zinc/83/87/76/1029838776.db2.gz SIYNOSDVGNRFOH-INIZCTEOSA-N 2 0 335.451 4.178 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)C(C)(C)C(F)F ZINC000657861636 1029867856 /nfs/dbraw/zinc/86/78/56/1029867856.db2.gz VGHIXEHTWSIOCD-ZDUSSCGKSA-N 2 0 330.488 4.230 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccc(F)cn1 ZINC000092720865 1029932033 /nfs/dbraw/zinc/93/20/33/1029932033.db2.gz IKVFNZDNGHBANK-MRXNPFEDSA-N 2 0 327.447 4.057 20 0 EIADRP Cc1ccoc1C[NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1 ZINC000525694531 1029933963 /nfs/dbraw/zinc/93/39/63/1029933963.db2.gz ACCDUGKHDOTXJL-IAGOWNOFSA-N 2 0 326.484 4.356 20 0 EIADRP CC[N@H+](Cc1cn(-c2cc[nH+]cc2)nc1C)[C@@H](C)Cc1ccsc1 ZINC000428476862 1029941935 /nfs/dbraw/zinc/94/19/35/1029941935.db2.gz YSVGCEXMWMLHSZ-HNNXBMFYSA-N 2 0 340.496 4.090 20 0 EIADRP Cc1nc2c(s1)[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C3CCC3)C1)CCC2 ZINC000183187756 1029993505 /nfs/dbraw/zinc/99/35/05/1029993505.db2.gz DHDHOQQKKDMISZ-LXZKKBNFSA-N 2 0 333.545 4.072 20 0 EIADRP C[C@@H](c1ccccc1Br)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000138374882 1030040167 /nfs/dbraw/zinc/04/01/67/1030040167.db2.gz HMPTYAZUMMFDQL-AWEZNQCLSA-N 2 0 339.321 4.174 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccc(Br)cc1 ZINC000171126483 1030063187 /nfs/dbraw/zinc/06/31/87/1030063187.db2.gz SFDNCCNUXFRNOY-AWEZNQCLSA-N 2 0 347.300 4.362 20 0 EIADRP C[C@H]([NH2+]CCC[N@H+](C)C1CCCCC1)c1ccc(-n2ccnc2)cc1 ZINC000392266006 1030079085 /nfs/dbraw/zinc/07/90/85/1030079085.db2.gz OGZVTOQPYLRTEK-SFHVURJKSA-N 2 0 340.515 4.178 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447574079 1030153964 /nfs/dbraw/zinc/15/39/64/1030153964.db2.gz UMGXUDXZUWEHMC-OAQYLSRUSA-N 2 0 342.527 4.488 20 0 EIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)C(C)(C)C(F)F ZINC000657879100 1030163161 /nfs/dbraw/zinc/16/31/61/1030163161.db2.gz JOCHOVNGLQUEEO-CCNLRDMRSA-N 2 0 336.470 4.451 20 0 EIADRP Cc1cc(Cl)cc2c1OCCC[C@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447557117 1030167500 /nfs/dbraw/zinc/16/75/00/1030167500.db2.gz ISOMKJRCZLXZII-LJQANCHMSA-N 2 0 348.918 4.326 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CC2(c3c(Cl)cccc3Cl)CCC2)CC[N@@H+]1C ZINC000447563831 1030171656 /nfs/dbraw/zinc/17/16/56/1030171656.db2.gz FWOBGAWISJEGNH-KBPBESRZSA-N 2 0 341.326 4.487 20 0 EIADRP C[C@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH3+])(c2ccccc2)CC1 ZINC001168165126 1030235912 /nfs/dbraw/zinc/23/59/12/1030235912.db2.gz BZOREHMXUNSYDD-MRXNPFEDSA-N 2 0 328.887 4.221 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+](CC)CC)cc1)c1ccc(F)cn1 ZINC000392486411 1030301889 /nfs/dbraw/zinc/30/18/89/1030301889.db2.gz LRPFODGOBCTDBP-IBGZPJMESA-N 2 0 329.463 4.303 20 0 EIADRP C[C@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(OCc2ccccc2)cc1 ZINC000392263986 1030331561 /nfs/dbraw/zinc/33/15/61/1030331561.db2.gz LDILFFDDEFKRBG-SFHVURJKSA-N 2 0 336.479 4.178 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000708566640 1030385486 /nfs/dbraw/zinc/38/54/86/1030385486.db2.gz RHWMYNHBYYZAGA-UEXGIBASSA-N 2 0 340.486 4.114 20 0 EIADRP CSCC1CCC([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000708573363 1030399026 /nfs/dbraw/zinc/39/90/26/1030399026.db2.gz IWENDDZNZUOBEN-MAKTXDPSSA-N 2 0 346.584 4.266 20 0 EIADRP C[NH2+]C[C@H]1CCC[N@H+](Cc2c(OC(C)C)ccc3ccccc32)C1 ZINC000470013469 1030549598 /nfs/dbraw/zinc/54/95/98/1030549598.db2.gz OCTKQXGMSMZBHJ-QGZVFWFLSA-N 2 0 326.484 4.058 20 0 EIADRP CSc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000685614012 1030564499 /nfs/dbraw/zinc/56/44/99/1030564499.db2.gz QVPIVBZHOLVEDB-UHFFFAOYSA-N 2 0 346.565 4.472 20 0 EIADRP COc1ccc([C@@H](C)[C@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1 ZINC000527232755 1030588111 /nfs/dbraw/zinc/58/81/11/1030588111.db2.gz NULCXCHTZSDAFQ-ROUUACIJSA-N 2 0 344.543 4.431 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CC[C@H](c3ccccc3)C2)cc1 ZINC000527348871 1030637873 /nfs/dbraw/zinc/63/78/73/1030637873.db2.gz BSHMWCCXLXWXSK-SFTDATJTSA-N 2 0 338.495 4.053 20 0 EIADRP COc1ccc(-c2csc(C[NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4C)c2)cc1 ZINC000192926352 1030718901 /nfs/dbraw/zinc/71/89/01/1030718901.db2.gz FGCDVRODKPODCH-AYHJJNSGSA-N 2 0 342.508 4.139 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CC(C)(C)Cc2occc21 ZINC000122315836 1030801643 /nfs/dbraw/zinc/80/16/43/1030801643.db2.gz KSPLBZSQAMBPLD-GOSISDBHSA-N 2 0 342.483 4.023 20 0 EIADRP CC(C)CC[C@H]1CCC[C@@H]1[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658066587 1030811767 /nfs/dbraw/zinc/81/17/67/1030811767.db2.gz CCHCYMFHMSNLIH-CTNGQTDRSA-N 2 0 336.564 4.072 20 0 EIADRP C[C@H](C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)c1ccccn1 ZINC000658067631 1030813729 /nfs/dbraw/zinc/81/37/29/1030813729.db2.gz XCNRKCOFTRETBV-QGZVFWFLSA-N 2 0 331.548 4.454 20 0 EIADRP C[C@H]1CC[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)c2ccccc21 ZINC000658069994 1030815191 /nfs/dbraw/zinc/81/51/91/1030815191.db2.gz SNSVLWCDJBTGDT-HTAPYJJXSA-N 2 0 342.527 4.106 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c(C)c1 ZINC000658164481 1030861203 /nfs/dbraw/zinc/86/12/03/1030861203.db2.gz DRAQXNMPOQRMNO-IBGZPJMESA-N 2 0 337.511 4.261 20 0 EIADRP c1cc(C[NH+]2CCC(C[NH2+][C@H]3CCCCC34CCCC4)CC2)ccn1 ZINC000658166937 1030863086 /nfs/dbraw/zinc/86/30/86/1030863086.db2.gz WNTJBSKAFKIORV-NRFANRHFSA-N 2 0 341.543 4.386 20 0 EIADRP C[C@H](CCC1CCCC1)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658167383 1030863846 /nfs/dbraw/zinc/86/38/46/1030863846.db2.gz RUGUVGFALIQGJH-GOSISDBHSA-N 2 0 329.532 4.242 20 0 EIADRP C[C@@H](CCC1CCCC1)[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000658167387 1030864207 /nfs/dbraw/zinc/86/42/07/1030864207.db2.gz RUGUVGFALIQGJH-SFHVURJKSA-N 2 0 329.532 4.242 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)CCC2 ZINC000658168739 1030865459 /nfs/dbraw/zinc/86/54/59/1030865459.db2.gz YFOPRLCRJFSGNX-HSZRJFAPSA-N 2 0 349.522 4.269 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccncc1 ZINC000658319279 1030980037 /nfs/dbraw/zinc/98/00/37/1030980037.db2.gz YWDQQYRVJZEESP-VXKWHMMOSA-N 2 0 349.522 4.425 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cncs1 ZINC000658319533 1030981998 /nfs/dbraw/zinc/98/19/98/1030981998.db2.gz FYEQZJAXPOQXRL-WMZOPIPTSA-N 2 0 341.524 4.096 20 0 EIADRP C[C@H](NC(C)(C)C[NH2+][C@H]1CCc2cccnc2CC1)c1ccccc1 ZINC000421840422 1031036853 /nfs/dbraw/zinc/03/68/53/1031036853.db2.gz ZBOFTRMWXUKRCM-PXNSSMCTSA-N 2 0 337.511 4.048 20 0 EIADRP c1cc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)n(C2CCCC2)n1 ZINC000449037451 1031372722 /nfs/dbraw/zinc/37/27/22/1031372722.db2.gz NHNJRKTUAULWJV-UHFFFAOYSA-N 2 0 344.547 4.086 20 0 EIADRP Clc1ccc(C[C@@H]2CCC[C@@H]2[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000449090468 1031450370 /nfs/dbraw/zinc/45/03/70/1031450370.db2.gz NDBVQOMVJODAMD-NBYUQASBSA-N 2 0 332.919 4.268 20 0 EIADRP CC1CC[NH+](Cc2cccc(C[NH2+][C@H]3CCOC4(CCC4)C3)c2)CC1 ZINC000449131948 1031467131 /nfs/dbraw/zinc/46/71/31/1031467131.db2.gz QOFXZKGEPRFCRJ-NRFANRHFSA-N 2 0 342.527 4.110 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2CCCOc3ccc(Cl)cc32)c1 ZINC000123593813 1031474606 /nfs/dbraw/zinc/47/46/06/1031474606.db2.gz NGWMBAWUGBVZKD-LJQANCHMSA-N 2 0 344.886 4.405 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H]2CCc3ccccc32)cc1 ZINC000531682619 1031475395 /nfs/dbraw/zinc/47/53/95/1031475395.db2.gz CACPGNURIVCCSQ-JOCHJYFZSA-N 2 0 338.495 4.184 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)C1 ZINC000584479620 1031503387 /nfs/dbraw/zinc/50/33/87/1031503387.db2.gz AVAGVMNGRUWTBC-IARIHHJXSA-N 2 0 326.406 4.201 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC(C)(C)c1ccc(F)cc1Cl ZINC000531718366 1031518419 /nfs/dbraw/zinc/51/84/19/1031518419.db2.gz WNYOXBZCPLLBQG-PBFPGSCMSA-N 2 0 326.887 4.075 20 0 EIADRP COc1cccc(-c2ccc(C[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@@H]3C)cc2)c1 ZINC000531725045 1031527384 /nfs/dbraw/zinc/52/73/84/1031527384.db2.gz GKOGDKVOLNRRMT-PNLZDCPESA-N 2 0 338.495 4.181 20 0 EIADRP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@@H](C)CCCc1cccnc1 ZINC000453064823 1031529578 /nfs/dbraw/zinc/52/95/78/1031529578.db2.gz ULNHPGWHKRLYKE-IBGZPJMESA-N 2 0 339.527 4.423 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ncc(-c2ccccc2)n1C ZINC000453065786 1031530408 /nfs/dbraw/zinc/53/04/08/1031530408.db2.gz XTHVYVBKSVMXIM-QZTJIDSGSA-N 2 0 342.531 4.248 20 0 EIADRP C[C@H](CCCc1cccnc1)[NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000453070100 1031535894 /nfs/dbraw/zinc/53/58/94/1031535894.db2.gz ZVUABRYSDLFWLO-HSALFYBXSA-N 2 0 331.548 4.141 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@@H](C[NH2+]C2CCC(OC3CCCC3)CC2)C1 ZINC000449211845 1031538299 /nfs/dbraw/zinc/53/82/99/1031538299.db2.gz SDJPSPAUVODCQJ-JSOIOWGOSA-N 2 0 336.564 4.214 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccsc1 ZINC000453098956 1031557148 /nfs/dbraw/zinc/55/71/48/1031557148.db2.gz VSSKPJJTBPCVAG-IBGZPJMESA-N 2 0 332.513 4.320 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CCCc2nccs2)CC1 ZINC000449226593 1031558476 /nfs/dbraw/zinc/55/84/76/1031558476.db2.gz RMQPKXZHTZWLSW-UHFFFAOYSA-N 2 0 337.577 4.345 20 0 EIADRP C[C@@H]([NH2+]C1CCC(OC2CCCC2)CC1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000449231327 1031560949 /nfs/dbraw/zinc/56/09/49/1031560949.db2.gz DGUQYEXVNBSWJX-MVLYANGWSA-N 2 0 348.575 4.499 20 0 EIADRP C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2OCC[NH+](C)C)c2sccc21 ZINC000453094777 1031590868 /nfs/dbraw/zinc/59/08/68/1031590868.db2.gz SZDKZRZDUTVPIA-CRAIPNDOSA-N 2 0 344.524 4.417 20 0 EIADRP CCOC1CC(CC[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)C1 ZINC000449278241 1031592167 /nfs/dbraw/zinc/59/21/67/1031592167.db2.gz IDUXUBJCRMUGCS-UHFFFAOYSA-N 2 0 338.580 4.460 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CCCC2CCOCC2)CC1 ZINC000449355242 1031676379 /nfs/dbraw/zinc/67/63/79/1031676379.db2.gz XGWLGWVENKEFCJ-UHFFFAOYSA-N 2 0 338.580 4.462 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21)C(F)(F)F ZINC000453207613 1031719781 /nfs/dbraw/zinc/71/97/81/1031719781.db2.gz WMJQURBRAGWVNG-BZZMCLGOSA-N 2 0 340.433 4.218 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCCCC1(F)F)c1cccc(OCC[NH+](C)C)c1 ZINC000453251806 1031774955 /nfs/dbraw/zinc/77/49/55/1031774955.db2.gz NUSHDUTZOWCCQU-DOTOQJQBSA-N 2 0 340.458 4.103 20 0 EIADRP CC(C)[C@@H]1C[C@H](C[NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)CCO1 ZINC000449494498 1031785888 /nfs/dbraw/zinc/78/58/88/1031785888.db2.gz NIUDHAQZSWKYAZ-QCFAMHMHSA-N 2 0 336.564 4.070 20 0 EIADRP COc1ccc([C@H](Cc2ccc(F)cc2)[NH2+]CCCC[NH+](C)C)cc1 ZINC000531962914 1031882120 /nfs/dbraw/zinc/88/21/20/1031882120.db2.gz IBEPXVVIHRGLSJ-NRFANRHFSA-N 2 0 344.474 4.050 20 0 EIADRP COc1cc(C)c([C@@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cc1OC ZINC000531973687 1031912534 /nfs/dbraw/zinc/91/25/34/1031912534.db2.gz UYHGIVQOJZXZSX-GOSISDBHSA-N 2 0 348.531 4.319 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1OC ZINC000453370689 1031914775 /nfs/dbraw/zinc/91/47/75/1031914775.db2.gz VTVKOZWXAGBSGS-UXDRXVOSSA-N 2 0 346.515 4.150 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000453373229 1031920069 /nfs/dbraw/zinc/92/00/69/1031920069.db2.gz WZFLZFSHYSQAGU-KVMCETHSSA-N 2 0 328.500 4.239 20 0 EIADRP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(OC(F)(F)F)cc1 ZINC000453375538 1031921676 /nfs/dbraw/zinc/92/16/76/1031921676.db2.gz XWAYQRWTFORZLG-BTFYYFJDSA-N 2 0 342.405 4.251 20 0 EIADRP C[N@H+](CCCC[NH2+][C@H](c1ccccc1)c1ccc(F)cc1)C1CC1 ZINC000453395881 1031965758 /nfs/dbraw/zinc/96/57/58/1031965758.db2.gz ICQZHQWDPUSDOO-OAQYLSRUSA-N 2 0 326.459 4.379 20 0 EIADRP Cc1cc(Br)c(C[NH2+]C(C)(C)CCC[NH+](C)C)s1 ZINC000453596273 1032020628 /nfs/dbraw/zinc/02/06/28/1032020628.db2.gz NINDNFRLGDKVSO-UHFFFAOYSA-N 2 0 333.339 4.029 20 0 EIADRP C[N@@H+]1CCC[C@]2(CC[NH+](CCCOc3ccc4ccccc4c3)C2)C1 ZINC000549840768 1033294782 /nfs/dbraw/zinc/29/47/82/1033294782.db2.gz OBDIBUULPMCUHS-QFIPXVFZSA-N 2 0 338.495 4.026 20 0 EIADRP C[C@H](c1ccncc1)[NH+](C)CCCCC[N@@H+](C)[C@H](C)c1ccncc1 ZINC000246086453 1033344881 /nfs/dbraw/zinc/34/48/81/1033344881.db2.gz IGWFOTRNYNMTDV-RTBURBONSA-N 2 0 340.515 4.333 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+][C@@H]3CC[C@@H]4C[NH2+]C[C@H]4C3)cc2)cs1 ZINC000647788790 1033969920 /nfs/dbraw/zinc/96/99/20/1033969920.db2.gz RDLAVKRPIHMEJQ-JGNHQEBTSA-N 2 0 341.524 4.157 20 0 EIADRP CO[C@]1(C)CCC[N@H+](Cc2ccc(C[NH+]3CCCCC3)cc2)CC1 ZINC000411662142 1034026580 /nfs/dbraw/zinc/02/65/80/1034026580.db2.gz FDJSJOFDESFNAT-OAQYLSRUSA-N 2 0 330.516 4.064 20 0 EIADRP Cc1ccc2c(CC[NH2+]C3CC[NH+](C4CCCCC4)CC3)c[nH]c2c1 ZINC000513046614 1034364116 /nfs/dbraw/zinc/36/41/16/1034364116.db2.gz MOVDSJAPPYJUAL-UHFFFAOYSA-N 2 0 339.527 4.406 20 0 EIADRP Clc1ccc([C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@@H]3C2)c2ccsc2)cc1 ZINC000647792137 1034375033 /nfs/dbraw/zinc/37/50/33/1034375033.db2.gz UDTQRXHUULPDIO-WQCNXYOZSA-N 2 0 346.927 4.469 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]Cc2ccc(-c3ccc(OC)cc3)s2)[C@@H](C)C1 ZINC000469080850 1034808465 /nfs/dbraw/zinc/80/84/65/1034808465.db2.gz XWTLAPFCYMXLAL-HNAYVOBHSA-N 2 0 344.524 4.244 20 0 EIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]CCc1ccc(F)c(F)c1 ZINC000469100082 1034899105 /nfs/dbraw/zinc/89/91/05/1034899105.db2.gz ZCIOFOBBMOZGDQ-IERDGZPVSA-N 2 0 344.449 4.008 20 0 EIADRP CCc1ncc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)s1 ZINC000513500614 1034998836 /nfs/dbraw/zinc/99/88/36/1034998836.db2.gz NMKKXRFBVBDCFV-WMZOPIPTSA-N 2 0 343.540 4.096 20 0 EIADRP CCc1cc(OC)ccc1C[NH2+]Cc1ccc(C[NH+](CC)CC)cc1 ZINC000501484826 1035454398 /nfs/dbraw/zinc/45/43/98/1035454398.db2.gz XSTUSOHYKKTTDM-UHFFFAOYSA-N 2 0 340.511 4.389 20 0 EIADRP Cc1nc([C@H](C)N2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)oc1-c1ccc(Cl)cc1 ZINC000420315681 1035509756 /nfs/dbraw/zinc/50/97/56/1035509756.db2.gz XEPDGSZYZDPIMX-GUDXXQAFSA-N 2 0 345.874 4.034 20 0 EIADRP Cc1nc([C@H](C)[N@@H+]2CCC[C@H](CC[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420319115 1035515357 /nfs/dbraw/zinc/51/53/57/1035515357.db2.gz XDBOUXCEDPHRDM-LSDHHAIUSA-N 2 0 347.890 4.425 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CCC[C@@H]([C@@H]2CC[NH2+]C2)C1 ZINC000420327448 1035532452 /nfs/dbraw/zinc/53/24/52/1035532452.db2.gz LDPLGFBKDPYTHZ-FVQBIDKESA-N 2 0 326.406 4.088 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2cccc(C(F)(F)F)c2)CC1 ZINC000501780377 1035588634 /nfs/dbraw/zinc/58/86/34/1035588634.db2.gz ZURXLHIKJDCVIJ-UHFFFAOYSA-N 2 0 328.422 4.259 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H](c2cccc(F)c2)c2cccc(Cl)c2)CC1 ZINC000491002459 1035753914 /nfs/dbraw/zinc/75/39/14/1035753914.db2.gz BSFZDWRFXWXIPE-FQEVSTJZSA-N 2 0 346.877 4.500 20 0 EIADRP C[C@@H](C[NH2+]C1CCC([NH+](C)C)CC1)c1cccc(Br)c1 ZINC000421371533 1036317671 /nfs/dbraw/zinc/31/76/71/1036317671.db2.gz KVLPENRGBFLGIS-IGEOTXOUSA-N 2 0 339.321 4.015 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2cc(Cl)ccc2OCC2CC2)CC1 ZINC000421373074 1036322520 /nfs/dbraw/zinc/32/25/20/1036322520.db2.gz MIRGMTJIPJRZTR-UHFFFAOYSA-N 2 0 336.907 4.091 20 0 EIADRP COc1ccc(C2CCC([NH2+]C3CCC([NH+](C)C)CC3)CC2)cc1 ZINC000421378477 1036328021 /nfs/dbraw/zinc/32/80/21/1036328021.db2.gz VHAVSRMEOZKSCR-UHFFFAOYSA-N 2 0 330.516 4.184 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC12CCSCC2)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000421385522 1036344929 /nfs/dbraw/zinc/34/49/29/1036344929.db2.gz QAJVINTXXXXKEL-SXLOBPIMSA-N 2 0 344.568 4.020 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1cnn(C2CCCC2)c1 ZINC000502688543 1036483199 /nfs/dbraw/zinc/48/31/99/1036483199.db2.gz WYVSZTGKEQXXIC-QRVBRYPASA-N 2 0 346.563 4.407 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccc4[nH]cnc4c3)cc2)C1 ZINC000589641137 1036857454 /nfs/dbraw/zinc/85/74/54/1036857454.db2.gz UFVIBJFZODGOME-QGZVFWFLSA-N 2 0 348.494 4.085 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H](C)c2ccc(Oc3cccnc3)cc2)CC1 ZINC000489801448 1036860144 /nfs/dbraw/zinc/86/01/44/1036860144.db2.gz ORYRBHAHWYTOOU-QGZVFWFLSA-N 2 0 339.483 4.399 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CCC[C@H](c2ccccc2)C1 ZINC000486859844 1036873608 /nfs/dbraw/zinc/87/36/08/1036873608.db2.gz QBXPWKDDYOIRTI-FPOVZHCZSA-N 2 0 346.478 4.392 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+]C[C@H]3C[C@H]3c3ccccc3)CC2)c1 ZINC000503035706 1036882338 /nfs/dbraw/zinc/88/23/38/1036882338.db2.gz PDNHCJVNFVQKCZ-CTNGQTDRSA-N 2 0 340.536 4.353 20 0 EIADRP CCOc1ccc(C[NH2+]Cc2ccc(C[NH+](CC)CC)cc2)cc1F ZINC000486929536 1036894317 /nfs/dbraw/zinc/89/43/17/1036894317.db2.gz AXFOAASPYYXQGY-UHFFFAOYSA-N 2 0 344.474 4.356 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CC2CCC(F)(F)CC2)CC1 ZINC000503079220 1036895236 /nfs/dbraw/zinc/89/52/36/1036895236.db2.gz UXCGXKKSNLMOQA-CRAIPNDOSA-N 2 0 328.491 4.445 20 0 EIADRP CCOc1ccc(C[NH2+]Cc2cccc(C[NH+](CC)CC)c2)cc1F ZINC000486933353 1036896515 /nfs/dbraw/zinc/89/65/15/1036896515.db2.gz WZJUBZIIFVVUAS-UHFFFAOYSA-N 2 0 344.474 4.356 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]C/C=C\c1ccncc1 ZINC000486944396 1036898598 /nfs/dbraw/zinc/89/85/98/1036898598.db2.gz PMNQBJUKCOWGFW-MONCILHSSA-N 2 0 335.495 4.259 20 0 EIADRP CC1CC[NH+](Cc2ccc(C[NH2+]C/C=C\c3ccncc3)cc2)CC1 ZINC000486935193 1036900540 /nfs/dbraw/zinc/90/05/40/1036900540.db2.gz ZKEYAQNACLFCQJ-IHWYPQMZSA-N 2 0 335.495 4.117 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3[C@H]4Cc5cc(F)ccc5[C@@H]34)CC2)C1 ZINC000668743537 1037005755 /nfs/dbraw/zinc/00/57/55/1037005755.db2.gz IOBRILCZTPAQAX-VSMKJTFCSA-N 2 0 342.502 4.097 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(C[NH2+][C@@H]2CCC23CCOCC3)cc1 ZINC000669698639 1037016738 /nfs/dbraw/zinc/01/67/38/1037016738.db2.gz VPQYIEAEZUJZCL-WIYYLYMNSA-N 2 0 342.527 4.110 20 0 EIADRP Fc1ccc2c(c1)CC[C@@H]([NH2+]CC1CC[NH+](CC3CCCC3)CC1)C2 ZINC001168415912 1037097808 /nfs/dbraw/zinc/09/78/08/1037097808.db2.gz SNUXUIHMKPRFNR-JOCHJYFZSA-N 2 0 344.518 4.175 20 0 EIADRP CCOc1c(Cl)cccc1C[NH2+]Cc1cccc(C[N@H+](C)CC)c1 ZINC000487311892 1037120720 /nfs/dbraw/zinc/12/07/20/1037120720.db2.gz QRXUZRLYCQAKPV-UHFFFAOYSA-N 2 0 346.902 4.480 20 0 EIADRP CCOCCC1(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CCC1 ZINC000272711312 1037276595 /nfs/dbraw/zinc/27/65/95/1037276595.db2.gz COBHMDYZFCHCLH-PZJWPPBQSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNC(=[NH2+])Nc2ccccc2)cc1 ZINC000057887896 1037288270 /nfs/dbraw/zinc/28/82/70/1037288270.db2.gz BROGNUAVQBKVEE-QGZVFWFLSA-N 2 0 336.483 4.197 20 0 EIADRP C[NH+](C)CC[C@@H]([NH2+]Cc1ccc(OCC(F)(F)F)cc1)C(C)(C)C ZINC000604771097 1037510950 /nfs/dbraw/zinc/51/09/50/1037510950.db2.gz VQRYHKUBSBOORM-MRXNPFEDSA-N 2 0 346.437 4.084 20 0 EIADRP C[C@H](c1ccccc1)[NH+]1CCC(Nc2cc[nH+]c3ccccc23)CC1 ZINC000604757455 1037525913 /nfs/dbraw/zinc/52/59/13/1037525913.db2.gz FJLXEQVKYODRRL-QGZVFWFLSA-N 2 0 331.463 4.294 20 0 EIADRP CC(C)(C)[C@H]1C[C@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)CS1 ZINC000488467721 1037616340 /nfs/dbraw/zinc/61/63/40/1037616340.db2.gz WYKVWFNQDWJZQI-RBUKOAKNSA-N 2 0 332.557 4.292 20 0 EIADRP C[NH2+]CCC1CC[NH+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)CC1 ZINC000414660108 1037703777 /nfs/dbraw/zinc/70/37/77/1037703777.db2.gz MFBAKSANUJXLQT-CQSZACIVSA-N 2 0 328.422 4.130 20 0 EIADRP c1nc([C@@H]2CCC[N@@H+](CCSC3CCCCC3)C2)n2c1CCCC2 ZINC000503371263 1037714057 /nfs/dbraw/zinc/71/40/57/1037714057.db2.gz HTTVEYFEGLBFRG-QGZVFWFLSA-N 2 0 347.572 4.465 20 0 EIADRP c1ccc2c(c1)OC1(CCCCC1)C[C@@H]2N[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000513787593 1037714812 /nfs/dbraw/zinc/71/48/12/1037714812.db2.gz BLMGIIJUIBCZBP-BJLQDIEVSA-N 2 0 340.511 4.430 20 0 EIADRP C[C@H]([NH3+])C1CC[NH+](Cc2ccc(-c3nc4ccccc4s3)o2)CC1 ZINC000414673638 1037777390 /nfs/dbraw/zinc/77/73/90/1037777390.db2.gz PBHILGGOELGSMC-ZDUSSCGKSA-N 2 0 341.480 4.116 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H]2CC3(CCCCC3)Oc3ccccc32)CC1 ZINC000513790162 1037788360 /nfs/dbraw/zinc/78/83/60/1037788360.db2.gz SVMFRYNDEOVROO-IBGZPJMESA-N 2 0 328.500 4.145 20 0 EIADRP c1ccc2cc(C[NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)ccc2c1 ZINC000422700358 1037802448 /nfs/dbraw/zinc/80/24/48/1037802448.db2.gz GRGCRDWYRJSXEZ-FYYLOGMGSA-N 2 0 344.458 4.185 20 0 EIADRP [NH3+][C@@H]1C[C@H](NCc2ccccc2C[NH+]2CCCCCC2)c2ccccc21 ZINC000422711486 1037804889 /nfs/dbraw/zinc/80/48/89/1037804889.db2.gz NESNNARUBIRPFE-PKTZIBPZSA-N 2 0 349.522 4.297 20 0 EIADRP CCCC[C@H]([NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)c1ccc(OC)cc1 ZINC000422718076 1037813380 /nfs/dbraw/zinc/81/33/80/1037813380.db2.gz WLQZOFYBIUDOGF-KKSFZXQISA-N 2 0 341.499 4.439 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](C)CC(C)(C)c1ccccc1 ZINC000422716078 1037813693 /nfs/dbraw/zinc/81/36/93/1037813693.db2.gz MWNOALAHMZTHCX-HOTGVXAUSA-N 2 0 325.500 4.256 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000422720119 1037814248 /nfs/dbraw/zinc/81/42/48/1037814248.db2.gz ZREYLJSCTYAMJU-APMMTJHUSA-N 2 0 342.458 4.325 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000422727198 1037818693 /nfs/dbraw/zinc/81/86/93/1037818693.db2.gz BOUTVQFYNKJAIE-GOSISDBHSA-N 3 0 331.548 4.058 20 0 EIADRP Cc1cccc([C@H](C)[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1C ZINC000422747216 1037824319 /nfs/dbraw/zinc/82/43/19/1037824319.db2.gz PMTVXJZNPUUBNG-XJABCFGWSA-N 2 0 336.479 4.210 20 0 EIADRP COc1cccc([C@H]([NH2+][C@@H](C)CCC[NH3+])c2ccccc2Cl)c1 ZINC000422776016 1037831044 /nfs/dbraw/zinc/83/10/44/1037831044.db2.gz BVQRLMXSYKEFPU-LIRRHRJNSA-N 2 0 332.875 4.155 20 0 EIADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](c1cccs1)c1ccc(C(C)C)cc1 ZINC000422785205 1037833270 /nfs/dbraw/zinc/83/32/70/1037833270.db2.gz MWOZTSTVDIHXGJ-AZUAARDMSA-N 2 0 346.540 4.304 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]CC1(c2cccc(C(F)(F)F)c2)CCC1 ZINC000422779654 1037833342 /nfs/dbraw/zinc/83/33/42/1037833342.db2.gz GFMBXZDPDNTMBX-CQSZACIVSA-N 2 0 328.422 4.234 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](c1ccc(F)cc1)C(C)(C)C ZINC000422788107 1037835196 /nfs/dbraw/zinc/83/51/96/1037835196.db2.gz VESUDZWLVGQYRW-IFXJQAMLSA-N 2 0 329.463 4.426 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1 ZINC000422814977 1037839483 /nfs/dbraw/zinc/83/94/83/1037839483.db2.gz WSFMKLDNQPTGHX-JKSUJKDBSA-N 2 0 346.478 4.323 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+]Cc1ccccc1COc1ccccc1Cl ZINC000422790796 1037840206 /nfs/dbraw/zinc/84/02/06/1037840206.db2.gz XZMZLRHKTLQKST-OAHLLOKOSA-N 2 0 332.875 4.136 20 0 EIADRP Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)cc1C ZINC000422792022 1037840298 /nfs/dbraw/zinc/84/02/98/1037840298.db2.gz ZABIKJFVKNZBET-UCNVEGJOSA-N 2 0 336.479 4.210 20 0 EIADRP CC[C@@H](C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)Oc1ccccc1Cl ZINC000422838306 1037843707 /nfs/dbraw/zinc/84/37/07/1037843707.db2.gz ODKPFABYASNVQU-BBRMVZONSA-N 2 0 347.890 4.010 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CCCC[C@@H]2[NH2+]C2CC[NH2+]CC2)cc1 ZINC000422831611 1037843985 /nfs/dbraw/zinc/84/39/85/1037843985.db2.gz WVLAQMDYYBJLML-IRXDYDNUSA-N 2 0 326.406 4.073 20 0 EIADRP C[C@H](CC[NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1 ZINC000422857706 1037846233 /nfs/dbraw/zinc/84/62/33/1037846233.db2.gz YTTZJFQTFDFTHI-ZNLUXHQJSA-N 2 0 336.479 4.026 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@@H](C)c1cccc(NC(=O)c2ccccc2)c1 ZINC000422866235 1037848128 /nfs/dbraw/zinc/84/81/28/1037848128.db2.gz PWSANVQUJRYODH-IRXDYDNUSA-N 2 0 339.483 4.107 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@H](C)CCCC[NH3+])ccc1OC1CCCC1 ZINC000422875742 1037850367 /nfs/dbraw/zinc/85/03/67/1037850367.db2.gz DBBNHFNYRYXUKH-CVEARBPZSA-N 2 0 334.504 4.185 20 0 EIADRP CCC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc(C(F)(F)F)c1 ZINC000422900685 1037863206 /nfs/dbraw/zinc/86/32/06/1037863206.db2.gz ARFXTPYSKMBYRG-FCLJQHQZSA-N 2 0 326.406 4.419 20 0 EIADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1cccc2ccccc21 ZINC000422902442 1037863859 /nfs/dbraw/zinc/86/38/59/1037863859.db2.gz DDWXNGVEVSZUDS-REWPJTCUSA-N 2 0 348.490 4.273 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCSc2ccc(Br)cc21 ZINC000422949538 1037885961 /nfs/dbraw/zinc/88/59/61/1037885961.db2.gz VODREJSFYBYJEC-BXUZGUMPSA-N 2 0 343.334 4.093 20 0 EIADRP CC[C@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1cccs1 ZINC000422950050 1037887482 /nfs/dbraw/zinc/88/74/82/1037887482.db2.gz VBLGWQYNYIYOFX-TXPKVOOTSA-N 2 0 328.481 4.045 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]C[C@H](C)Sc1ccc(Br)cc1 ZINC000422957087 1037889078 /nfs/dbraw/zinc/88/90/78/1037889078.db2.gz MLESWLMNSIINMP-STQMWFEESA-N 2 0 345.350 4.037 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)CCCC[NH3+])Sc1ccc(Br)cc1 ZINC000422957086 1037889411 /nfs/dbraw/zinc/88/94/11/1037889411.db2.gz MLESWLMNSIINMP-QWHCGFSZSA-N 2 0 345.350 4.037 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c2ccccc21 ZINC000422993379 1037891372 /nfs/dbraw/zinc/89/13/72/1037891372.db2.gz SRTPNRIENPSQBF-MIZPHKNDSA-N 2 0 348.490 4.255 20 0 EIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000423006233 1037900134 /nfs/dbraw/zinc/90/01/34/1037900134.db2.gz USEAIOWJEKYFRU-RMVXJAJNSA-N 2 0 330.516 4.055 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@@H](C)Cc1ccc(C(C)C)cc1 ZINC000423023356 1037906781 /nfs/dbraw/zinc/90/67/81/1037906781.db2.gz JQFXIDNPUIWJBM-JKSUJKDBSA-N 2 0 325.500 4.254 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C1CCC(c2ccc(F)cc2)CC1 ZINC000423033546 1037915901 /nfs/dbraw/zinc/91/59/01/1037915901.db2.gz OPVHVJQEVMJDEO-ZCGYKAAXSA-N 2 0 341.474 4.365 20 0 EIADRP C[C@@H]([NH2+]CC1(c2ccc(Cl)cc2Cl)CCCC1)C1C[NH2+]C1 ZINC000423031698 1037917377 /nfs/dbraw/zinc/91/73/77/1037917377.db2.gz XQTFVVFRLFLOQA-GFCCVEGCSA-N 2 0 327.299 4.003 20 0 EIADRP c1ccc(N2CCCCC2)c(C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000423040660 1037919660 /nfs/dbraw/zinc/91/96/60/1037919660.db2.gz HTJHYFARKXGJJQ-PWRODBHTSA-N 2 0 341.543 4.077 20 0 EIADRP Cc1oc2ccccc2c1C[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423044936 1037924218 /nfs/dbraw/zinc/92/42/18/1037924218.db2.gz CHQWWVLWCQWXAJ-UGKGYDQZSA-N 2 0 348.446 4.087 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+]CC1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000423072924 1037932493 /nfs/dbraw/zinc/93/24/93/1037932493.db2.gz QPMKRZYKCQCZDE-NSHDSACASA-N 2 0 334.813 4.107 20 0 EIADRP [NH3+][C@H]1C[C@H]([NH2+]CC2(CCOCc3ccccc3)CC2)c2ccccc21 ZINC000423054528 1037942054 /nfs/dbraw/zinc/94/20/54/1037942054.db2.gz USCMEPFRRCXFHK-SFTDATJTSA-N 2 0 336.479 4.108 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CC1CCC(F)(F)CC1 ZINC000503864812 1037950573 /nfs/dbraw/zinc/95/05/73/1037950573.db2.gz WHCQLJBKTOXWRK-QFBILLFUSA-N 2 0 336.470 4.312 20 0 EIADRP [NH3+]CC1CCC([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000423099881 1037958475 /nfs/dbraw/zinc/95/84/75/1037958475.db2.gz UNFOWBYTUHNAPW-ZDKDBBBSSA-N 2 0 326.406 4.059 20 0 EIADRP [NH3+]CC1CCC([NH2+][C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)CC1 ZINC000423100498 1037958682 /nfs/dbraw/zinc/95/86/82/1037958682.db2.gz MWGCIMPLXDDYND-VIVVKUNJSA-N 2 0 327.299 4.347 20 0 EIADRP c1ccc([C@H](C[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C2CC2)cc1 ZINC000423121287 1037966539 /nfs/dbraw/zinc/96/65/39/1037966539.db2.gz APESPKYRCWDBOE-QZNHQXDQSA-N 2 0 348.490 4.026 20 0 EIADRP Cc1ccccc1[C@H]1C[C@H]([NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C1 ZINC000423106922 1037983845 /nfs/dbraw/zinc/98/38/45/1037983845.db2.gz RSEYBTJBHDUMIO-SVVKQXANSA-N 2 0 348.490 4.087 20 0 EIADRP C[C@H](C[C@H](C)[NH3+])[NH2+][C@@H](Cc1ccccc1)c1nc2ccccc2s1 ZINC000423161422 1038021053 /nfs/dbraw/zinc/02/10/53/1038021053.db2.gz NUOPIZKFCWISOP-DAYGRLMNSA-N 2 0 339.508 4.296 20 0 EIADRP C/C(=C/c1ccccc1C(F)(F)F)C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000503941011 1038031781 /nfs/dbraw/zinc/03/17/81/1038031781.db2.gz DWBPAGQLOBYYGB-QINSGFPZSA-N 2 0 340.433 4.382 20 0 EIADRP CC(C)=CCOc1ccc(CC[C@H](C)[NH2+]C2CCC([NH3+])CC2)cc1 ZINC000423208792 1038039249 /nfs/dbraw/zinc/03/92/49/1038039249.db2.gz DWQJNWITMOBQJF-KKXNLOMOSA-N 2 0 330.516 4.212 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1)c1ccc2ccccc2c1OC(F)F ZINC000423216133 1038063121 /nfs/dbraw/zinc/06/31/21/1038063121.db2.gz NYYKJWSDNNZZFI-OFQRWUPVSA-N 2 0 348.437 4.480 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423263421 1038072317 /nfs/dbraw/zinc/07/23/17/1038072317.db2.gz XFLRDWJTDSTGOA-GOEBONIOSA-N 2 0 329.513 4.159 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423264075 1038073172 /nfs/dbraw/zinc/07/31/72/1038073172.db2.gz XZTCDZXTPGJXNB-RDJZCZTQSA-N 2 0 343.540 4.467 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423260848 1038074039 /nfs/dbraw/zinc/07/40/39/1038074039.db2.gz QXNIENKYUAQWJZ-MAUKXSAKSA-N 2 0 343.540 4.083 20 0 EIADRP Fc1ccc([C@@H]([NH2+]CC[C@@H]2CC[NH2+]C2)c2ccc(Cl)cc2)cc1 ZINC000423247925 1038081580 /nfs/dbraw/zinc/08/15/80/1038081580.db2.gz MFCPOLOIOWTMRF-LIRRHRJNSA-N 2 0 332.850 4.158 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423257445 1038086156 /nfs/dbraw/zinc/08/61/56/1038086156.db2.gz JKCRYWZIPAHXKD-ZFWWWQNUSA-N 2 0 347.503 4.298 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423283596 1038087763 /nfs/dbraw/zinc/08/77/63/1038087763.db2.gz XNUHACNUVYSSNT-IRXDYDNUSA-N 2 0 327.516 4.203 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]CC[C@@H]2CCC[NH2+]C2)cc1 ZINC000423259635 1038089226 /nfs/dbraw/zinc/08/92/26/1038089226.db2.gz OQBMLFQVXIELIM-MSOLQXFVSA-N 2 0 338.495 4.403 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@H]1CCCC[C@@H]1C[NH3+] ZINC000423283850 1038091387 /nfs/dbraw/zinc/09/13/87/1038091387.db2.gz WKSUOUXPACOURO-QGTPRVQTSA-N 2 0 343.540 4.210 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(Br)s2)cc1 ZINC000423290404 1038091429 /nfs/dbraw/zinc/09/14/29/1038091429.db2.gz CUVGXUFCAPPGSY-QWRGUYRKSA-N 2 0 339.302 4.381 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1OCC ZINC000423291938 1038098160 /nfs/dbraw/zinc/09/81/60/1038098160.db2.gz KQCPOTCHIVOTSD-HOTGVXAUSA-N 2 0 342.483 4.355 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccccc1OC(F)(F)F ZINC000423292200 1038098220 /nfs/dbraw/zinc/09/82/20/1038098220.db2.gz LYMZQYLXUJBWKD-QWHCGFSZSA-N 2 0 338.373 4.456 20 0 EIADRP NC[C@@H]([NH2+]C1CCC(c2cccc(C(F)(F)F)c2)CC1)C1CC1 ZINC000423276219 1038100732 /nfs/dbraw/zinc/10/07/32/1038100732.db2.gz MTEBAUYJQCVNCC-UAIPMZCESA-N 2 0 326.406 4.059 20 0 EIADRP CC(C)[C@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)c1ccc2[nH]c(=O)oc2c1 ZINC000423295374 1038121531 /nfs/dbraw/zinc/12/15/31/1038121531.db2.gz WWHARKLOLPUNCD-YJYMSZOUSA-N 2 0 339.439 4.040 20 0 EIADRP CC(C)[C@@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)c1ccc2[nH]c(=O)oc2c1 ZINC000423295371 1038123057 /nfs/dbraw/zinc/12/30/57/1038123057.db2.gz WWHARKLOLPUNCD-BFUOFWGJSA-N 2 0 339.439 4.040 20 0 EIADRP C[C@H](C[NH3+])C[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423304355 1038127201 /nfs/dbraw/zinc/12/72/01/1038127201.db2.gz YKPFDRSDZJPIPR-RISCZKNCSA-N 2 0 335.904 4.025 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCOc3c(Cl)cc(C)cc32)C1 ZINC000489585739 1038130560 /nfs/dbraw/zinc/13/05/60/1038130560.db2.gz AXIXHKAHGGQJLD-QAPCUYQASA-N 2 0 336.907 4.184 20 0 EIADRP C[C@H]([NH2+]CC1C[NH2+]C1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 ZINC000423303095 1038131296 /nfs/dbraw/zinc/13/12/96/1038131296.db2.gz KYIFYDOEZSNLLW-NSHDSACASA-N 2 0 340.414 4.304 20 0 EIADRP Cc1cccc(COc2ccc([C@H](C)[NH2+]CC3=CC[NH2+]CC3)cc2)c1 ZINC000423345405 1038136019 /nfs/dbraw/zinc/13/60/19/1038136019.db2.gz NZADKPWSKXRGOV-SFHVURJKSA-N 2 0 336.479 4.144 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NCC1([NH3+])CCC1 ZINC000423323988 1038138482 /nfs/dbraw/zinc/13/84/82/1038138482.db2.gz JVIKBIBXQYIWBQ-LLVKDONJSA-N 2 0 335.904 4.304 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423329051 1038141599 /nfs/dbraw/zinc/14/15/99/1038141599.db2.gz DULPDPXEKBHJIQ-KKSFZXQISA-N 2 0 327.516 4.203 20 0 EIADRP CC1(C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CC[NH2+]CC1 ZINC000423333460 1038146560 /nfs/dbraw/zinc/14/65/60/1038146560.db2.gz PXQSOVRXARLHMF-MRXNPFEDSA-N 2 0 326.406 4.136 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423356627 1038172614 /nfs/dbraw/zinc/17/26/14/1038172614.db2.gz GZEQULFFCRESEQ-RHSMWYFYSA-N 2 0 329.513 4.220 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+][C@H](C)C2)cc1OCCC ZINC000423363549 1038176084 /nfs/dbraw/zinc/17/60/84/1038176084.db2.gz AOKZDUYVNAJPGT-SOLBZPMBSA-N 2 0 334.504 4.055 20 0 EIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@@H]3CCC[C@H]([NH3+])C3)s2)cc1 ZINC000423370197 1038189914 /nfs/dbraw/zinc/18/99/14/1038189914.db2.gz FHXMZZHHMOTRTQ-VBNZEHGJSA-N 2 0 345.512 4.048 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)CC1 ZINC000423421369 1038209883 /nfs/dbraw/zinc/20/98/83/1038209883.db2.gz KIWGWAISBLZQKB-IYARVYRRSA-N 3 0 337.596 4.020 20 0 EIADRP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423404862 1038215542 /nfs/dbraw/zinc/21/55/42/1038215542.db2.gz XVJDMQKCXYFDSN-IBGZPJMESA-N 2 0 342.870 4.255 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000423444687 1038226075 /nfs/dbraw/zinc/22/60/75/1038226075.db2.gz LXLOFJCCFZWHPP-AVRDEDQJSA-N 2 0 349.522 4.045 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](c1ccc(Br)cc1F)C1CC1 ZINC000423447663 1038227851 /nfs/dbraw/zinc/22/78/51/1038227851.db2.gz ZWKPXWXFQOHHDB-ZBEGNZNMSA-N 2 0 343.284 4.146 20 0 EIADRP Cc1ccc(OC(F)F)c([C@@H](C)[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)c1 ZINC000423426979 1038229853 /nfs/dbraw/zinc/22/98/53/1038229853.db2.gz QAJMTQGIMPHRNF-RBSFLKMASA-N 2 0 326.431 4.012 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[C@@H]([NH3+])C2)cc1OC ZINC000423455438 1038237723 /nfs/dbraw/zinc/23/77/23/1038237723.db2.gz FDQXYTBMLOMXPT-LZLYRXPVSA-N 2 0 334.504 4.042 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000423439599 1038239378 /nfs/dbraw/zinc/23/93/78/1038239378.db2.gz SLXCRQYEXIYHNE-BBRMVZONSA-N 2 0 347.503 4.434 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000423465704 1038243610 /nfs/dbraw/zinc/24/36/10/1038243610.db2.gz WTQFSMFAIBIOAD-DOMZBBRYSA-N 2 0 333.476 4.044 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1)c1ccccc1Br ZINC000423470701 1038247179 /nfs/dbraw/zinc/24/71/79/1038247179.db2.gz LTEQLBALCNCOBD-IOASZLSFSA-N 2 0 325.294 4.007 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CCC[C@H]([NH3+])C1)c1cccc(Br)c1 ZINC000423454254 1038255250 /nfs/dbraw/zinc/25/52/50/1038255250.db2.gz BZCMADQJCLKPBP-RCBQFDQVSA-N 2 0 325.294 4.007 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)CCS2 ZINC000423503167 1038258027 /nfs/dbraw/zinc/25/80/27/1038258027.db2.gz FLWHCTGYZJUSLW-OALUTQOASA-N 2 0 342.508 4.302 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CC[C@@H]([NH2+]CCC[C@@H]3CCC[NH2+]3)C2)cc1 ZINC000423487916 1038260636 /nfs/dbraw/zinc/26/06/36/1038260636.db2.gz UUERBYIQAJNGKH-BPQIPLTHSA-N 2 0 340.433 4.463 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H](C[NH3+])C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423493607 1038263600 /nfs/dbraw/zinc/26/36/00/1038263600.db2.gz QHJUENNMIPZETK-OUCADQQQSA-N 2 0 332.435 4.119 20 0 EIADRP Fc1ccccc1-c1nc2c(s1)[C@@H]([NH2+]CCC[NH2+]C1CC1)CCC2 ZINC000423532597 1038266767 /nfs/dbraw/zinc/26/67/67/1038266767.db2.gz VKTQAULIVYRSNX-INIZCTEOSA-N 2 0 345.487 4.058 20 0 EIADRP COc1ccc(Cl)cc1[C@@H](C)[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000423514008 1038269816 /nfs/dbraw/zinc/26/98/16/1038269816.db2.gz WCUSJERTUIECRU-RDTXWAMCSA-N 2 0 332.875 4.479 20 0 EIADRP [NH3+]C[C@H]1CC[C@@H]([NH2+]C2CCC(c3cccc(C(F)(F)F)c3)CC2)C1 ZINC000423513815 1038270819 /nfs/dbraw/zinc/27/08/19/1038270819.db2.gz ROHWGCXWTPVDIY-VDEYCQILSA-N 2 0 340.433 4.449 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@@H]2C1)c1ccc(SCC(F)F)cc1 ZINC000423557449 1038282624 /nfs/dbraw/zinc/28/26/24/1038282624.db2.gz ZRNJQWNIOHXFBH-QCEMKRCNSA-N 2 0 340.483 4.083 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1cc(F)c(Cl)cc1Cl ZINC000423539185 1038284873 /nfs/dbraw/zinc/28/48/73/1038284873.db2.gz HUIBENQUHZHPIH-IRCOFANPSA-N 2 0 331.262 4.171 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+]CCC1=CC[NH2+]CC1 ZINC000423543674 1038288846 /nfs/dbraw/zinc/28/88/46/1038288846.db2.gz VGZDIPVEOSEZSO-HNNXBMFYSA-N 2 0 341.524 4.003 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](Cc2ccncc2)c2cccs2)C1 ZINC000424311947 1038799286 /nfs/dbraw/zinc/79/92/86/1038799286.db2.gz LNZKKMFZBSLTNU-OALUTQOASA-N 2 0 343.540 4.137 20 0 EIADRP CC(C)[C@@H](CCc1ccc(Cl)cc1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000480770560 1038808135 /nfs/dbraw/zinc/80/81/35/1038808135.db2.gz OOVQGMGCPSIRMN-YLJYHZDGSA-N 2 0 334.935 4.371 20 0 EIADRP CC(C)[C@H](CCc1ccc(Cl)cc1)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000480770559 1038808747 /nfs/dbraw/zinc/80/87/47/1038808747.db2.gz OOVQGMGCPSIRMN-XLIONFOSSA-N 2 0 334.935 4.371 20 0 EIADRP CC(C)CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1 ZINC000480775854 1038811830 /nfs/dbraw/zinc/81/18/30/1038811830.db2.gz QPKPYDLFMQXTRH-QZTJIDSGSA-N 2 0 330.516 4.246 20 0 EIADRP CCC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)C1CCCCC1 ZINC000539065071 1038817618 /nfs/dbraw/zinc/81/76/18/1038817618.db2.gz KJWIOUIBIRLRCX-PCCBWWKXSA-N 2 0 336.564 4.093 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cc(F)ccc2F)CC1)CC1CC1 ZINC001168424899 1038844736 /nfs/dbraw/zinc/84/47/36/1038844736.db2.gz YIKSBNYCYRCDGB-UHFFFAOYSA-N 2 0 336.470 4.299 20 0 EIADRP COc1cc([C@H](C)[NH2+]C[C@H](C)C[NH+]2CCCCC2)ccc1SC ZINC000480909938 1038866659 /nfs/dbraw/zinc/86/66/59/1038866659.db2.gz LFLOYWVLXWQJFF-HOTGVXAUSA-N 2 0 336.545 4.190 20 0 EIADRP C[NH+](C)C1CCC([NH+]2CCC(Oc3cccc(Cl)c3)CC2)CC1 ZINC001168323025 1038867470 /nfs/dbraw/zinc/86/74/70/1038867470.db2.gz NJTMUNISQOJASR-UHFFFAOYSA-N 2 0 336.907 4.056 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccnn1C1CCC1 ZINC000924686348 1038873604 /nfs/dbraw/zinc/87/36/04/1038873604.db2.gz RIRRRKPVNDTVEF-FGTMMUONSA-N 2 0 332.536 4.017 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc3cc(OC)ccc3c2)C1 ZINC000481023380 1038958110 /nfs/dbraw/zinc/95/81/10/1038958110.db2.gz NDLRMRVNLVIEHW-IRXDYDNUSA-N 2 0 326.484 4.231 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)Cc1ccccc1F)c1cccc(OCC[NH+](C)C)c1 ZINC000481045401 1038977637 /nfs/dbraw/zinc/97/76/37/1038977637.db2.gz ZWZPJRXBLYNDNA-DLBZAZTESA-N 2 0 344.474 4.048 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CCc3c2ccc(Cl)c3Cl)C1 ZINC000481037767 1038988509 /nfs/dbraw/zinc/98/85/09/1038988509.db2.gz MXZOEKCCSCVWBB-MLGOLLRUSA-N 2 0 327.299 4.302 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)[C@@H]1C[C@H]1c1ccccc1 ZINC000555232557 1039000063 /nfs/dbraw/zinc/00/00/63/1039000063.db2.gz HVPRVHXZAGIKNW-ZXHYAQOVSA-N 2 0 348.534 4.333 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+][C@H]1CCC[NH2+]CC1)c1cccs1 ZINC000643522495 1039037341 /nfs/dbraw/zinc/03/73/41/1039037341.db2.gz NZQCTIKUPYTTMZ-DOTOQJQBSA-N 2 0 334.916 4.417 20 0 EIADRP Cc1ccc(-c2ncc(C[NH2+]Cc3ccc([C@H](C)[NH3+])cc3)s2)o1 ZINC000414808143 1039038154 /nfs/dbraw/zinc/03/81/54/1039038154.db2.gz KITYFWQBGBODLI-ZDUSSCGKSA-N 2 0 327.453 4.021 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@H]1CCc2ccccc21 ZINC000481185240 1039088998 /nfs/dbraw/zinc/08/89/98/1039088998.db2.gz WNSHJXDLVADSTJ-JMUQELJHSA-N 2 0 334.507 4.217 20 0 EIADRP Cc1nc(C(C)C)ccc1C[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000555422768 1039180834 /nfs/dbraw/zinc/18/08/34/1039180834.db2.gz FOGQAIWSMYBRLQ-QFBILLFUSA-N 2 0 329.532 4.256 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+][C@H](C)c3ccc(C)o3)CC2)cc1 ZINC000120689203 1039206996 /nfs/dbraw/zinc/20/69/96/1039206996.db2.gz NQTFBXCFMCRUNP-QGZVFWFLSA-N 2 0 342.483 4.159 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@H](C)C2)c(C)c1OC ZINC000552225101 1039277554 /nfs/dbraw/zinc/27/75/54/1039277554.db2.gz AICKNZZEGWEGDU-WMZOPIPTSA-N 2 0 348.531 4.175 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(-n2ccnc2)cc1)[C@@H]1COc2ccccc21 ZINC000090845072 1039310162 /nfs/dbraw/zinc/31/01/62/1039310162.db2.gz KAPKFWBBRXXMSH-YRNRMSPPSA-N 2 0 333.435 4.088 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCc3c2cccc3F)c1 ZINC000513858977 1039337967 /nfs/dbraw/zinc/33/79/67/1039337967.db2.gz GNHWIQMOWWUXGZ-OAQYLSRUSA-N 2 0 326.459 4.445 20 0 EIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](C[C@H]3CCCC(F)(F)C3)C2)CC1 ZINC000513882639 1039343834 /nfs/dbraw/zinc/34/38/34/1039343834.db2.gz MYLNQFIQCCADMP-ROUUACIJSA-N 2 0 328.491 4.256 20 0 EIADRP CO[C@@H]1C[C@H](c2ccccc2)CC[C@@H]1[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000552322730 1039380957 /nfs/dbraw/zinc/38/09/57/1039380957.db2.gz XJKASLZCPSSSOV-HLAWJBBLSA-N 2 0 344.543 4.190 20 0 EIADRP c1nc(C[NH2+]CCCCC[NH+]2CCCC2)sc1-c1ccccc1 ZINC000555612483 1039447447 /nfs/dbraw/zinc/44/74/47/1039447447.db2.gz OLXQUIQSQUNMLA-UHFFFAOYSA-N 2 0 329.513 4.166 20 0 EIADRP CC[NH+]1C[C@H]2C[NH+](C3CCC(c4ccc(Cl)cc4)CC3)C[C@@H]2C1 ZINC001168347476 1039495431 /nfs/dbraw/zinc/49/54/31/1039495431.db2.gz LUFBJFFMPNMSJH-NRGCRIOASA-N 2 0 332.919 4.250 20 0 EIADRP C[C@@H](CC[NH2+][C@@H](c1cccnc1)C1CCC1)[N@H+](C)Cc1ccccc1 ZINC000481666505 1039717678 /nfs/dbraw/zinc/71/76/78/1039717678.db2.gz IXANJMWBOPJLSZ-PGRDOPGGSA-N 2 0 337.511 4.423 20 0 EIADRP FC(F)(F)c1ccc(CCC[NH2+]C2CC[NH+](CC3CC3)CC2)cc1 ZINC001168360926 1039794496 /nfs/dbraw/zinc/79/44/96/1039794496.db2.gz XQURWHFGAKUYJE-UHFFFAOYSA-N 2 0 340.433 4.102 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)CCN1C ZINC000481740608 1039804156 /nfs/dbraw/zinc/80/41/56/1039804156.db2.gz MUTHHPPYNRGWLB-IPHXSNPTSA-N 2 0 344.449 4.321 20 0 EIADRP c1cc2cccc(C[NH+]3CCC(CCC[NH+]4CCCC4)CC3)c2[nH]1 ZINC000537651067 1039840786 /nfs/dbraw/zinc/84/07/86/1039840786.db2.gz UVSGDHJLMUEZDM-UHFFFAOYSA-N 2 0 325.500 4.256 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2c(C3CCC3)cnn2C)CC1 ZINC000667966577 1039850613 /nfs/dbraw/zinc/85/06/13/1039850613.db2.gz MYGUKHPCTYEDAS-UHFFFAOYSA-N 2 0 346.563 4.022 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCc3c2nccc3Cl)c1 ZINC000924709685 1039858548 /nfs/dbraw/zinc/85/85/48/1039858548.db2.gz YXDDREGGXNFOAY-LJQANCHMSA-N 2 0 343.902 4.354 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CCC[C@@H]2[NH2+][C@H]2CC23CC[NH2+]CC3)cc1 ZINC000666954263 1039861056 /nfs/dbraw/zinc/86/10/56/1039861056.db2.gz SUDJWKZZLCXDIX-ULQDDVLXSA-N 2 0 338.417 4.073 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@@H](c2cccnc2)C2CCC2)C1 ZINC000481922279 1039895834 /nfs/dbraw/zinc/89/58/34/1039895834.db2.gz XUYVXBVHIKKIPK-DBXWQHBBSA-N 2 0 329.532 4.271 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+](C)C)c1cccc(OCc2ccccc2)c1 ZINC000481955335 1039913322 /nfs/dbraw/zinc/91/33/22/1039913322.db2.gz VDUDTGXIMHGRNZ-GOSISDBHSA-N 2 0 326.484 4.258 20 0 EIADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000481955126 1039913882 /nfs/dbraw/zinc/91/38/82/1039913882.db2.gz SULWTDFXNQHYQV-XJKSGUPXSA-N 2 0 347.503 4.256 20 0 EIADRP Cc1ccc(-c2nc3c(s2)[C@@H]([NH2+][C@@H](C)CC[NH+](C)C)CCC3)cc1 ZINC000481960133 1039914046 /nfs/dbraw/zinc/91/40/46/1039914046.db2.gz LQTKPVAXOWDTCH-RDJZCZTQSA-N 2 0 343.540 4.426 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+](C)C)c1cccc(OCc2ccccc2)c1 ZINC000481955336 1039914220 /nfs/dbraw/zinc/91/42/20/1039914220.db2.gz VDUDTGXIMHGRNZ-SFHVURJKSA-N 2 0 326.484 4.258 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@@H](C)[NH2+]CCCC[NH+](C)C ZINC000481975072 1039923035 /nfs/dbraw/zinc/92/30/35/1039923035.db2.gz QKJYVFCZUQCXFD-OAHLLOKOSA-N 2 0 331.529 4.035 20 0 EIADRP Cc1cccnc1C(C)(C)C[NH2+]C1CC[NH+]([C@@H]2CCC[C@@H](C)C2)CC1 ZINC000514637714 1040074477 /nfs/dbraw/zinc/07/44/77/1040074477.db2.gz SLUWKGAHGLSIGF-YLJYHZDGSA-N 2 0 343.559 4.300 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2ncc(-c3ccccc3C)o2)CC1 ZINC000535259730 1040100756 /nfs/dbraw/zinc/10/07/56/1040100756.db2.gz FCPQMOKOSZBSAJ-UHFFFAOYSA-N 2 0 341.499 4.204 20 0 EIADRP C[C@@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000551267686 1040129164 /nfs/dbraw/zinc/12/91/64/1040129164.db2.gz SLEAXSPUKYIQAD-DLBZAZTESA-N 2 0 339.527 4.298 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)cc1 ZINC000479120783 1040154423 /nfs/dbraw/zinc/15/44/23/1040154423.db2.gz UMRCYDKHPYMVGC-FQEVSTJZSA-N 2 0 344.886 4.058 20 0 EIADRP Fc1ccc(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)c(Cl)c1 ZINC000514764007 1040227999 /nfs/dbraw/zinc/22/79/99/1040227999.db2.gz LFAUJKQRRNJZRU-UHFFFAOYSA-N 2 0 338.898 4.408 20 0 EIADRP CC[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cccs1 ZINC000482443007 1040250183 /nfs/dbraw/zinc/25/01/83/1040250183.db2.gz FCYNTBQBECHXDS-MOPGFXCFSA-N 2 0 328.525 4.353 20 0 EIADRP Cc1ncsc1-c1ccc(C[N@H+]2CCC[C@@H]([NH+](C)C)CC2)cc1 ZINC000668063912 1040311198 /nfs/dbraw/zinc/31/11/98/1040311198.db2.gz ZLESVLDOVAOPIJ-GOSISDBHSA-N 2 0 329.513 4.035 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCc3ccc(F)cc32)c1 ZINC000479420301 1040321433 /nfs/dbraw/zinc/32/14/33/1040321433.db2.gz HVSRFICGYDFIFS-NRFANRHFSA-N 2 0 326.459 4.445 20 0 EIADRP C[C@@H](C[NH2+][C@H]1CC[NH2+]C2(CCC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000666993718 1040364312 /nfs/dbraw/zinc/36/43/12/1040364312.db2.gz GIUWQYBUYCFZFX-BBRMVZONSA-N 2 0 326.406 4.073 20 0 EIADRP Cc1cc2[nH]c(C[NH2+]Cc3ccc(C[NH+](C)C)c(F)c3)cc2c(C)c1 ZINC000479464797 1040374703 /nfs/dbraw/zinc/37/47/03/1040374703.db2.gz NDUVYNZPJPTIHL-UHFFFAOYSA-N 2 0 339.458 4.275 20 0 EIADRP C[C@H](CN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1ccc(C2CCCCC2)cc1 ZINC000482630965 1040396315 /nfs/dbraw/zinc/39/63/15/1040396315.db2.gz QZTUAYIBYVYIDI-MOPGFXCFSA-N 2 0 343.559 4.021 20 0 EIADRP C[C@@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@@H]1CC[NH2+]C2(CCC2)C1 ZINC000666995349 1040404588 /nfs/dbraw/zinc/40/45/88/1040404588.db2.gz KPBCCIVWCZSQBF-WMLDXEAASA-N 2 0 340.433 4.291 20 0 EIADRP c1ccc(COc2ccc(C[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)cc2)cc1 ZINC000666998387 1040417869 /nfs/dbraw/zinc/41/78/69/1040417869.db2.gz QMFWLMYRXODVHL-FQEVSTJZSA-N 2 0 336.479 4.030 20 0 EIADRP C[NH+](C)Cc1cc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)ccc1F ZINC000479531822 1040458526 /nfs/dbraw/zinc/45/85/26/1040458526.db2.gz VQOSUKAZUGZKGM-LJQANCHMSA-N 2 0 332.850 4.318 20 0 EIADRP C[C@H]([NH2+]CCCc1cccc(F)c1)c1cccc(OCC[NH+](C)C)c1 ZINC000482879104 1040535234 /nfs/dbraw/zinc/53/52/34/1040535234.db2.gz WLYVHLVZORFSDK-KRWDZBQOSA-N 2 0 344.474 4.050 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000551788676 1040600638 /nfs/dbraw/zinc/60/06/38/1040600638.db2.gz DYZLQAPHTAIMRQ-SJORKVTESA-N 2 0 328.422 4.273 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCCC[NH+]2CCC(C)CC2)cc1 ZINC000551794591 1040606751 /nfs/dbraw/zinc/60/67/51/1040606751.db2.gz ZJEXLTYQQGJPLB-STZQEDGTSA-N 2 0 344.543 4.289 20 0 EIADRP C[N@H+](C[C@H]1CC[NH+](Cc2ccccc2)C1)[C@H]1CCc2ccc(F)cc21 ZINC000483088701 1040697702 /nfs/dbraw/zinc/69/77/02/1040697702.db2.gz LILZWBICRUBQOU-GCJKJVERSA-N 2 0 338.470 4.267 20 0 EIADRP CCCOc1ccc(C[N@H+](C)[C@@H]2CC[NH+](CC)C[C@H]2C)cc1OCC ZINC000539817499 1040808937 /nfs/dbraw/zinc/80/89/37/1040808937.db2.gz OJNBFMMYFKFRMO-IEBWSBKVSA-N 2 0 348.531 4.036 20 0 EIADRP CCCOc1ccc(C[N@H+](C)[C@@H]2CC[NH+](CC)C[C@@H]2C)cc1OCC ZINC000539817502 1040811951 /nfs/dbraw/zinc/81/19/51/1040811951.db2.gz OJNBFMMYFKFRMO-PKOBYXMFSA-N 2 0 348.531 4.036 20 0 EIADRP CC(C)c1ncc(C[NH+]2CCC(CCC[NH+]3CCCC3)CC2)s1 ZINC000539852581 1040848152 /nfs/dbraw/zinc/84/81/52/1040848152.db2.gz YLMPMPDWJAFFFK-UHFFFAOYSA-N 2 0 335.561 4.355 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1)c1nc2c(s1)CCCC2 ZINC000537883264 1040871695 /nfs/dbraw/zinc/87/16/95/1040871695.db2.gz QQVZAXXVLDWKCE-ZACQAIPSSA-N 2 0 349.588 4.431 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C)C1 ZINC000483483451 1040872054 /nfs/dbraw/zinc/87/20/54/1040872054.db2.gz NNFKUGPRECHSNE-KMFMINBZSA-N 2 0 326.406 4.183 20 0 EIADRP CCC[NH+]1CCC(C[NH2+]Cc2cc(C)c(C)cc2OC(F)F)CC1 ZINC000462744222 1040892956 /nfs/dbraw/zinc/89/29/56/1040892956.db2.gz KQHIHXQRQSWEHE-UHFFFAOYSA-N 2 0 340.458 4.116 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1cscn1 ZINC000537944564 1040911646 /nfs/dbraw/zinc/91/16/46/1040911646.db2.gz GHSOJDIGEDRANI-BQFCYCMXSA-N 2 0 329.513 4.094 20 0 EIADRP CCC1CCC([NH2+]CC2CC[NH+](Cc3ccc(OC)cc3)CC2)CC1 ZINC000462774176 1040927310 /nfs/dbraw/zinc/92/73/10/1040927310.db2.gz NYGJHRYJIAFASY-UHFFFAOYSA-N 2 0 344.543 4.466 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CC2(c3ccc(Cl)cc3Cl)CCC2)CC[N@@H+]1C ZINC000537964482 1040936806 /nfs/dbraw/zinc/93/68/06/1040936806.db2.gz RYNOQPCATQMHGK-UKRRQHHQSA-N 2 0 341.326 4.487 20 0 EIADRP FC(F)(F)CCC(CCC(F)(F)F)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000924648679 1040938579 /nfs/dbraw/zinc/93/85/79/1040938579.db2.gz NKTSGVNRJFXZIB-LLVKDONJSA-N 2 0 346.359 4.114 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H]2CCCc3ccc(O)cc32)CC1 ZINC000462811463 1040960416 /nfs/dbraw/zinc/96/04/16/1040960416.db2.gz WRQMLKFSGCWHIH-OAQYLSRUSA-N 2 0 330.516 4.117 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1ccc(COc2ccccc2)cc1 ZINC000537988281 1040966228 /nfs/dbraw/zinc/96/62/28/1040966228.db2.gz WHISYYCMHTXXKA-HMFYCAOWSA-N 2 0 338.495 4.084 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCCc4c(O)cccc43)CC2)CC1 ZINC000462814166 1040984702 /nfs/dbraw/zinc/98/47/02/1040984702.db2.gz OLBAVBPVXHJVGD-NGICGMGXSA-N 2 0 342.527 4.402 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC000379740222 1040992317 /nfs/dbraw/zinc/99/23/17/1040992317.db2.gz HWPIKSPXGYGELJ-RXVVDRJESA-N 2 0 326.459 4.389 20 0 EIADRP CCO[C@@H]1C[C@@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)C12CCCC2 ZINC000483841135 1041040597 /nfs/dbraw/zinc/04/05/97/1041040597.db2.gz VWMCBVHQELTRHW-WOJBJXKFSA-N 2 0 334.548 4.111 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CC[C@H](c3ccccc3)C2)c1 ZINC000436273598 1041044513 /nfs/dbraw/zinc/04/45/13/1041044513.db2.gz JAHDMXSAQCNTMJ-SFTDATJTSA-N 2 0 338.495 4.053 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000436273524 1041044860 /nfs/dbraw/zinc/04/48/60/1041044860.db2.gz KALTWRXRZGUPOK-TZIWHRDSSA-N 2 0 338.495 4.053 20 0 EIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H]3CC[C@H]3C(C)(C)C)cc2)CC1 ZINC000554378063 1041064365 /nfs/dbraw/zinc/06/43/65/1041064365.db2.gz ZHPGULOQJXOICV-UXHICEINSA-N 2 0 330.516 4.074 20 0 EIADRP CC(C)[C@@H]([NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1)c1cccnc1 ZINC000538115705 1041065666 /nfs/dbraw/zinc/06/56/66/1041065666.db2.gz AWLKXZWBWGWDFY-WIYYLYMNSA-N 2 0 325.500 4.279 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)c1cscn1 ZINC000903454379 1041066496 /nfs/dbraw/zinc/06/64/96/1041066496.db2.gz BPRHLOCYAWICET-OQIJWPOYSA-N 2 0 341.524 4.094 20 0 EIADRP Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000540136655 1041179934 /nfs/dbraw/zinc/17/99/34/1041179934.db2.gz WLJCNAZRDZENAS-UWJYYQICSA-N 2 0 335.495 4.445 20 0 EIADRP COc1ccc2oc([C@H](C)[NH2+]CCCNc3ccccn3)c(C)c2c1 ZINC000484305081 1041192020 /nfs/dbraw/zinc/19/20/20/1041192020.db2.gz UMBALGDVJGJIRE-HNNXBMFYSA-N 2 0 339.439 4.298 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)cc1F ZINC000436411718 1041214117 /nfs/dbraw/zinc/21/41/17/1041214117.db2.gz FIWKADIWFHAIAG-QUCCMNQESA-N 2 0 326.459 4.313 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)cc1F ZINC000436411719 1041214888 /nfs/dbraw/zinc/21/48/88/1041214888.db2.gz FIWKADIWFHAIAG-UYAOXDASSA-N 2 0 326.459 4.313 20 0 EIADRP C[C@H](CC[NH3+])[NH2+]Cc1ccc(-c2ccccc2Br)s1 ZINC000414884102 1041223816 /nfs/dbraw/zinc/22/38/16/1041223816.db2.gz AVQOHHSCOAIUDM-LLVKDONJSA-N 2 0 339.302 4.005 20 0 EIADRP C[C@H]1CCN(c2cc[nH+]c3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC000463062555 1041296102 /nfs/dbraw/zinc/29/61/02/1041296102.db2.gz ADRYIGWLBKLRMO-SFHVURJKSA-N 2 0 331.463 4.336 20 0 EIADRP COc1ccc([C@H]([NH2+]CCCCC[NH+]2CCCCC2)C2CC2)cc1 ZINC000540300620 1041353046 /nfs/dbraw/zinc/35/30/46/1041353046.db2.gz FCLDHVAQAXXRCM-OAQYLSRUSA-N 2 0 330.516 4.392 20 0 EIADRP CC(C)[NH+](CCCN[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1)C(C)C ZINC000463208589 1041419386 /nfs/dbraw/zinc/41/93/86/1041419386.db2.gz XOVOXKNCPMLHOB-UNMCSNQZSA-N 3 0 345.575 4.138 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc(C(C)C)c2)[C@@H](C)C1 ZINC000480674046 1041465582 /nfs/dbraw/zinc/46/55/82/1041465582.db2.gz WPLMDACGDOAROX-RXVVDRJESA-N 2 0 332.532 4.037 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)[C@H]1CCOC1 ZINC000480703453 1041480645 /nfs/dbraw/zinc/48/06/45/1041480645.db2.gz YPRHDNPTZCZWAM-UDKICSLYSA-N 2 0 344.543 4.069 20 0 EIADRP CCC[C@@H](C[NH+]1CCC(OCC[NH+]2CCCC2)CC1)c1ccccc1 ZINC000540480069 1041483280 /nfs/dbraw/zinc/48/32/80/1041483280.db2.gz GBIDSRSSLKMGOI-NRFANRHFSA-N 2 0 344.543 4.147 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000195132211 1041484471 /nfs/dbraw/zinc/48/44/71/1041484471.db2.gz WJKCORPLOJQRGP-SJLPKXTDSA-N 2 0 342.458 4.007 20 0 EIADRP CC(C)CC1(C[NH2+][C@@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)CC1 ZINC000540493333 1041496828 /nfs/dbraw/zinc/49/68/28/1041496828.db2.gz ZONZMOLTWAITBR-LJQANCHMSA-N 2 0 342.527 4.391 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H](C)c1cccc(F)c1 ZINC000480734927 1041497143 /nfs/dbraw/zinc/49/71/43/1041497143.db2.gz VZVOQLDNKSUYMM-KRWDZBQOSA-N 2 0 344.474 4.397 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc(-c4ccccc4F)o3)CC[C@@H]21 ZINC000538799167 1041539519 /nfs/dbraw/zinc/53/95/19/1041539519.db2.gz RRENVKHCEKAYTI-KXBFYZLASA-N 2 0 328.431 4.002 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc(-c4ccc(F)cc4)o3)CC[C@H]21 ZINC000538799217 1041540885 /nfs/dbraw/zinc/54/08/85/1041540885.db2.gz URBUTZRBHMMBOC-QFBILLFUSA-N 2 0 328.431 4.002 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](Cc3ccc(-c4ccc(F)cc4)o3)CC[C@@H]21 ZINC000538799216 1041541531 /nfs/dbraw/zinc/54/15/31/1041541531.db2.gz URBUTZRBHMMBOC-LPHOPBHVSA-N 2 0 328.431 4.002 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000470181960 1041580189 /nfs/dbraw/zinc/58/01/89/1041580189.db2.gz HSOVLFNDEVGAPA-ZBFHGGJFSA-N 2 0 329.513 4.117 20 0 EIADRP CC[N@@H+]1CC[C@H](Nc2ccc(C[NH+]3CCCC[C@@H]3C)cc2)[C@@H](C)C1 ZINC000540699435 1041613795 /nfs/dbraw/zinc/61/37/95/1041613795.db2.gz FDEHMQRWLSYIBQ-WFXMLNOXSA-N 2 0 329.532 4.203 20 0 EIADRP CC(C)[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000437076325 1041625113 /nfs/dbraw/zinc/62/51/13/1041625113.db2.gz OBFQGWJVJMLUFM-RHSMWYFYSA-N 2 0 346.437 4.255 20 0 EIADRP C[C@H](c1ccc(OC(F)(F)F)cc1)[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000516738420 1041722186 /nfs/dbraw/zinc/72/21/86/1041722186.db2.gz HXFDSJHHHJMLMD-CQSZACIVSA-N 2 0 344.421 4.310 20 0 EIADRP CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000540982949 1041765564 /nfs/dbraw/zinc/76/55/64/1041765564.db2.gz YAYHQXBRKVPSPY-KKSFZXQISA-N 2 0 348.506 4.288 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000540984012 1041766683 /nfs/dbraw/zinc/76/66/83/1041766683.db2.gz VEULDVVLLLTERW-PNLZDCPESA-N 2 0 342.527 4.326 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@H]2CCCc3c4ccccc4[nH]c32)CC1 ZINC000516808402 1041768398 /nfs/dbraw/zinc/76/83/98/1041768398.db2.gz LVZAOTNHLCOIDG-FQEVSTJZSA-N 2 0 325.500 4.255 20 0 EIADRP c1ccc(OCCCC[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)cc1 ZINC000437766434 1041899807 /nfs/dbraw/zinc/89/98/07/1041899807.db2.gz WEOAZSODRUAYBY-UHFFFAOYSA-N 2 0 338.495 4.231 20 0 EIADRP Cc1ccc2cc([C@@H](C)[NH2+]CCCC[N@H+]3C[C@@H](C)O[C@@H](C)C3)oc2c1 ZINC000425927138 1041950863 /nfs/dbraw/zinc/95/08/63/1041950863.db2.gz YNPULDBLPDUHKE-FGTMMUONSA-N 2 0 344.499 4.281 20 0 EIADRP Cc1ccc2cc([C@H](C)[NH2+]CCCC[N@H+]3C[C@@H](C)O[C@@H](C)C3)oc2c1 ZINC000425927139 1041951832 /nfs/dbraw/zinc/95/18/32/1041951832.db2.gz YNPULDBLPDUHKE-KSZLIROESA-N 2 0 344.499 4.281 20 0 EIADRP Cc1ccc2cc([C@H](C)[NH2+]CCCC[NH+]3C[C@@H](C)O[C@H](C)C3)oc2c1 ZINC000425927140 1041952254 /nfs/dbraw/zinc/95/22/54/1041952254.db2.gz YNPULDBLPDUHKE-KURKYZTESA-N 2 0 344.499 4.281 20 0 EIADRP CC[C@@H]1CCC[C@H](C[N@H+](C)C2CCN(CCc3ccccn3)CC2)C1 ZINC000541536593 1041998814 /nfs/dbraw/zinc/99/88/14/1041998814.db2.gz CWDFCQMVGIDHCD-UXHICEINSA-N 2 0 343.559 4.237 20 0 EIADRP c1ccc2c(c1)c1ccccc1n2CC[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000541558133 1042012705 /nfs/dbraw/zinc/01/27/05/1042012705.db2.gz LZVHFWCAWOYOIA-UHFFFAOYSA-N 2 0 347.506 4.259 20 0 EIADRP FC1(F)CC(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000425940700 1042018121 /nfs/dbraw/zinc/01/81/21/1042018121.db2.gz XNIPNMOUVJKIMA-XUVXKRRUSA-N 2 0 348.481 4.312 20 0 EIADRP C[NH+](C)C[C@@H]1CC[N@H+](Cc2ccc(-c3cccc(Cl)c3)s2)C1 ZINC000541908757 1042165686 /nfs/dbraw/zinc/16/56/86/1042165686.db2.gz MCRNNYSBYDUBEI-AWEZNQCLSA-N 2 0 334.916 4.452 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc(NC(C)=O)cc1 ZINC000541917673 1042179124 /nfs/dbraw/zinc/17/91/24/1042179124.db2.gz DBDWLGMDTQFXOB-NBHGPNQESA-N 2 0 345.531 4.196 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000414933624 1042217255 /nfs/dbraw/zinc/21/72/55/1042217255.db2.gz XBKXOFQCQSQPPW-LTIDMASMSA-N 2 0 326.406 4.201 20 0 EIADRP C[N@H+](CCC[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1)Cc1ccccc1 ZINC000303093372 1042295976 /nfs/dbraw/zinc/29/59/76/1042295976.db2.gz BUXAZRPSNGJMET-DLBZAZTESA-N 2 0 328.422 4.219 20 0 EIADRP Cc1cc(C)c(C[NH2+]C[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1C ZINC000303149414 1042323149 /nfs/dbraw/zinc/32/31/49/1042323149.db2.gz FCWXXNPJMNTAEJ-QFIPXVFZSA-N 2 0 336.523 4.266 20 0 EIADRP CC(C)[NH+]1CCC(N(C)Cc2cnc(-c3ccsc3)s2)CC1 ZINC000506343666 1042338903 /nfs/dbraw/zinc/33/89/03/1042338903.db2.gz UDOHDMYSBMXJAK-UHFFFAOYSA-N 2 0 335.542 4.176 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@@]2(C)CCCS2)CC1 ZINC000438826649 1042371061 /nfs/dbraw/zinc/37/10/61/1042371061.db2.gz OJRHHDCOGJGRKQ-SOAGJPPSSA-N 2 0 332.557 4.305 20 0 EIADRP CC(C)CC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)C(C)(C)C ZINC000518249773 1042439187 /nfs/dbraw/zinc/43/91/87/1042439187.db2.gz BLYZNYMJCPNXQS-AQNXPRMDSA-N 2 0 338.580 4.195 20 0 EIADRP c1cc(-c2nc3ccccc3s2)oc1C[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000414975595 1042467633 /nfs/dbraw/zinc/46/76/33/1042467633.db2.gz OWEKZTVMOZGOSL-AWEZNQCLSA-N 2 0 341.480 4.178 20 0 EIADRP C[C@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](CCCOc2ccccc2)C1 ZINC000303657672 1042492765 /nfs/dbraw/zinc/49/27/65/1042492765.db2.gz VEFNWMSIQKHOGN-PMACEKPBSA-N 2 0 330.516 4.042 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1CCc2cc(F)ccc2C1 ZINC001168442476 1042505666 /nfs/dbraw/zinc/50/56/66/1042505666.db2.gz VMGFSJAHRAAOKM-PWRODBHTSA-N 2 0 330.491 4.022 20 0 EIADRP [NH3+][C@H]1CCC[C@@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000414996494 1042600608 /nfs/dbraw/zinc/60/06/08/1042600608.db2.gz GJZQXNQIYDXKJF-QRWLVFNGSA-N 2 0 344.449 4.204 20 0 EIADRP c1cc(C[NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)cc(OCC2CCCCC2)c1 ZINC000518767821 1042676773 /nfs/dbraw/zinc/67/67/73/1042676773.db2.gz TUSZRKVKSBEVFJ-FQEVSTJZSA-N 2 0 342.527 4.220 20 0 EIADRP CC(C)c1ccc(-c2ncc(CN3CC[C@@H](C[NH+](C)C)C3)s2)cc1 ZINC000174861628 1042716473 /nfs/dbraw/zinc/71/64/73/1042716473.db2.gz CVOVNMFEYCKOOI-INIZCTEOSA-N 2 0 343.540 4.317 20 0 EIADRP C[C@@H](CC[NH+](C)C)[NH2+][C@@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000309876397 1042823713 /nfs/dbraw/zinc/82/37/13/1042823713.db2.gz JCDHVRIXCGSZSY-ROUUACIJSA-N 2 0 326.484 4.256 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H]2CCCc3ccc(C(C)C)cc32)CC1 ZINC000536420617 1042848655 /nfs/dbraw/zinc/84/86/55/1042848655.db2.gz LDUMLUIMYBSSHT-JOCHJYFZSA-N 2 0 344.543 4.278 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]Cc1ccc(OCc2ccccc2)cc1 ZINC000311016327 1042850662 /nfs/dbraw/zinc/85/06/62/1042850662.db2.gz NADWJIPWPYTHFU-FGSXEWAUSA-N 2 0 338.495 4.084 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C2CC[NH+](CC3CC3)CC2)c2ccccc12 ZINC000178254506 1042862045 /nfs/dbraw/zinc/86/20/45/1042862045.db2.gz WCYSNPOUDPZBDL-INIZCTEOSA-N 2 0 338.495 4.373 20 0 EIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000493890809 1042972071 /nfs/dbraw/zinc/97/20/71/1042972071.db2.gz HMTGJMDJNPFGOK-AVRDEDQJSA-N 2 0 340.511 4.393 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)c1ccc2cc(OC)ccc2c1 ZINC000152418281 1043005694 /nfs/dbraw/zinc/00/56/94/1043005694.db2.gz ANTQRRABYMDJEE-OPAMFIHVSA-N 2 0 338.495 4.373 20 0 EIADRP Cc1cc(F)ccc1C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000310070953 1043099463 /nfs/dbraw/zinc/09/94/63/1043099463.db2.gz ACFSARWIWJXXAN-IBGZPJMESA-N 2 0 326.459 4.136 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H](C)C1CC[NH+](C)CC1 ZINC000164758917 1043152417 /nfs/dbraw/zinc/15/24/17/1043152417.db2.gz WDCHESDSWJVRHH-CABCVRRESA-N 2 0 343.540 4.499 20 0 EIADRP c1ccc2ncc(C[NH2+]Cc3ccc(C[NH+]4CCCC4)cc3)cc2c1 ZINC000727464557 1043223890 /nfs/dbraw/zinc/22/38/90/1043223890.db2.gz TVYKIPCUAJCKQM-UHFFFAOYSA-N 2 0 331.463 4.120 20 0 EIADRP COc1cccc2cc(C[NH2+]CCCC[NH+]3CCC(C)CC3)oc21 ZINC000727644191 1043254548 /nfs/dbraw/zinc/25/45/48/1043254548.db2.gz RMDGKJIGPSJYBS-UHFFFAOYSA-N 2 0 330.472 4.043 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCc4ccc(F)cc43)CC2)CC1 ZINC000536824733 1043305539 /nfs/dbraw/zinc/30/55/39/1043305539.db2.gz DOMNIMYICICZAN-GZNCHQMQSA-N 2 0 330.491 4.446 20 0 EIADRP COc1ccc(-c2csc(C[NH2+][C@H]3CC[N@@H+]4CCC[C@@H]4C3)c2)cc1 ZINC000166764663 1043311770 /nfs/dbraw/zinc/31/17/70/1043311770.db2.gz FLTLUMNUFXXGPQ-ZWKOTPCHSA-N 2 0 342.508 4.140 20 0 EIADRP C[C@@H]1C[C@@H](Nc2cccc(F)c2C[NH3+])C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168011590 1043334263 /nfs/dbraw/zinc/33/42/63/1043334263.db2.gz PTVVMFCREJZXFP-ALXJQNPVSA-N 2 0 341.474 4.138 20 0 EIADRP c1cc2c(cccc2C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)[nH]1 ZINC000171130546 1043452098 /nfs/dbraw/zinc/45/20/98/1043452098.db2.gz YQLGKHGHDJJUDR-UHFFFAOYSA-N 2 0 333.479 4.170 20 0 EIADRP Cc1cscc1C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000494448261 1043490401 /nfs/dbraw/zinc/49/04/01/1043490401.db2.gz FJLVDSWIAOSEGE-ACDBMABISA-N 2 0 326.509 4.342 20 0 EIADRP C[N@H+](CCCc1ccsc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000543032333 1043595107 /nfs/dbraw/zinc/59/51/07/1043595107.db2.gz LOJLKKYJYBNCPO-FQEVSTJZSA-N 2 0 328.525 4.135 20 0 EIADRP CC[C@@](C)([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000730817057 1043630862 /nfs/dbraw/zinc/63/08/62/1043630862.db2.gz FNHMLNNUIXAQQT-OAQYLSRUSA-N 2 0 326.484 4.042 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@@H]3CCCC[C@@H]3[C@H]3CCOC3)CC2)CC1 ZINC000474034477 1043731766 /nfs/dbraw/zinc/73/17/66/1043731766.db2.gz SBUVJMHGKWJCIT-QKQBLWMGSA-N 2 0 348.575 4.214 20 0 EIADRP CCC[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccsc1 ZINC000658069209 1043740192 /nfs/dbraw/zinc/74/01/92/1043740192.db2.gz CWAPFLLVVUFUCV-LJQANCHMSA-N 2 0 336.545 4.070 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1Cc2[nH]c3ccccc3c2C1 ZINC000442637828 1043778023 /nfs/dbraw/zinc/77/80/23/1043778023.db2.gz QCGPDLQSAQMFJK-IBGZPJMESA-N 2 0 347.506 4.267 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2Cc3[nH]c4ccccc4c3C2)cc1 ZINC000442659435 1043785638 /nfs/dbraw/zinc/78/56/38/1043785638.db2.gz YCDNPEDEDJZNRM-IBGZPJMESA-N 2 0 347.506 4.267 20 0 EIADRP Cc1c([C@H](C)[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)cnn1C(C)C ZINC000191179548 1043794686 /nfs/dbraw/zinc/79/46/86/1043794686.db2.gz CLDQIXNBMIJRJN-BZSNNMDCSA-N 2 0 334.552 4.181 20 0 EIADRP C[C@H](CC[NH2+][C@H](C)c1cccc(OC(F)F)c1)[NH+]1CCCCC1 ZINC000542487812 1043797485 /nfs/dbraw/zinc/79/74/85/1043797485.db2.gz APFSYCUZGDLQKI-HUUCEWRRSA-N 2 0 326.431 4.203 20 0 EIADRP C[C@@]12CC3([NH3+])CC([NH2+][C@@H]4Cc5cccc(Cl)c5C4)(C1)C[C@](C)(C3)C2 ZINC001168703942 1043798935 /nfs/dbraw/zinc/79/89/35/1043798935.db2.gz KFJZDFFOEUUPCW-FOMZIEGMSA-N 2 0 344.930 4.227 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2cnn(C(C)C)c2C)c1 ZINC000191267114 1043803780 /nfs/dbraw/zinc/80/37/80/1043803780.db2.gz CTGASTRYSRYJTN-MRXNPFEDSA-N 2 0 328.504 4.075 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H]1CCSc2ccc(OC)cc21 ZINC000191483895 1043819749 /nfs/dbraw/zinc/81/97/49/1043819749.db2.gz ARLGZFZMFBABBY-QAPCUYQASA-N 2 0 336.545 4.332 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)CCS2 ZINC000191535780 1043824808 /nfs/dbraw/zinc/82/48/08/1043824808.db2.gz ZGNYFVITIOGBBW-QFBILLFUSA-N 2 0 348.556 4.190 20 0 EIADRP C[N@H+](Cc1ccccc1C[NH2+]Cc1cncc(F)c1)C1CCCCC1 ZINC000494597224 1043838080 /nfs/dbraw/zinc/83/80/80/1043838080.db2.gz ONXPSLOEJABBJW-UHFFFAOYSA-N 2 0 341.474 4.275 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1cccc(O)c1 ZINC000442872455 1043873731 /nfs/dbraw/zinc/87/37/31/1043873731.db2.gz JNRWJFQWJJIIHR-HBFSDRIKSA-N 2 0 338.495 4.344 20 0 EIADRP Clc1cccc2c1C[C@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)C2 ZINC001168707182 1043895686 /nfs/dbraw/zinc/89/56/86/1043895686.db2.gz KCYJLMGCIRMGAX-QGZVFWFLSA-N 2 0 332.919 4.194 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH2+]C2CCC(C[NH+](C)C)CC2)cc1 ZINC000657413845 1044030469 /nfs/dbraw/zinc/03/04/69/1044030469.db2.gz FMHFUUKSYFJQJI-UHFFFAOYSA-N 2 0 343.540 4.329 20 0 EIADRP Clc1cccc2c1C[C@H]([NH2+]CC1CC[NH+](CC3CCCC3)CC1)C2 ZINC001168710049 1044081664 /nfs/dbraw/zinc/08/16/64/1044081664.db2.gz WHCPNNBBQCGTNP-LJQANCHMSA-N 2 0 346.946 4.299 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH2+]CCCCC[NH+]2CCCC2)cc1 ZINC000657475068 1044144487 /nfs/dbraw/zinc/14/44/87/1044144487.db2.gz ZFNXILITVXROQT-UHFFFAOYSA-N 2 0 343.540 4.474 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000474051435 1044306628 /nfs/dbraw/zinc/30/66/28/1044306628.db2.gz CKNOFKDDSDOAAA-OAQYLSRUSA-N 2 0 342.527 4.414 20 0 EIADRP CCC(CC)(C[NH2+]C1CC[NH+](CCc2ccccc2)CC1)SC ZINC000378920354 1044417078 /nfs/dbraw/zinc/41/70/78/1044417078.db2.gz OUABVBQSRARSFB-UHFFFAOYSA-N 2 0 334.573 4.205 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+][C@@H](C[C@@H]1CCOC1)c1ccc(F)cc1 ZINC000494880544 1044466135 /nfs/dbraw/zinc/46/61/35/1044466135.db2.gz SNLZLVMODBMLOP-LQWHRVPQSA-N 2 0 348.506 4.148 20 0 EIADRP CCC(CC)(C[NH2+][C@H](C)C1CC[NH+](C)CC1)N[C@@H](C)c1ccccc1 ZINC000675894938 1044544942 /nfs/dbraw/zinc/54/49/42/1044544942.db2.gz WFGUGAQOFCUOOK-MOPGFXCFSA-N 2 0 345.575 4.216 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2ccccc2Oc2cccnc2)CC1 ZINC000113500848 1044605906 /nfs/dbraw/zinc/60/59/06/1044605906.db2.gz YYWYJZSMZAGNDW-UHFFFAOYSA-N 2 0 339.483 4.038 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C[C@@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000495072534 1044641563 /nfs/dbraw/zinc/64/15/63/1044641563.db2.gz SDANDMHRXUZNQI-RXVVDRJESA-N 2 0 348.506 4.005 20 0 EIADRP CC(C)[NH+]1CCC([NH2+]CC(C)(C)c2cccc(Cl)c2F)CC1 ZINC000469800603 1044751842 /nfs/dbraw/zinc/75/18/42/1044751842.db2.gz NNBFDXLARNVBPU-UHFFFAOYSA-N 2 0 326.887 4.219 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+]Cc2cc3ccnc(Cl)c3s2)CC1 ZINC000895455320 1044759580 /nfs/dbraw/zinc/75/95/80/1044759580.db2.gz VLNYJPYFTHCWPT-UHFFFAOYSA-N 2 0 337.920 4.302 20 0 EIADRP Fc1ccc2c(c1)[nH]cc2C1CC[NH+](CCC[NH+]2CCCCC2)CC1 ZINC000033964696 1044782366 /nfs/dbraw/zinc/78/23/66/1044782366.db2.gz UIRILMHEDUNQNH-UHFFFAOYSA-N 2 0 343.490 4.362 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C2(Cc3cccnc3)CC2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168031899 1044841427 /nfs/dbraw/zinc/84/14/27/1044841427.db2.gz DATRXQWHVYHMOA-HATOLVCRSA-N 2 0 349.522 4.188 20 0 EIADRP C[C@H]1CC([NH2+]CC2CCSCC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168031864 1044841522 /nfs/dbraw/zinc/84/15/22/1044841522.db2.gz CUFIIVQLSNCDLW-IRXDYDNUSA-N 2 0 332.557 4.161 20 0 EIADRP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000673600222 1044861004 /nfs/dbraw/zinc/86/10/04/1044861004.db2.gz WPAXHEQWJOTUKX-VOKWIDLSSA-N 2 0 338.417 4.325 20 0 EIADRP CCc1cccc(Cl)c1C[NH2+]Cc1cccc(-n2ccnc2)c1 ZINC000474368996 1044890975 /nfs/dbraw/zinc/89/09/75/1044890975.db2.gz TXUSRLXEAQLPIH-UHFFFAOYSA-N 2 0 325.843 4.378 20 0 EIADRP CCC[C@@H]([NH2+]CC[C@H](C)[N@H+](C)Cc1ccccc1)c1cccnc1 ZINC000544570184 1044943501 /nfs/dbraw/zinc/94/35/01/1044943501.db2.gz WPZYJFSKSXZZKF-GHTZIAJQSA-N 2 0 325.500 4.423 20 0 EIADRP CC[N@H+](CCC1CC[NH+](CCCc2ccc(C)nc2)CC1)CC1CC1 ZINC000474465028 1045015825 /nfs/dbraw/zinc/01/58/25/1045015825.db2.gz BCENZIFWCMVGEQ-UHFFFAOYSA-N 2 0 343.559 4.157 20 0 EIADRP COC1(C[C@H](C)[NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)CCC1 ZINC000429374656 1045037949 /nfs/dbraw/zinc/03/79/49/1045037949.db2.gz WJEMZVWXPGBKOO-SFHVURJKSA-N 2 0 330.516 4.110 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+]Cc3scnc3C3CC3)CC2)c1 ZINC000486971504 1045221419 /nfs/dbraw/zinc/22/14/19/1045221419.db2.gz NZBRQQFKVBVOFI-UHFFFAOYSA-N 2 0 347.553 4.084 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccc(OC)c(Cl)c1 ZINC000236913304 1045370604 /nfs/dbraw/zinc/37/06/04/1045370604.db2.gz XDNQRKBYENOINY-UHFFFAOYSA-N 2 0 346.902 4.480 20 0 EIADRP C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)C(c1ccccc1)c1ccccc1 ZINC000322881305 1045500857 /nfs/dbraw/zinc/50/08/57/1045500857.db2.gz BLOAPIBHLBFSTF-IRFPFTSISA-N 2 0 334.507 4.422 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1cc(Cl)c(N)c(Cl)c1 ZINC000790751760 1045568986 /nfs/dbraw/zinc/56/89/86/1045568986.db2.gz XDGWLPWJEDJCHQ-LBPRGKRZSA-N 2 0 344.330 4.348 20 0 EIADRP C[C@@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1CCC[C@H]([NH+](C)C)CC1 ZINC000429531729 1045677118 /nfs/dbraw/zinc/67/71/18/1045677118.db2.gz SFKZTMZPRWGJSX-ZFWWWQNUSA-N 2 0 330.394 4.062 20 0 EIADRP C[C@H]1C[N@H+](Cc2cc(Cl)c(Cl)c(Cl)c2)CCC[C@@H]1C[NH3+] ZINC001206026684 1045711600 /nfs/dbraw/zinc/71/16/00/1045711600.db2.gz TZBDZPMOSDNFDY-CMPLNLGQSA-N 2 0 335.706 4.454 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cccc(Br)c2)cc1 ZINC000768252821 1045765225 /nfs/dbraw/zinc/76/52/25/1045765225.db2.gz RJIISZDRIUTQSN-UHFFFAOYSA-N 2 0 347.300 4.143 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]CCSc1ccccc1 ZINC000397977363 1045818967 /nfs/dbraw/zinc/81/89/67/1045818967.db2.gz KZLAHAZGPLXGSG-WIYYLYMNSA-N 2 0 340.536 4.279 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](Cc2ccccc2C[NH2+]C2CC(C(F)F)C2)C1 ZINC000768679844 1045827102 /nfs/dbraw/zinc/82/71/02/1045827102.db2.gz XLRCIWNEGNLHQD-GKVPXEHWSA-N 2 0 336.470 4.298 20 0 EIADRP c1nc(C2CCCC2)sc1CN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246818803 1045832075 /nfs/dbraw/zinc/83/20/75/1045832075.db2.gz RHCXCGHKTMYJSZ-QFBILLFUSA-N 2 0 345.556 4.249 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccsc1 ZINC000246982192 1045837068 /nfs/dbraw/zinc/83/70/68/1045837068.db2.gz KCJAFKGVPRKVAG-BRWVUGGUSA-N 2 0 344.524 4.208 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)c1ccsc1 ZINC000247039042 1045838474 /nfs/dbraw/zinc/83/84/74/1045838474.db2.gz MPQDCVGCZALEEQ-IXDOHACOSA-N 2 0 344.524 4.208 20 0 EIADRP CC(=O)Nc1ccc([C@@H](C)[NH2+]CCCC[N@H+]2C[C@H](C)C[C@H](C)C2)cc1 ZINC000248457111 1045874600 /nfs/dbraw/zinc/87/46/00/1045874600.db2.gz SUEHQWIOTYYKLJ-FGTMMUONSA-N 2 0 345.531 4.054 20 0 EIADRP Cc1nc2c(s1)[C@@H]([NH2+]CC1CC[NH+](CCC(C)C)CC1)CCC2 ZINC000163592840 1045938349 /nfs/dbraw/zinc/93/83/49/1045938349.db2.gz QUYQKPNOUDBCOT-KRWDZBQOSA-N 2 0 335.561 4.177 20 0 EIADRP C[C@H](Cc1ccccc1Cl)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001170250348 1045971591 /nfs/dbraw/zinc/97/15/91/1045971591.db2.gz KPKKZEFUQFTTAJ-IEBWSBKVSA-N 2 0 342.914 4.383 20 0 EIADRP CCc1noc(C)c1[C@H](C)[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000769872775 1046103054 /nfs/dbraw/zinc/10/30/54/1046103054.db2.gz FCSULZONZMWBCS-INIZCTEOSA-N 2 0 341.499 4.108 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[N@H+](C)C[C@@H]2CCC[NH2+]C2)cc1 ZINC000261745938 1046144439 /nfs/dbraw/zinc/14/44/39/1046144439.db2.gz BWMYVDZTRPWFBR-QZTJIDSGSA-N 2 0 338.495 4.355 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2cnc(-c3ccccc3)s2)CC1 ZINC000123470513 1046155865 /nfs/dbraw/zinc/15/58/65/1046155865.db2.gz ZCXVECWZGBJQNG-UHFFFAOYSA-N 2 0 343.540 4.364 20 0 EIADRP CCOc1ccccc1[C@H](C)[NH2+]Cc1cccc(C[N@H+](C)CC)c1 ZINC000123984163 1046208767 /nfs/dbraw/zinc/20/87/67/1046208767.db2.gz XSEUFDSINBKSKY-KRWDZBQOSA-N 2 0 326.484 4.388 20 0 EIADRP C[C@H]([NH2+]CCc1cccc(F)c1F)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508710051 1046365426 /nfs/dbraw/zinc/36/54/26/1046365426.db2.gz KVEZBTYQWLFUND-LPHOPBHVSA-N 2 0 344.449 4.008 20 0 EIADRP C[C@H]([NH2+]CCc1cc(F)cc(F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508712198 1046370720 /nfs/dbraw/zinc/37/07/20/1046370720.db2.gz CHGFJHWTZUOCLR-LPHOPBHVSA-N 2 0 344.449 4.008 20 0 EIADRP C[C@H]([NH2+]CCc1c[nH]c2ccccc12)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508715708 1046381126 /nfs/dbraw/zinc/38/11/26/1046381126.db2.gz XHNHYORWEGNHNP-RXVVDRJESA-N 2 0 347.506 4.211 20 0 EIADRP COc1cc(C)cc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000508722031 1046420562 /nfs/dbraw/zinc/42/05/62/1046420562.db2.gz QUTGCHMSSXOLLZ-GHTZIAJQSA-N 2 0 338.495 4.004 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccccc2OCC2CC2)CC1 ZINC000536652558 1046595685 /nfs/dbraw/zinc/59/56/85/1046595685.db2.gz XGNPXHPYCRGVDU-UHFFFAOYSA-N 2 0 330.516 4.028 20 0 EIADRP CCCCOc1ccc(C[N@H+](C)[C@@H]2CC[NH+](CC)C[C@H]2C)cc1OC ZINC000536662345 1046633795 /nfs/dbraw/zinc/63/37/95/1046633795.db2.gz YEVPUQCZOXRDQR-IEBWSBKVSA-N 2 0 348.531 4.036 20 0 EIADRP CC(C)(C[NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccccc1Cl ZINC000459413389 1046636588 /nfs/dbraw/zinc/63/65/88/1046636588.db2.gz XEVGQNIABKHOAJ-UHFFFAOYSA-N 2 0 343.902 4.271 20 0 EIADRP C[N@@H+](Cc1cccc2cc[nH]c21)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536677260 1046663968 /nfs/dbraw/zinc/66/39/68/1046663968.db2.gz GSABXYYCRSFLLN-LJQANCHMSA-N 2 0 333.479 4.122 20 0 EIADRP CCC[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1F ZINC000459447243 1046679330 /nfs/dbraw/zinc/67/93/30/1046679330.db2.gz UKWMCXRFQNLQSS-HXUWFJFHSA-N 2 0 345.437 4.460 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc3cc(OC)ccc3c2)[C@H](C)C1 ZINC000536682262 1046685261 /nfs/dbraw/zinc/68/52/61/1046685261.db2.gz BJCDJJXDORATLU-IIBYNOLFSA-N 2 0 326.484 4.011 20 0 EIADRP Cc1ccc(CC[N@H+](C)CCC2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000536714376 1046706306 /nfs/dbraw/zinc/70/63/06/1046706306.db2.gz XXEFSYPTJKPYOM-UHFFFAOYSA-N 2 0 337.511 4.171 20 0 EIADRP CN(Cc1ccccc1)CC(C)(C)[NH2+]CCCCC1CCOCC1 ZINC000379621530 1046714469 /nfs/dbraw/zinc/71/44/69/1046714469.db2.gz FQSKPITUORRMEO-UHFFFAOYSA-N 2 0 332.532 4.084 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CCCOc2ccccc2)CCN1Cc1ccccc1 ZINC000379624693 1046715519 /nfs/dbraw/zinc/71/55/19/1046715519.db2.gz JRDUVMUTZSYSOT-FPOVZHCZSA-N 2 0 338.495 4.098 20 0 EIADRP c1ccc([C@H]2CCC[C@H]([NH2+]C3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000459498279 1046726185 /nfs/dbraw/zinc/72/61/85/1046726185.db2.gz AGTPLUJFHKMYDP-FPOVZHCZSA-N 2 0 335.495 4.366 20 0 EIADRP COc1ccc2c(c1)CCC[C@H]2[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000536836777 1046811575 /nfs/dbraw/zinc/81/15/75/1046811575.db2.gz BPFGVHQPWNFENJ-DYESRHJHSA-N 2 0 330.516 4.030 20 0 EIADRP COc1ccc2c(c1)CCC[C@H]2[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000536836794 1046811677 /nfs/dbraw/zinc/81/16/77/1046811677.db2.gz BPFGVHQPWNFENJ-LAUBAEHRSA-N 2 0 330.516 4.030 20 0 EIADRP Cc1ccc([C@@H]2CCC[C@@H]2[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000536855960 1046826128 /nfs/dbraw/zinc/82/61/28/1046826128.db2.gz CVIQTDCLMNLHJN-LGGPRVQUSA-N 2 0 344.543 4.110 20 0 EIADRP C[C@H]1C[NH+](CCCC[NH2+]C2CCC(c3ccccc3)CC2)C[C@H](C)O1 ZINC000536858399 1046826627 /nfs/dbraw/zinc/82/66/27/1046826627.db2.gz PAMQFKQKVYGUHK-CDNGDFIJSA-N 2 0 344.543 4.192 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c[nH+]cn2c1)[C@@H](C)c1nc2ccccc2s1 ZINC000459663729 1046846275 /nfs/dbraw/zinc/84/62/75/1046846275.db2.gz YDBJRSGPOONVIF-ZIAGYGMSSA-N 2 0 336.464 4.226 20 0 EIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C2CCC(C(F)F)CC2)CC1 ZINC000459703903 1046855740 /nfs/dbraw/zinc/85/57/40/1046855740.db2.gz FSEIWWGBPGOKEB-USSHROBNSA-N 2 0 328.491 4.443 20 0 EIADRP CC1(C)[C@@H](C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)[C@@H]1c1ccccc1 ZINC000459714483 1046870298 /nfs/dbraw/zinc/87/02/98/1046870298.db2.gz OQRDUHIMMZODKJ-SFTDATJTSA-N 2 0 335.495 4.080 20 0 EIADRP COc1ccccc1CC1([NH3+])CC[NH+]([C@@H](C)CCCC(C)C)CC1 ZINC001170071690 1046973376 /nfs/dbraw/zinc/97/33/76/1046973376.db2.gz SGEPUSXLRQQRJE-SFHVURJKSA-N 2 0 332.532 4.246 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@@H]2CCc3ccc(Cl)nc32)C1 ZINC000788538613 1047216385 /nfs/dbraw/zinc/21/63/85/1047216385.db2.gz HZVLETKVVVJAOJ-BFYDXBDKSA-N 2 0 335.923 4.070 20 0 EIADRP C[C@@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1cc[nH]c(=O)c1 ZINC000788592447 1047241725 /nfs/dbraw/zinc/24/17/25/1047241725.db2.gz LFYCEWDBCURIOT-QGZVFWFLSA-N 2 0 339.483 4.014 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1cc[nH]c(=O)c1 ZINC000788592443 1047241795 /nfs/dbraw/zinc/24/17/95/1047241795.db2.gz LFYCEWDBCURIOT-KRWDZBQOSA-N 2 0 339.483 4.014 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)C1 ZINC000129195913 1047330693 /nfs/dbraw/zinc/33/06/93/1047330693.db2.gz RGRLXTBPPGWPAH-MSOLQXFVSA-N 2 0 340.433 4.493 20 0 EIADRP C[C@@H]1CC[C@@H]([NH+]2CCC([NH3+])(c3ccc(C(F)(F)F)cc3)CC2)C1 ZINC001170119550 1047470774 /nfs/dbraw/zinc/47/07/74/1047470774.db2.gz YIKOLXUIUIBEGW-CZUORRHYSA-N 2 0 326.406 4.144 20 0 EIADRP C[C@H]([NH2+]Cc1coc2ccccc12)c1cccc(OCC[NH+](C)C)c1 ZINC000556216779 1047566593 /nfs/dbraw/zinc/56/65/93/1047566593.db2.gz JOFRDUAQGIUGSD-INIZCTEOSA-N 2 0 338.451 4.224 20 0 EIADRP CCCC[C@@H](COC)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000556233067 1047595769 /nfs/dbraw/zinc/59/57/69/1047595769.db2.gz FOCPHBYJUNQWIO-KBWCOIMZSA-N 2 0 332.532 4.224 20 0 EIADRP CCC[C@@H](CC)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCOCC2 ZINC000556231266 1047596046 /nfs/dbraw/zinc/59/60/46/1047596046.db2.gz UNPJRFAEUQDCEA-LEWJYISDSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000556242189 1047622864 /nfs/dbraw/zinc/62/28/64/1047622864.db2.gz RJIGLFQNEXNFOK-FDTGPBLFSA-N 2 0 334.507 4.290 20 0 EIADRP C[NH+](C)C1CCC([NH2+]CC(C)(c2ccccc2)c2ccccc2)CC1 ZINC001168294703 1047664280 /nfs/dbraw/zinc/66/42/80/1047664280.db2.gz CCVLPWLXRINUIK-UHFFFAOYSA-N 2 0 336.523 4.455 20 0 EIADRP Cc1cc(F)ccc1CC[NH2+][C@@H]1CCN(C)[C@@H](c2ccccc2)C1 ZINC000550680212 1047814404 /nfs/dbraw/zinc/81/44/04/1047814404.db2.gz JFRGNXJXGSXPGI-NHCUHLMSSA-N 2 0 326.459 4.102 20 0 EIADRP Cc1cc(F)ccc1CC[NH2+][C@H]1CCN(C)[C@@H](c2ccccc2)C1 ZINC000550680211 1047814598 /nfs/dbraw/zinc/81/45/98/1047814598.db2.gz JFRGNXJXGSXPGI-LEWJYISDSA-N 2 0 326.459 4.102 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000131295016 1047859840 /nfs/dbraw/zinc/85/98/40/1047859840.db2.gz YUTBIOTUFKSOFJ-QZTJIDSGSA-N 2 0 342.531 4.342 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ccc(-n2ccnc2C)cc1 ZINC000131294867 1047860535 /nfs/dbraw/zinc/86/05/35/1047860535.db2.gz YUTBIOTUFKSOFJ-ROUUACIJSA-N 2 0 342.531 4.342 20 0 EIADRP c1ccc(CC[NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000814172734 1047865263 /nfs/dbraw/zinc/86/52/63/1047865263.db2.gz AYQWAVFRWBPYJH-NOTZXAQLSA-N 2 0 334.507 4.404 20 0 EIADRP C[N@H+](C1CCC([NH3+])CC1)[C@@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171063036 1047905071 /nfs/dbraw/zinc/90/50/71/1047905071.db2.gz LAKUISFDEYPUSC-YMAMQOFZSA-N 2 0 327.299 4.052 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C[C@@]2(C)CC2(Cl)Cl)CC1 ZINC000824771246 1047920458 /nfs/dbraw/zinc/92/04/58/1047920458.db2.gz AJLTYERRRZYLLC-VNQPRFMTSA-N 2 0 333.347 4.203 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171065229 1047925567 /nfs/dbraw/zinc/92/55/67/1047925567.db2.gz WBTBOSRLCZPNMU-MRXNPFEDSA-N 2 0 341.326 4.315 20 0 EIADRP [NH3+]Cc1ccccc1C[NH2+][C@H]1CCc2cc(Cl)cc(Cl)c2C1 ZINC001171066190 1047939021 /nfs/dbraw/zinc/93/90/21/1047939021.db2.gz IIJRFDNCRGCGFY-INIZCTEOSA-N 2 0 335.278 4.099 20 0 EIADRP [NH3+]CCC1CCC([NH2+][C@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171074124 1048038157 /nfs/dbraw/zinc/03/81/57/1048038157.db2.gz ZJEKCVNFSLCHDU-MOQPWLNLSA-N 2 0 341.326 4.348 20 0 EIADRP CCCCC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2O)CC1)C(C)(C)C ZINC000808706540 1048053385 /nfs/dbraw/zinc/05/33/85/1048053385.db2.gz MNRRSSGCJKQRGO-UFYCRDLUSA-N 2 0 338.580 4.339 20 0 EIADRP FC1(F)CC([NH2+][C@@H]2CCCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000556887849 1048099880 /nfs/dbraw/zinc/09/98/80/1048099880.db2.gz MGQXTUWWPAZQGA-NZSAHSFTSA-N 2 0 334.454 4.065 20 0 EIADRP CCCN(CCC[NH+](C)C)Cc1cc(F)c(OCC)c(Cl)c1 ZINC001143746394 1048182272 /nfs/dbraw/zinc/18/22/72/1048182272.db2.gz RCOUAHDASDTWCC-UHFFFAOYSA-N 2 0 330.875 4.042 20 0 EIADRP [NH3+]C1(CC2CCC2)CC[NH+]([C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171107961 1048209361 /nfs/dbraw/zinc/20/93/61/1048209361.db2.gz FDECUXXAMJXZHL-LJQANCHMSA-N 2 0 332.919 4.181 20 0 EIADRP Cc1ccc(C[NH+]2CC[C@H](C[N@H+](C)CCc3cccs3)C2)s1 ZINC000844325997 1048296113 /nfs/dbraw/zinc/29/61/13/1048296113.db2.gz FQWNLGRSSQBMTP-MRXNPFEDSA-N 2 0 334.554 4.114 20 0 EIADRP c1ccc([C@H]2CC[C@H]([NH2+]CC3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000132608226 1048369189 /nfs/dbraw/zinc/36/91/89/1048369189.db2.gz SUHIWPFVIXEILL-SFTDATJTSA-N 2 0 335.495 4.224 20 0 EIADRP c1ccc(CCC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000499163146 1048370818 /nfs/dbraw/zinc/37/08/18/1048370818.db2.gz UEGQAMLYHRTDNE-WBDAEOGXSA-N 2 0 334.507 4.404 20 0 EIADRP CC(C)CSCC[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499194656 1048394089 /nfs/dbraw/zinc/39/40/89/1048394089.db2.gz SCPHGIWHVNKROO-OWZKRDHZSA-N 2 0 332.557 4.161 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H]1CCc3cc(Cl)c(Cl)cc3C1)C2 ZINC001171139835 1048428761 /nfs/dbraw/zinc/42/87/61/1048428761.db2.gz RKSQTAGEMBVRMN-JONQDZQNSA-N 2 0 339.310 4.066 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171144819 1048449979 /nfs/dbraw/zinc/44/99/79/1048449979.db2.gz RTKQYLNRVYBLQP-INIZCTEOSA-N 2 0 341.326 4.172 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+]Cc1ccc(SC(F)(F)F)cc1 ZINC000844905069 1048540936 /nfs/dbraw/zinc/54/09/36/1048540936.db2.gz USDNOXBWESJCRP-UHFFFAOYSA-N 2 0 340.414 4.308 20 0 EIADRP CCCCCC[C@H](CC)[NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC001170589653 1048563510 /nfs/dbraw/zinc/56/35/10/1048563510.db2.gz YTABDTDUPNOGAX-NRFANRHFSA-N 2 0 346.559 4.352 20 0 EIADRP Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3cc[nH+]cc3C(F)(F)F)c2c1 ZINC001171169917 1048621798 /nfs/dbraw/zinc/62/17/98/1048621798.db2.gz SLEBRERAKYUBDD-GFCCVEGCSA-N 2 0 333.357 4.242 20 0 EIADRP C[C@@H]([NH3+])C[C@@H](C)[NH2+]CC(C)(C)Sc1ccc(Br)cc1 ZINC000817897292 1049055900 /nfs/dbraw/zinc/05/59/00/1049055900.db2.gz JQXQYJHLSUXHMS-VXGBXAGGSA-N 2 0 345.350 4.035 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c2ccccc21 ZINC000817912518 1049059698 /nfs/dbraw/zinc/05/96/98/1049059698.db2.gz VHKANXZUNWIEED-YHQLXQCYSA-N 2 0 334.463 4.080 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H]2CCCc3cc(SC(F)F)ccc32)CC1 ZINC000817946760 1049060812 /nfs/dbraw/zinc/06/08/12/1049060812.db2.gz DOSWWMWWSQAJIR-ZUEPYMLJSA-N 2 0 326.456 4.238 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)CC[NH2+]1 ZINC000817972083 1049072627 /nfs/dbraw/zinc/07/26/27/1049072627.db2.gz SWLOVHIQHSDQIQ-PVXIVEMSSA-N 2 0 326.456 4.109 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(Cl)c(N)c(Cl)c1 ZINC000817969441 1049073115 /nfs/dbraw/zinc/07/31/15/1049073115.db2.gz VAPIJUGWBUXALG-JTQLQIEISA-N 2 0 336.266 4.030 20 0 EIADRP COc1ccc([C@@H]([NH2+][C@@H](C)CCC[NH3+])c2ccc(Cl)cc2)cc1C ZINC000817977456 1049075367 /nfs/dbraw/zinc/07/53/67/1049075367.db2.gz KOJVJOCRWUKVMA-YWZLYKJASA-N 2 0 346.902 4.463 20 0 EIADRP Cc1c([C@H](C)[NH2+][C@H](CCC[NH3+])c2ccccc2)cnn1-c1ccccc1 ZINC000817981774 1049077156 /nfs/dbraw/zinc/07/71/56/1049077156.db2.gz NPORQOQAJFWIML-HTAPYJJXSA-N 2 0 348.494 4.312 20 0 EIADRP C[C@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1cnn(-c2ccccc2)c1 ZINC000817982287 1049078306 /nfs/dbraw/zinc/07/83/06/1049078306.db2.gz QWRZERFNXDURNX-UWJYYQICSA-N 2 0 334.467 4.003 20 0 EIADRP Clc1cccc2c1C[C@@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)CC2 ZINC001170911689 1049197250 /nfs/dbraw/zinc/19/72/50/1049197250.db2.gz YYHOOGKFXXNNGT-IBGZPJMESA-N 2 0 346.946 4.442 20 0 EIADRP [NH3+]C1CCC(N(c2c[nH+]cc3cc[nH]c32)[C@@H]2C[C@H]2c2ccccc2)CC1 ZINC001170646937 1049308250 /nfs/dbraw/zinc/30/82/50/1049308250.db2.gz YRXICFOMVDYOCM-GHBBCFCZSA-N 2 0 346.478 4.195 20 0 EIADRP CC[NH+](CC)Cc1cc(C(F)(F)F)ccc1NC[C@@H]1CCCC[NH2+]1 ZINC001171341922 1049415722 /nfs/dbraw/zinc/41/57/22/1049415722.db2.gz ZWLSKVBSXLVXIP-INIZCTEOSA-N 2 0 343.437 4.101 20 0 EIADRP C[C@H](CC[NH2+][C@@H]1CCCNc2ccccc21)[N@H+](C)Cc1ccccc1 ZINC000348097587 1049415981 /nfs/dbraw/zinc/41/59/81/1049415981.db2.gz WQQBUJDVEKAHFB-XMSQKQJNSA-N 2 0 337.511 4.434 20 0 EIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000136688116 1049500046 /nfs/dbraw/zinc/50/00/46/1049500046.db2.gz OIDHOQDDCPKWOA-FQEVSTJZSA-N 2 0 344.543 4.226 20 0 EIADRP Cc1cccc(C)c1C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000773066948 1049559963 /nfs/dbraw/zinc/55/99/63/1049559963.db2.gz GLIIRBNWKHCRNO-SFHVURJKSA-N 2 0 326.484 4.095 20 0 EIADRP CC[C@@H]([NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@@H]1CCCO1 ZINC000820829450 1049563161 /nfs/dbraw/zinc/56/31/61/1049563161.db2.gz JLOLZGTZHBMGKF-DSBNJHONSA-N 2 0 342.527 4.119 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)c1ccc2c(c1)CCO2 ZINC000773079761 1049569249 /nfs/dbraw/zinc/56/92/49/1049569249.db2.gz YVNXBFMWAAPUND-YLJYHZDGSA-N 2 0 330.516 4.030 20 0 EIADRP Fc1cccc2c1CC[C@@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)C2 ZINC001171434020 1049674811 /nfs/dbraw/zinc/67/48/11/1049674811.db2.gz PMPLLEMGYBUIAV-RBUKOAKNSA-N 2 0 330.491 4.023 20 0 EIADRP C[N@H+](C1CC[NH+](C2CCCCC2)CC1)[C@H]1CCc2c(F)cccc2C1 ZINC001171445372 1049697184 /nfs/dbraw/zinc/69/71/84/1049697184.db2.gz JRUOPZCEFFNEAJ-FQEVSTJZSA-N 2 0 344.518 4.412 20 0 EIADRP C[NH+](C)CCC1CC[NH+](CCOc2cc(Cl)ccc2Cl)CC1 ZINC000615463937 1049697778 /nfs/dbraw/zinc/69/77/78/1049697778.db2.gz BPMNAQYAWIOBIC-UHFFFAOYSA-N 2 0 345.314 4.036 20 0 EIADRP CCC(CC)[NH+]1CCC([NH2+][C@@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171465942 1049707217 /nfs/dbraw/zinc/70/72/17/1049707217.db2.gz KQIWUIXCMOPHLJ-QGZVFWFLSA-N 2 0 336.470 4.065 20 0 EIADRP Fc1cc2c(cc1F)C[C@@H]([N@@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)CC2 ZINC001171486350 1049717287 /nfs/dbraw/zinc/71/72/87/1049717287.db2.gz BPLIABWPBCWRNO-MOPGFXCFSA-N 2 0 348.481 4.163 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@H]1CCCC[NH+]1[C@@H]1CCc2cc(F)c(F)cc2C1 ZINC001171495141 1049720476 /nfs/dbraw/zinc/72/04/76/1049720476.db2.gz XTNDEBFJWRHBDH-IPMKNSEASA-N 2 0 348.481 4.161 20 0 EIADRP Cc1cccc2c1CC[C@H]([N@H+](Cc1ccccn1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171558895 1049755231 /nfs/dbraw/zinc/75/52/31/1049755231.db2.gz PYKAJMZQSLHPFR-BVSLBCMMSA-N 2 0 349.522 4.019 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CCCOc2cccc(Cl)c2)CC1(C)C ZINC001171619061 1049766078 /nfs/dbraw/zinc/76/60/78/1049766078.db2.gz GEQMZLPTWTVMRK-UHFFFAOYSA-N 2 0 338.923 4.350 20 0 EIADRP C[NH+]1C(C)(C)CC(n2c3ccccc3c3c2CC[C@H]([NH3+])C3)CC1(C)C ZINC001171622983 1049767711 /nfs/dbraw/zinc/76/77/11/1049767711.db2.gz FYRRCTUMTVKHRF-HNNXBMFYSA-N 2 0 339.527 4.281 20 0 EIADRP C[NH+]1C(C)(C)CC(Nc2ccc(C[NH3+])c(C(F)(F)F)c2)CC1(C)C ZINC001171625309 1049767888 /nfs/dbraw/zinc/76/78/88/1049767888.db2.gz GRROBPHULPWUJA-UHFFFAOYSA-N 2 0 343.437 4.227 20 0 EIADRP Cc1ccc(CC[C@@H](C)[NH2+]Cc2ccccc2OCC[NH+](C)C)cc1 ZINC001171664397 1049772400 /nfs/dbraw/zinc/77/24/00/1049772400.db2.gz ZBVYISIZJREAGV-LJQANCHMSA-N 2 0 340.511 4.046 20 0 EIADRP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000245550265 1049776162 /nfs/dbraw/zinc/77/61/62/1049776162.db2.gz OOAHYCYVKPMSAQ-MCIONIFRSA-N 2 0 327.299 4.141 20 0 EIADRP C[NH+]1C(C)(C)CC([N@H+]2C[C@H]3[C@@H](C2)CCC[C@@H]3OCC2CC2)CC1(C)C ZINC001171638618 1049778545 /nfs/dbraw/zinc/77/85/45/1049778545.db2.gz XJYXEHSKWPRFPE-HOJAQTOUSA-N 2 0 348.575 4.165 20 0 EIADRP C[NH+]1C(C)(C)CC([N@H+]2C[C@H]3[C@@H](C2)CCC[C@H]3OCC2CC2)CC1(C)C ZINC001171638619 1049779480 /nfs/dbraw/zinc/77/94/80/1049779480.db2.gz XJYXEHSKWPRFPE-YZGWKJHDSA-N 2 0 348.575 4.165 20 0 EIADRP COc1ccccc1C[C@@H](C)[N@H+](C)C1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001171642754 1049781087 /nfs/dbraw/zinc/78/10/87/1049781087.db2.gz MEYTYBSFHZVVGH-MRXNPFEDSA-N 2 0 332.532 4.209 20 0 EIADRP Cc1cccc2c(CC[NH3+])cn([C@@H]3C[C@H](C)[N@@H+](Cc4ccccc4)C3)c21 ZINC001171726354 1049785474 /nfs/dbraw/zinc/78/54/74/1049785474.db2.gz VERMBNJPXMICEV-GHTZIAJQSA-N 2 0 347.506 4.286 20 0 EIADRP CC1(C)C[C@@H](n2c3ccccc3nc2C[NH3+])CC[N@@H+]1Cc1ccccc1 ZINC001171966574 1049828302 /nfs/dbraw/zinc/82/83/02/1049828302.db2.gz VNDORPAFLQXIRT-SFHVURJKSA-N 2 0 348.494 4.111 20 0 EIADRP CC1(C)C[C@H]([NH+]2CCC(C(F)F)CC2)CC[N@@H+]1Cc1ccccc1 ZINC001171988968 1049831741 /nfs/dbraw/zinc/83/17/41/1049831741.db2.gz YEQIOKUWPLEYLD-GOSISDBHSA-N 2 0 336.470 4.407 20 0 EIADRP CC1(C)C[C@H]([NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)C(C)(C)O1 ZINC000245720021 1049838810 /nfs/dbraw/zinc/83/88/10/1049838810.db2.gz OOQTYJZGAFMGEI-HAGHYFMRSA-N 2 0 342.527 4.118 20 0 EIADRP Cc1ncsc1CC[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171980619 1049839453 /nfs/dbraw/zinc/83/94/53/1049839453.db2.gz WAOHHXGTOQJFNN-SFHVURJKSA-N 2 0 343.540 4.027 20 0 EIADRP CC1(C)C[C@H]([NH2+]CC2Cc3ccccc3C2)CC[N@@H+]1Cc1ccccc1 ZINC001171979042 1049839459 /nfs/dbraw/zinc/83/94/59/1049839459.db2.gz KMTYVMWTXUZCDI-HSZRJFAPSA-N 2 0 348.534 4.434 20 0 EIADRP CC1(C)C[C@@H]([NH+]2CC[C@H](c3ccccn3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171983818 1049840011 /nfs/dbraw/zinc/84/00/11/1049840011.db2.gz GWHZCPGRAPDMNJ-SFTDATJTSA-N 2 0 349.522 4.314 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1ccc(N)cc1 ZINC001171984846 1049840296 /nfs/dbraw/zinc/84/02/96/1049840296.db2.gz YCKPOFSKWIREJF-LAUBAEHRSA-N 2 0 337.511 4.363 20 0 EIADRP CO[C@@H]1CCC[N@@H+]([C@H]2C[C@H]3CCC[C@@H](C2)[NH+]3Cc2ccccc2)CC1 ZINC001172076428 1049844587 /nfs/dbraw/zinc/84/45/87/1049844587.db2.gz YMXXYPSAOGUMMB-CLAROIROSA-N 2 0 342.527 4.073 20 0 EIADRP C[C@@H](N[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccccn1 ZINC001172062337 1049850107 /nfs/dbraw/zinc/85/01/07/1049850107.db2.gz NELUWNOIFSTXJW-AYWYSENESA-N 2 0 335.495 4.318 20 0 EIADRP c1cc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)cs1 ZINC001172064441 1049850757 /nfs/dbraw/zinc/85/07/57/1049850757.db2.gz GBGFHMCZRLFEED-OWZKRDHZSA-N 2 0 326.509 4.423 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1)c1ccncc1 ZINC001172064786 1049851581 /nfs/dbraw/zinc/85/15/81/1049851581.db2.gz JPPHKUJKYSZQNR-AGOPTVSRSA-N 2 0 335.495 4.318 20 0 EIADRP CCCC(O)(CCC)C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245777053 1049853645 /nfs/dbraw/zinc/85/36/45/1049853645.db2.gz YGWYMWBIMYDRSF-WKCHPHFGSA-N 2 0 344.543 4.103 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cnc(-c3cccs3)s2)[C@@H](C)C1 ZINC000245799476 1049856518 /nfs/dbraw/zinc/85/65/18/1049856518.db2.gz XOICAUXEWHXHJJ-DZGCQCFKSA-N 2 0 335.542 4.034 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)N2C)c1ccc(C(F)(F)F)cc1 ZINC001172108352 1049856825 /nfs/dbraw/zinc/85/68/25/1049856825.db2.gz VDNJZBBOGRVKKM-OSMBCOQSSA-N 2 0 326.406 4.371 20 0 EIADRP Cc1c(C[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3C)cccc1C(F)(F)F ZINC001172106226 1049857259 /nfs/dbraw/zinc/85/72/59/1049857259.db2.gz NREYQCFCLXXIJD-PHZGNYQRSA-N 2 0 326.406 4.119 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH+]1CCC3(CCCc4ccccc43)CC1)C2 ZINC001172120679 1049858700 /nfs/dbraw/zinc/85/87/00/1049858700.db2.gz LMJOYVGRJXWKGW-WKCHPHFGSA-N 2 0 338.539 4.372 20 0 EIADRP CC(C)C[C@@H]([NH3+])c1nc2ccccc2n1[C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172118816 1049859094 /nfs/dbraw/zinc/85/90/94/1049859094.db2.gz TVWVLNATGRGVMY-VSZNYVQBSA-N 2 0 340.515 4.270 20 0 EIADRP CC(C)(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@H]1CSc2ccccc2C1 ZINC001172199246 1049869240 /nfs/dbraw/zinc/86/92/40/1049869240.db2.gz UEWMTECKUXQVBA-KZNAEPCWSA-N 2 0 332.557 4.321 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC001172319422 1049877526 /nfs/dbraw/zinc/87/75/26/1049877526.db2.gz QUNPRFHXWOVOBT-OOOLTRJPSA-N 2 0 344.543 4.080 20 0 EIADRP CCC[N@@H+]1CC[C@@H](CN[C@H](c2ccccc2)c2ccc(OC)cc2)C1 ZINC000245954242 1049882831 /nfs/dbraw/zinc/88/28/31/1049882831.db2.gz LNQZOYFYNILALM-PGRDOPGGSA-N 2 0 338.495 4.106 20 0 EIADRP C[C@@H]1CC[C@H]([NH+]2CCC3(CC[N@H+](Cc4ccoc4)C3)CC2)C[C@H]1C ZINC001172379932 1049886199 /nfs/dbraw/zinc/88/61/99/1049886199.db2.gz UJZIVSXLMXZTKI-GGPKGHCWSA-N 2 0 330.516 4.392 20 0 EIADRP CCOCC[C@H](C)[NH+]1CCC2(CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001172434439 1049902554 /nfs/dbraw/zinc/90/25/54/1049902554.db2.gz WJHKXOWSFPLNII-FQEVSTJZSA-N 2 0 344.543 4.180 20 0 EIADRP CC(C)COCC[C@@H](C)[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001172475936 1049908641 /nfs/dbraw/zinc/90/86/41/1049908641.db2.gz NQPXAQNTCOGMRU-IRLDBZIGSA-N 2 0 344.543 4.036 20 0 EIADRP CC(C)OCC[C@H](C)[N@H+]([C@@H]1C[C@H]1c1ccccc1)C1CCC([NH3+])CC1 ZINC001172439226 1049912758 /nfs/dbraw/zinc/91/27/58/1049912758.db2.gz AFGPMKKDASSXIK-KYXZJRGPSA-N 2 0 344.543 4.318 20 0 EIADRP CCCCCC[C@H](CCCC)[NH+]1CCN(CCC[NH+](C)C)CC1 ZINC001172512588 1049927184 /nfs/dbraw/zinc/92/71/84/1049927184.db2.gz RHEJAMWEIIGDKS-FQEVSTJZSA-N 2 0 325.585 4.085 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@H]1CC[C@@H]([NH+](C)C)CC1 ZINC001172570635 1049939635 /nfs/dbraw/zinc/93/96/35/1049939635.db2.gz HHNQRBFTWKGRRX-YUELXQCFSA-N 2 0 344.877 4.402 20 0 EIADRP C([NH2+]C1CCC2(CCCC2)CC1)C1CC[NH+](CC2CCOCC2)CC1 ZINC001172724262 1049966383 /nfs/dbraw/zinc/96/63/83/1049966383.db2.gz PFUIIQCIIGVHHM-UHFFFAOYSA-N 2 0 348.575 4.218 20 0 EIADRP COC(=O)N1CCC([NH2+]CCC[PH+](C(C)(C)C)C(C)(C)C)CC1 ZINC001172735221 1049969491 /nfs/dbraw/zinc/96/94/91/1049969491.db2.gz XNTRDHQPURTOOR-UHFFFAOYSA-N 2 0 344.480 4.276 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)c2sc(-c3ccc(C)cc3)nc2C)C1 ZINC000246851434 1050002723 /nfs/dbraw/zinc/00/27/23/1050002723.db2.gz COIYEYQSBOTCQA-NVXWUHKLSA-N 2 0 343.540 4.419 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc2ccccc2n1 ZINC000246879412 1050003749 /nfs/dbraw/zinc/00/37/49/1050003749.db2.gz DXRAEQFAPDHHRN-ZWKOTPCHSA-N 2 0 325.500 4.398 20 0 EIADRP CCc1nc2c(s1)[C@H]([NH2+][C@H](C)[C@H]1CCC[N@@H+](C3CCC3)C1)CCC2 ZINC000248408981 1050055799 /nfs/dbraw/zinc/05/57/99/1050055799.db2.gz WBEJTDBHONPFKX-HLLBOEOZSA-N 2 0 347.572 4.326 20 0 EIADRP CCO[C@@H]1CCC[C@H]([NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)C1 ZINC001177180991 1050164526 /nfs/dbraw/zinc/16/45/26/1050164526.db2.gz SEPCJBOWFMRBKK-FCHUYYIVSA-N 2 0 344.543 4.356 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([NH+]1CCC([N@H+](C)Cc3ccccc3)CC1)CC2 ZINC001172830118 1050168127 /nfs/dbraw/zinc/16/81/27/1050168127.db2.gz FXDFQFUCNCRAFF-XMMPIXPASA-N 2 0 348.534 4.449 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)[NH2+]CCC[NH+]1CCC(C)CC1 ZINC001172836811 1050171399 /nfs/dbraw/zinc/17/13/99/1050171399.db2.gz HSJWYIQHWMTHHZ-HNNXBMFYSA-N 2 0 326.887 4.122 20 0 EIADRP C[C@@H]1C[N@@H+](Cc2ccc(C[NH2+][C@H]3CCC[C@@H](C)CC3)cc2)C[C@H](C)O1 ZINC001177245565 1050172787 /nfs/dbraw/zinc/17/27/87/1050172787.db2.gz XOEYBIJLQXZKNC-IWQHBPENSA-N 2 0 344.543 4.354 20 0 EIADRP C[C@H]1CCC[N@H+](CCCC[NH2+]Cc2cn(C)nc2C2CCCCC2)C1 ZINC001177299277 1050180646 /nfs/dbraw/zinc/18/06/46/1050180646.db2.gz NJEBONZTLZTNCI-SFHVURJKSA-N 2 0 346.563 4.070 20 0 EIADRP COc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cc1OC ZINC000090586761 1050187546 /nfs/dbraw/zinc/18/75/46/1050187546.db2.gz JFAXXFWUQAMPBR-QZTJIDSGSA-N 2 0 348.531 4.031 20 0 EIADRP C[C@H](C[NH2+][C@@H](C)Cc1ccc(F)cc1Cl)CC(C)(C)CC[NH3+] ZINC001172861381 1050199292 /nfs/dbraw/zinc/19/92/92/1050199292.db2.gz QSKGALJWIZZNAB-KBPBESRZSA-N 2 0 328.903 4.401 20 0 EIADRP C[C@@H](CSc1ccc(Cl)cc1)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC001172877652 1050216824 /nfs/dbraw/zinc/21/68/24/1050216824.db2.gz GPSITAQJDKMDFX-AWEZNQCLSA-N 2 0 338.948 4.285 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000090963483 1050218846 /nfs/dbraw/zinc/21/88/46/1050218846.db2.gz ZNBNKCSLDIFSJP-CABCVRRESA-N 2 0 348.437 4.317 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1 ZINC001172878124 1050221028 /nfs/dbraw/zinc/22/10/28/1050221028.db2.gz INEYFFBTCPOGGA-FVQBIDKESA-N 2 0 326.937 4.283 20 0 EIADRP C[N@@H+]1CC[C@@H]([NH2+]CC2(c3ccc(F)cc3)CCCCC2)CC1(C)C ZINC001177487788 1050225005 /nfs/dbraw/zinc/22/50/05/1050225005.db2.gz PNCUNPNPNPMMTB-LJQANCHMSA-N 2 0 332.507 4.490 20 0 EIADRP C[C@@H](CSc1ccc(Cl)cc1)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC001172883857 1050225558 /nfs/dbraw/zinc/22/55/58/1050225558.db2.gz UYMZMBSYVAXANW-AWEZNQCLSA-N 2 0 338.948 4.427 20 0 EIADRP C[N@H+](Cc1ccccc1C[NH2+]C[C@H]1CCC=CO1)C1CCCCC1 ZINC000774975078 1050243874 /nfs/dbraw/zinc/24/38/74/1050243874.db2.gz AHBRVAGVNYROEU-OAQYLSRUSA-N 2 0 328.500 4.233 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+]C/C=C/c1ccc(OCc2ccccc2)cc1 ZINC001177565840 1050253569 /nfs/dbraw/zinc/25/35/69/1050253569.db2.gz JZMOLFQHOIQYAO-QPGLYAHGSA-N 2 0 338.495 4.209 20 0 EIADRP CCCc1ccc(C[NH2+]C[C@H]2CC[N@H+](CCc3ccccc3)C2)s1 ZINC001177668980 1050273692 /nfs/dbraw/zinc/27/36/92/1050273692.db2.gz LXOWZNGBARDTCF-LJQANCHMSA-N 2 0 342.552 4.355 20 0 EIADRP CC[C@H](C)CN(C)c1ccc(F)cc1C[NH2+]CCC1CC[NH+](C)CC1 ZINC001177744593 1050290840 /nfs/dbraw/zinc/29/08/40/1050290840.db2.gz XPOXNURFMMBRHZ-KRWDZBQOSA-N 2 0 349.538 4.130 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](c2ccccc2)c2ccncc2)CC1 ZINC001173101366 1050301409 /nfs/dbraw/zinc/30/14/09/1050301409.db2.gz HNCQJIODLMMOMQ-LZBANZJXSA-N 2 0 337.511 4.414 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](CCO)c2ccc(Cl)cc2)CC1 ZINC001173101289 1050302957 /nfs/dbraw/zinc/30/29/57/1050302957.db2.gz FRLUXRBRMVPHSR-CTWPCTMYSA-N 2 0 338.923 4.006 20 0 EIADRP CC[NH+](CC)C1CCC(NC(=[NH2+])C23CC4CC(CC(C4)C2)C3)CC1 ZINC001173105348 1050305492 /nfs/dbraw/zinc/30/54/92/1050305492.db2.gz QZIWWYYQQWSCKN-UHFFFAOYSA-N 2 0 331.548 4.423 20 0 EIADRP CCO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)C1 ZINC001177803798 1050305991 /nfs/dbraw/zinc/30/59/91/1050305991.db2.gz HKQKTKXNFPBOJV-FCHUYYIVSA-N 2 0 344.543 4.500 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](C)[C@@H](O)c2ccc(Cl)cc2)CC1 ZINC001173107845 1050307425 /nfs/dbraw/zinc/30/74/25/1050307425.db2.gz PILBQJZONHUHNN-VKDMSYRKSA-N 2 0 338.923 4.005 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](C)[C@H](O)c2ccc(Cl)cc2)CC1 ZINC001173107844 1050308383 /nfs/dbraw/zinc/30/83/83/1050308383.db2.gz PILBQJZONHUHNN-UJPJLTBQSA-N 2 0 338.923 4.005 20 0 EIADRP CC[NH+](CC)C1CCC(n2cc(CC[NH2+]C)c3ccccc32)CC1 ZINC001173112957 1050309149 /nfs/dbraw/zinc/30/91/49/1050309149.db2.gz FNXRHSHTWSQQCB-UHFFFAOYSA-N 2 0 327.516 4.229 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](c2ncccc2Cl)C2CC2)CC1 ZINC001173110654 1050310422 /nfs/dbraw/zinc/31/04/22/1050310422.db2.gz QPJTYESHANKMBO-HTWSVDAQSA-N 2 0 335.923 4.429 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCN(c3ccccc3Cl)CC2)CC1 ZINC001173114539 1050310758 /nfs/dbraw/zinc/31/07/58/1050310758.db2.gz ODPIGOMNLFOYKR-UHFFFAOYSA-N 2 0 349.950 4.115 20 0 EIADRP c1cncc(-c2cccc(C[N@@H+]3CC[C@@H]4[C@H](CCC[NH+]4C4CC4)C3)c2)c1 ZINC000092066480 1050314823 /nfs/dbraw/zinc/31/48/23/1050314823.db2.gz VJURAIARAHDNKP-FYYLOGMGSA-N 2 0 347.506 4.197 20 0 EIADRP C[NH+]1CCC(CCC[NH2+]C2CCC(Oc3ccccc3)CC2)CC1 ZINC001173199213 1050342101 /nfs/dbraw/zinc/34/21/01/1050342101.db2.gz XKMVGFWLJMSLOQ-UHFFFAOYSA-N 2 0 330.516 4.088 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC[NH2+]C1CCC(Oc2ccccc2)CC1 ZINC001173198162 1050343264 /nfs/dbraw/zinc/34/32/64/1050343264.db2.gz PCWCUJDIATVAOR-LWEYNCJUSA-N 2 0 330.516 4.231 20 0 EIADRP [NH3+]CCc1cn(C2CCC(Oc3ccccc3)CC2)c2cc[nH+]cc12 ZINC001173197258 1050343296 /nfs/dbraw/zinc/34/32/96/1050343296.db2.gz BBFLSCSLMOOGLE-UHFFFAOYSA-N 2 0 335.451 4.100 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H]([NH2+]C2CCC(Oc3ccccc3)CC2)[C@H](C)C1 ZINC001173202544 1050344551 /nfs/dbraw/zinc/34/45/51/1050344551.db2.gz UJNSJROBNXYYKF-AXIYNFMDSA-N 2 0 330.516 4.085 20 0 EIADRP C[C@H](CC(c1ccccc1)c1ccccc1)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001173207340 1050368393 /nfs/dbraw/zinc/36/83/93/1050368393.db2.gz QVKQXBUGCXEIDV-PTUXOGIPSA-N 2 0 348.534 4.481 20 0 EIADRP CCc1ccc(C[C@@H](C)[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC001173237242 1050395108 /nfs/dbraw/zinc/39/51/08/1050395108.db2.gz GPIMETLQGHZWRZ-AUSIDOKSSA-N 2 0 336.523 4.292 20 0 EIADRP CCSC[C@H](C)[N@H+]([C@@H]1C[C@H]1c1ccccc1)C1CCC([NH3+])CC1 ZINC001173297780 1050398324 /nfs/dbraw/zinc/39/83/24/1050398324.db2.gz WMNSJVVJMPLDEL-DQAVMHLFSA-N 2 0 332.557 4.256 20 0 EIADRP C[C@H]1C[C@@H](CC[NH2+][C@H]2CC[C@@H](C)SC2)C[N@@H+]1Cc1ccccc1 ZINC001178207158 1050404351 /nfs/dbraw/zinc/40/43/51/1050404351.db2.gz APOXJDJCPXDXKK-CUDHKJQZSA-N 2 0 332.557 4.161 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]Cc3cc(O)cc(Cl)c3)CC2)CC1 ZINC001178280456 1050426770 /nfs/dbraw/zinc/42/67/70/1050426770.db2.gz DGLURONMUGPCKG-UHFFFAOYSA-N 2 0 336.907 4.178 20 0 EIADRP CCC(CC)[N@H+](C1Cc2cc(F)c(F)cc2C1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173475896 1050459133 /nfs/dbraw/zinc/45/91/33/1050459133.db2.gz KWOKVKRUURGKTK-JCNLHEQBSA-N 2 0 336.470 4.193 20 0 EIADRP c1cncc(-c2cccc(C[NH2+]C3CC[NH+](CC4CCCC4)CC3)c2)c1 ZINC001178409455 1050463773 /nfs/dbraw/zinc/46/37/73/1050463773.db2.gz UHLASXJHADXUCQ-UHFFFAOYSA-N 2 0 349.522 4.493 20 0 EIADRP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC001173544987 1050477979 /nfs/dbraw/zinc/47/79/79/1050477979.db2.gz VDHGRYNDANWJNF-ZFWWWQNUSA-N 2 0 329.315 4.246 20 0 EIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000450740965 1050526612 /nfs/dbraw/zinc/52/66/12/1050526612.db2.gz XGNZIOTZYBGJIC-JFRXWTBNSA-N 2 0 336.470 4.168 20 0 EIADRP C[NH+](C)[C@H]1CCC[C@H]([NH2+]C2CCC3(CCc4ccccc43)CC2)C1 ZINC001173685382 1050537813 /nfs/dbraw/zinc/53/78/13/1050537813.db2.gz RUYBEULXGYOPCW-KBNVZVJVSA-N 2 0 326.528 4.276 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]C1CCC3(CCc4ccccc43)CC1)C2 ZINC001173688568 1050541635 /nfs/dbraw/zinc/54/16/35/1050541635.db2.gz IEGGVIGJQPHPBJ-NVSXCIMMSA-N 2 0 338.539 4.418 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCCOC(C)C)cc1C[NH+]1CCCCC1 ZINC000182212390 1050542775 /nfs/dbraw/zinc/54/27/75/1050542775.db2.gz CMYQPMGHEHYNMZ-SFHVURJKSA-N 2 0 348.531 4.147 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2cccs2)ccc1OC ZINC000182220928 1050550606 /nfs/dbraw/zinc/55/06/06/1050550606.db2.gz BMZPYQNOVQUAGM-HNNXBMFYSA-N 2 0 332.513 4.449 20 0 EIADRP c1cncc(-c2cccc(C[N@H+]3CC[C@@H](C[NH+]4CCCCC4)C3)c2)c1 ZINC000093683554 1050658215 /nfs/dbraw/zinc/65/82/15/1050658215.db2.gz AETPFLNUINTAGR-FQEVSTJZSA-N 2 0 335.495 4.056 20 0 EIADRP c1cc(C[N@H+]2CC[C@H](C[NH+]3CCCCC3)C2)cc(-c2ccncc2)c1 ZINC000093683661 1050658447 /nfs/dbraw/zinc/65/84/47/1050658447.db2.gz KLKKOXVKRUQHQL-HXUWFJFHSA-N 2 0 335.495 4.056 20 0 EIADRP Fc1ccc(-c2ccc(C[NH2+]CC3CC[NH+](CC4CC4)CC3)o2)cc1 ZINC001179253880 1050660082 /nfs/dbraw/zinc/66/00/82/1050660082.db2.gz UFIVFZKNYGVYHA-UHFFFAOYSA-N 2 0 342.458 4.297 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]C[C@H]1CCC[N@H+](CC2CC2)C1 ZINC001179259165 1050661814 /nfs/dbraw/zinc/66/18/14/1050661814.db2.gz SHPMGYWNNOZPQS-MRXNPFEDSA-N 2 0 340.433 4.225 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+]Cc2cc(Br)cs2)CC1 ZINC001179278303 1050668575 /nfs/dbraw/zinc/66/85/75/1050668575.db2.gz TXUAFJMQPIGBPC-UHFFFAOYSA-N 2 0 345.350 4.111 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+]Cc2ccccc2C(F)(F)F)CC1 ZINC001179278197 1050669142 /nfs/dbraw/zinc/66/91/42/1050669142.db2.gz RWMMEPNFNCOZGL-UHFFFAOYSA-N 2 0 328.422 4.306 20 0 EIADRP CC(C)(C)[C@H]1C[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCCC2)CCO1 ZINC000763533252 1050729243 /nfs/dbraw/zinc/72/92/43/1050729243.db2.gz ZETWSAUIDQAPDU-NHCUHLMSSA-N 2 0 344.543 4.356 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2csc(C(F)(F)F)c2)CC1 ZINC001179717079 1050762548 /nfs/dbraw/zinc/76/25/48/1050762548.db2.gz NDQPRPWFVPDLSK-UHFFFAOYSA-N 2 0 332.435 4.264 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2cccc(Oc3ccccn3)c2)CC1 ZINC001179969474 1050850649 /nfs/dbraw/zinc/85/06/49/1050850649.db2.gz GQVGXIINYSJECD-UHFFFAOYSA-N 2 0 339.483 4.038 20 0 EIADRP CC[C@@H](Cc1ccccc1)[N@H+](CC)Cc1ccnn1-c1cc[nH+]cc1 ZINC001180057672 1050869632 /nfs/dbraw/zinc/86/96/32/1050869632.db2.gz HMSFQHMRQSFYAL-IBGZPJMESA-N 2 0 334.467 4.111 20 0 EIADRP OC[C@H]1CCC[N@@H+]1Cc1ccccc1C[NH2+]CCC1CCCCCC1 ZINC001180310489 1050946414 /nfs/dbraw/zinc/94/64/14/1050946414.db2.gz JAZLAGYAPWUDQQ-JOCHJYFZSA-N 2 0 344.543 4.093 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]C2CCSCC2)ccc1OC ZINC000183200599 1051013688 /nfs/dbraw/zinc/01/36/88/1051013688.db2.gz ZGGZKLCEDXTNJD-OAHLLOKOSA-N 2 0 336.545 4.083 20 0 EIADRP C[NH+]1CCC2(CCC[N@@H+]2CCCc2c(Cl)cccc2Cl)CC1 ZINC001180883291 1051101817 /nfs/dbraw/zinc/10/18/17/1051101817.db2.gz GTDOOMCNNFXOOQ-UHFFFAOYSA-N 2 0 341.326 4.486 20 0 EIADRP C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000153535601 1051190346 /nfs/dbraw/zinc/19/03/46/1051190346.db2.gz SJKMZIWNLFBRTP-HUUCEWRRSA-N 2 0 348.437 4.317 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@H]2CCCS2)cc1C[NH+]1CCCCC1 ZINC000775395821 1051210419 /nfs/dbraw/zinc/21/04/19/1051210419.db2.gz MKFJRVKWBZSWRZ-QFBILLFUSA-N 2 0 348.556 4.227 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@H](OC)C(C)C)cc1C[NH+]1CCCCC1 ZINC000775396032 1051218828 /nfs/dbraw/zinc/21/88/28/1051218828.db2.gz OWYVVHMMDCBTCK-UTKZUKDTSA-N 2 0 348.531 4.003 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](CCn2ccc3cc(Cl)ccc32)CC1 ZINC001190819092 1051283520 /nfs/dbraw/zinc/28/35/20/1051283520.db2.gz SOCCVZUHELOXOJ-UHFFFAOYSA-N 2 0 347.934 4.347 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)c1ccc(OC)c(C[NH+](CC)CC)c1)[C@@H]1CCCO1 ZINC000775417831 1051292004 /nfs/dbraw/zinc/29/20/04/1051292004.db2.gz XNBJVSHTZQJSQQ-LRQRDZAKSA-N 2 0 348.531 4.145 20 0 EIADRP C([C@H]1CCC2(CCCCCC2)O1)[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001191069971 1051339440 /nfs/dbraw/zinc/33/94/40/1051339440.db2.gz JDXLWRBGTDZLKN-WOJBJXKFSA-N 2 0 334.548 4.066 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](Cc2cccc3ncccc23)C1 ZINC001191048956 1051348873 /nfs/dbraw/zinc/34/88/73/1051348873.db2.gz VLVCRMHDWSLVHU-MOPGFXCFSA-N 2 0 337.511 4.321 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H](C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C)C1 ZINC001181982682 1051363611 /nfs/dbraw/zinc/36/36/11/1051363611.db2.gz JTSZWKLVWYKHCD-MRXNPFEDSA-N 2 0 342.508 4.302 20 0 EIADRP C[C@@H]([NH2+]C1CCC(C)([NH+]2CCOCC2)CC1)c1cccc(C2CC2)c1 ZINC001182031930 1051377638 /nfs/dbraw/zinc/37/76/38/1051377638.db2.gz KORVJBCTRNFQRF-PPNDLDFTSA-N 2 0 342.527 4.248 20 0 EIADRP COc1ccc(C[N@H+](CC(C)C)CC2CC[NH+](C)CC2)cc1Cl ZINC001175601017 1051664945 /nfs/dbraw/zinc/66/49/45/1051664945.db2.gz FHKRIMGERQJSMZ-UHFFFAOYSA-N 2 0 338.923 4.148 20 0 EIADRP CC(C)C[N@H+](CC[C@@H]1CCc2ccccc21)CC1CC[NH+](C)CC1 ZINC001175601018 1051665215 /nfs/dbraw/zinc/66/52/15/1051665215.db2.gz FIHXBNXUPWHRFX-NRFANRHFSA-N 2 0 328.544 4.406 20 0 EIADRP CC(C)C[N@H+](C)CCC[NH2+][C@H](C)Cc1ccccc1C(F)(F)F ZINC001182714017 1051680697 /nfs/dbraw/zinc/68/06/97/1051680697.db2.gz KAQYUEWASHVXBD-OAHLLOKOSA-N 2 0 330.438 4.204 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1cnc2ccsc2c1 ZINC000157942163 1051687480 /nfs/dbraw/zinc/68/74/80/1051687480.db2.gz VBHCNGHWZKVUEC-CVEARBPZSA-N 2 0 331.529 4.459 20 0 EIADRP C[C@@H]1SCC[C@H]1[NH2+]C[C@@]1(C(C)(C)C)CC[N@H+](Cc2ccccc2)C1 ZINC001182726493 1051687686 /nfs/dbraw/zinc/68/76/86/1051687686.db2.gz UBWVZDNFWOZPGK-DSKINZAPSA-N 2 0 346.584 4.408 20 0 EIADRP c1cc(C[NH+]2CCC(C[NH2+]CCCC3CCCCC3)CC2)ccn1 ZINC001182783124 1051710750 /nfs/dbraw/zinc/71/07/50/1051710750.db2.gz UFCUYSUDAQHONU-UHFFFAOYSA-N 2 0 329.532 4.244 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]C2CCN(c3ccccc3)CC2)C1 ZINC000158582355 1051760287 /nfs/dbraw/zinc/76/02/87/1051760287.db2.gz RJRZWPSACDTMKH-BGYRXZFFSA-N 2 0 343.559 4.003 20 0 EIADRP C[C@H](CCc1c[nH]c2ccccc12)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC001183095483 1051785893 /nfs/dbraw/zinc/78/58/93/1051785893.db2.gz QFQVCZGBMOYIHX-MJGOQNOKSA-N 2 0 339.527 4.201 20 0 EIADRP C[C@H](CCc1c[nH]c2ccccc12)[NH2+]C[C@@H]1CCN1C1CCCC1 ZINC001183238851 1051809888 /nfs/dbraw/zinc/80/98/88/1051809888.db2.gz QKKYXJHQKFFCQI-APWZRJJASA-N 2 0 325.500 4.096 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)CCOc2cccc3ccccc32)cc1 ZINC001192909313 1051829717 /nfs/dbraw/zinc/82/97/17/1051829717.db2.gz HJHFJMCYOQZJFU-UHFFFAOYSA-N 2 0 348.490 4.412 20 0 EIADRP CC(C)(C)[PH+](CCCNC(=O)C12CCC[NH+]1CCC2)C(C)(C)C ZINC001183563959 1051862488 /nfs/dbraw/zinc/86/24/88/1051862488.db2.gz YPZKQYSJCCWRTO-UHFFFAOYSA-N 2 0 340.492 4.200 20 0 EIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]C[C@@H]1CCCC(C)(C)O1 ZINC001193092252 1051874230 /nfs/dbraw/zinc/87/42/30/1051874230.db2.gz CHHHBLITYURQBB-IZZBFERCSA-N 2 0 344.543 4.080 20 0 EIADRP C[C@H](Cc1ccc(-c2ccccc2)cc1)[NH2+][C@@H]1CC[C@H]2C[N@H+](C)C[C@H]21 ZINC001184386266 1052002261 /nfs/dbraw/zinc/00/22/61/1052002261.db2.gz AMWFWTLGJPVKGC-FJTGNWTPSA-N 2 0 334.507 4.214 20 0 EIADRP COc1ccc2cc([C@H](C)[NH2+]CCCCn3ccnc3C)ccc2c1 ZINC000164701645 1052038417 /nfs/dbraw/zinc/03/84/17/1052038417.db2.gz CFTSDEZQNFPNPE-INIZCTEOSA-N 2 0 337.467 4.484 20 0 EIADRP FC(F)(F)c1ccc(C2([NH2+][C@@H]3CC[C@H]4C[NH2+]C[C@@H]4C3)CCC2)cc1 ZINC000622043784 1052083542 /nfs/dbraw/zinc/08/35/42/1052083542.db2.gz LRZPEMSXJWATQO-GRDNDAEWSA-N 2 0 338.417 4.062 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H](c2ccccc2)c2ccc(OC)cc2)CC1 ZINC000326824533 1052101003 /nfs/dbraw/zinc/10/10/03/1052101003.db2.gz YYTKCCUASFJRCD-QFIPXVFZSA-N 2 0 338.495 4.106 20 0 EIADRP C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(C(F)(F)F)cc1 ZINC000298151753 1052108769 /nfs/dbraw/zinc/10/87/69/1052108769.db2.gz RREYFBVZMAYISE-AWEZNQCLSA-N 2 0 349.400 4.420 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1cnc(-c2ccccc2)[nH]1 ZINC001177127721 1052226597 /nfs/dbraw/zinc/22/65/97/1052226597.db2.gz KPULZKFORQUJBZ-UHFFFAOYSA-N 2 0 348.494 4.208 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cc2ccccc2cc1OC ZINC001177093051 1052228860 /nfs/dbraw/zinc/22/88/60/1052228860.db2.gz NNRZOOCNMWJQNS-KRWDZBQOSA-N 2 0 328.500 4.449 20 0 EIADRP COc1ccc([C@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)C(C)C)cc1 ZINC000171127721 1052395858 /nfs/dbraw/zinc/39/58/58/1052395858.db2.gz JMHZCAYIAVSHIM-OAQYLSRUSA-N 2 0 326.484 4.244 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3OC)cc2)C1 ZINC000174299571 1052565220 /nfs/dbraw/zinc/56/52/20/1052565220.db2.gz BEJPXKPFKLCGDY-LJQANCHMSA-N 2 0 338.495 4.184 20 0 EIADRP C[C@H](C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccccc1 ZINC000671313116 1052615786 /nfs/dbraw/zinc/61/57/86/1052615786.db2.gz ZRICXCHIZBVQSH-GOSISDBHSA-N 2 0 338.495 4.053 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cc1 ZINC000177979593 1052695741 /nfs/dbraw/zinc/69/57/41/1052695741.db2.gz GNMBLPKJDXSOGW-QGZVFWFLSA-N 2 0 326.484 4.386 20 0 EIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+]C[C@@H]1CCCC[N@@H+](C)C1 ZINC000623656915 1052698476 /nfs/dbraw/zinc/69/84/76/1052698476.db2.gz FMWKFQBMRXWOLV-SFKKXYGYSA-N 2 0 338.442 4.013 20 0 EIADRP C[C@@H]1C[C@H](NC(c2ccc(F)cc2)c2ccc(F)cc2)CC[N@@H+]1C ZINC000178606538 1052709948 /nfs/dbraw/zinc/70/99/48/1052709948.db2.gz BVCFPAQWUIFOCA-AUUYWEPGSA-N 2 0 330.422 4.127 20 0 EIADRP Clc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+][C@@H]1CCc2nc[nH]c2C1 ZINC000623985993 1052844521 /nfs/dbraw/zinc/84/45/21/1052844521.db2.gz IFNFDZVLIMEYDW-SJKOYZFVSA-N 2 0 340.858 4.069 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(F)cc1C(F)(F)F ZINC000623998521 1052850065 /nfs/dbraw/zinc/85/00/65/1052850065.db2.gz VGRQYMPDUIEVFD-GFCCVEGCSA-N 2 0 332.385 4.370 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1cc(C)ccc1C ZINC000624010108 1052852817 /nfs/dbraw/zinc/85/28/17/1052852817.db2.gz HZMJOQWTADRVHF-JOCHJYFZSA-N 2 0 344.543 4.235 20 0 EIADRP Fc1ccc2c(c1)CCC[C@@H]2[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000183160090 1052965019 /nfs/dbraw/zinc/96/50/19/1052965019.db2.gz SMGFLLMDWGBFBM-NRFANRHFSA-N 2 0 339.458 4.104 20 0 EIADRP COc1ccc(C[C@@H](C)C[NH2+]C2CC[NH+](C3CCCC3)CC2)cc1F ZINC000185301391 1053016127 /nfs/dbraw/zinc/01/61/27/1053016127.db2.gz DRMVODBCXMOTLQ-MRXNPFEDSA-N 2 0 348.506 4.010 20 0 EIADRP C[C@@H]([NH2+]CCSc1ccc(F)cc1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000185706639 1053021284 /nfs/dbraw/zinc/02/12/84/1053021284.db2.gz DKESLWHYHAKWCM-CVEARBPZSA-N 2 0 336.520 4.160 20 0 EIADRP CC(C)[C@@H]1C[C@H]([NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)CCO1 ZINC000381195272 1053057173 /nfs/dbraw/zinc/05/71/73/1053057173.db2.gz ZVBSNEPYWJPDKP-BDTNDASRSA-N 2 0 344.543 4.082 20 0 EIADRP COc1ccc(CC[C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000119683811 1053089323 /nfs/dbraw/zinc/08/93/23/1053089323.db2.gz DXAZOJNMBLSJMM-CMKODMSKSA-N 2 0 344.543 4.259 20 0 EIADRP CSC1(C[NH2+]C[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)CCC1 ZINC000381904869 1053110573 /nfs/dbraw/zinc/11/05/73/1053110573.db2.gz IKVUGFDBUZUMNF-IBGZPJMESA-N 2 0 332.557 4.164 20 0 EIADRP C[C@H]([NH2+]Cc1cnc2ccccc2c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000382169304 1053156689 /nfs/dbraw/zinc/15/66/89/1053156689.db2.gz PKKQCTFSXKLHFD-PGRDOPGGSA-N 2 0 345.490 4.235 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cc2ccccc2[nH]1 ZINC000775628272 1053221028 /nfs/dbraw/zinc/22/10/28/1053221028.db2.gz QSTOMFVCZAVHFI-AZUAARDMSA-N 2 0 347.506 4.383 20 0 EIADRP CC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)C1CCCCC1 ZINC000850516958 1053277236 /nfs/dbraw/zinc/27/72/36/1053277236.db2.gz LUEMHWCWZDFXDE-OAQYLSRUSA-N 2 0 329.532 4.242 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)C1 ZINC000339070114 1053321054 /nfs/dbraw/zinc/32/10/54/1053321054.db2.gz WPWCKUPRTRSTIP-XAPVIXHLSA-N 2 0 344.543 4.112 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]C[C@@H]2CCOC2(C)C)ccc1OC ZINC000850570785 1053324546 /nfs/dbraw/zinc/32/45/46/1053324546.db2.gz IWTBLYHAACMWCY-APWZRJJASA-N 2 0 348.531 4.003 20 0 EIADRP Cc1ccc(C[NH+]2CCC3(CC2)CC[NH+](Cc2ccccc2)CC3)o1 ZINC001203301128 1053429075 /nfs/dbraw/zinc/42/90/75/1053429075.db2.gz CZZUETMWKQKEGJ-UHFFFAOYSA-N 2 0 338.495 4.466 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(OCC[NH+](C)C)cc2)s1 ZINC000765307577 1053503593 /nfs/dbraw/zinc/50/35/93/1053503593.db2.gz ZXFMQNKWSQYDHZ-HZPDHXFCSA-N 2 0 332.513 4.409 20 0 EIADRP C[C@@H]([NH2+]Cc1cnc2c(F)cccc2c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000865523482 1053534160 /nfs/dbraw/zinc/53/41/60/1053534160.db2.gz CFQLRQRFCUOGFV-CRAIPNDOSA-N 2 0 341.474 4.117 20 0 EIADRP CC(C)(C)OC1CCC([NH2+]C2CC[NH+](C3CCCCC3)CC2)CC1 ZINC000865698120 1053575005 /nfs/dbraw/zinc/57/50/05/1053575005.db2.gz IRNRGDIDLAFNDD-UHFFFAOYSA-N 2 0 336.564 4.499 20 0 EIADRP c1ccc(C[C@@H]2CCC[C@@H]2[NH2+]CCCCC[NH+]2CCCCC2)nc1 ZINC000852566180 1053589444 /nfs/dbraw/zinc/58/94/44/1053589444.db2.gz DUYPSFSAHBFDAQ-FPOVZHCZSA-N 2 0 329.532 4.039 20 0 EIADRP CC(C)[C@@H]([NH2+]C[C@H]1CCCN(Cc2cccs2)C1)c1ccccn1 ZINC000866250512 1053665189 /nfs/dbraw/zinc/66/51/89/1053665189.db2.gz CXGHKKDMMLKPRJ-YLJYHZDGSA-N 2 0 343.540 4.342 20 0 EIADRP CN1CCC[C@H](C[NH2+][C@H](C2CCC2)[C@H]2CCCO2)[C@@H]1c1cccs1 ZINC000866271589 1053671149 /nfs/dbraw/zinc/67/11/49/1053671149.db2.gz ANQJYFWZSCWSIL-HNBVOPMISA-N 2 0 348.556 4.068 20 0 EIADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H](CCc2ccccc2)c2ccccn2)C1 ZINC000866372468 1053709545 /nfs/dbraw/zinc/70/95/45/1053709545.db2.gz GXFDBBBDCSNYRZ-IRLDBZIGSA-N 2 0 337.511 4.077 20 0 EIADRP CC[N@H+](CCCc1cccc(OC)c1)Cc1ccc(C[NH+](C)C)cc1 ZINC001196623678 1053716020 /nfs/dbraw/zinc/71/60/20/1053716020.db2.gz SKWNWBXZORXHRQ-UHFFFAOYSA-N 2 0 340.511 4.212 20 0 EIADRP Cc1c([C@H](C)[NH2+]CCC2CC[NH+](C(C)C)CC2)cnn1C(C)(C)C ZINC000866468653 1053741387 /nfs/dbraw/zinc/74/13/87/1053741387.db2.gz HIWNWUBYKLSEFK-INIZCTEOSA-N 2 0 334.552 4.108 20 0 EIADRP COc1cc([C@@H](C)[NH2+]C2CCC(C)([NH+](C)C)CC2)ccc1SC ZINC000866515655 1053765410 /nfs/dbraw/zinc/76/54/10/1053765410.db2.gz GJMANVXATXXBHJ-ICXUMSERSA-N 2 0 336.545 4.331 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386797880 1053829391 /nfs/dbraw/zinc/82/93/91/1053829391.db2.gz MFGQFWZLYGCAFY-OPYAIIAOSA-N 2 0 340.486 4.257 20 0 EIADRP C[NH+](C)CCCC(C)(C)[NH2+]Cc1ccc(-c2cccc(F)c2F)o1 ZINC001202493375 1053896536 /nfs/dbraw/zinc/89/65/36/1053896536.db2.gz AIYVNOHZNYZTEQ-UHFFFAOYSA-N 2 0 336.426 4.435 20 0 EIADRP CC(C)[N@H+](C)Cc1cc(O[C@@H]2CC[NH+](CCCC(C)(C)C)C2)ccn1 ZINC000856604484 1054092288 /nfs/dbraw/zinc/09/22/88/1054092288.db2.gz NZYAQMLBJOIJSM-HXUWFJFHSA-N 2 0 347.547 4.201 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CC[C@@H]3CC3(Cl)Cl)CC2)C1 ZINC000857065402 1054169136 /nfs/dbraw/zinc/16/91/36/1054169136.db2.gz NUACRKIZOJEBRT-FMKPAKJESA-N 2 0 333.347 4.203 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CC[C@H]2CC2(F)F)ccc1OC ZINC000857082519 1054175158 /nfs/dbraw/zinc/17/51/58/1054175158.db2.gz WUHINHLAGAPSJR-PBHICJAKSA-N 2 0 340.458 4.233 20 0 EIADRP Cc1nccn1C[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1Cl ZINC000542667114 1054180416 /nfs/dbraw/zinc/18/04/16/1054180416.db2.gz WYFZVZWIYUGQNX-LSBZLQRGSA-N 2 0 331.891 4.407 20 0 EIADRP c1ccc([C@@H](CN2CCCC2)[NH2+][C@H]2CCCc3ccccc3C2)cc1 ZINC001198901022 1054293635 /nfs/dbraw/zinc/29/36/35/1054293635.db2.gz OGUMCLBCHZDMQR-XZOQPEGZSA-N 2 0 334.507 4.361 20 0 EIADRP CS[C@H]1CCC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC001199021169 1054320386 /nfs/dbraw/zinc/32/03/86/1054320386.db2.gz CSFHVULXEFLRER-UXHICEINSA-N 2 0 332.557 4.436 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000872018297 1054331544 /nfs/dbraw/zinc/33/15/44/1054331544.db2.gz KBHLKIFEXKXWTI-FQEVSTJZSA-N 2 0 330.516 4.110 20 0 EIADRP C[C@H](C[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)Cc1ccc(C(C)(C)C)cc1 ZINC001199197851 1054362589 /nfs/dbraw/zinc/36/25/89/1054362589.db2.gz KIQHFATWCUYHLE-PKOBYXMFSA-N 2 0 328.544 4.237 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2cc(F)cc3cccnc32)C1 ZINC001199320661 1054390402 /nfs/dbraw/zinc/39/04/02/1054390402.db2.gz PIWKUODGFRSNJI-CALCHBBNSA-N 2 0 343.490 4.222 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]C2CCC3(CC3)CC2)cc1 ZINC001199328733 1054391879 /nfs/dbraw/zinc/39/18/79/1054391879.db2.gz GPDGGQBYXMUURQ-UHFFFAOYSA-N 2 0 330.516 4.220 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+][C@H]3C[C@@H](C)O[C@@H](C)C3)cc2)C1 ZINC001199321081 1054392277 /nfs/dbraw/zinc/39/22/77/1054392277.db2.gz UYJZZTKBYDONBH-AISZHWQLSA-N 2 0 344.543 4.210 20 0 EIADRP CC[C@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@H+](C)C2CCCCC2)CCO1 ZINC001199630292 1054434723 /nfs/dbraw/zinc/43/47/23/1054434723.db2.gz VKTKJEHVTOKXOB-UNMCSNQZSA-N 2 0 344.543 4.498 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](C(C)(C)CNC2CC[NH+](C3CCCCC3)CC2)C1 ZINC001199760855 1054464598 /nfs/dbraw/zinc/46/45/98/1054464598.db2.gz STJOFKUHYRCGSE-OALUTQOASA-N 2 0 349.607 4.130 20 0 EIADRP COc1cc(C[NH2+]Cc2ccc(-n3ccnc3)cc2)cc2ccccc21 ZINC001199897299 1054483735 /nfs/dbraw/zinc/48/37/35/1054483735.db2.gz XPEOGUJBWJDKAR-UHFFFAOYSA-N 2 0 343.430 4.324 20 0 EIADRP CC[C@@H]1C[C@H](C[NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)CCO1 ZINC001199896508 1054484269 /nfs/dbraw/zinc/48/42/69/1054484269.db2.gz MXEGSAHROKSQOJ-IFMALSPDSA-N 2 0 344.543 4.357 20 0 EIADRP CCC[C@@H](C)CCC[C@@H](C)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000858430857 1054489873 /nfs/dbraw/zinc/48/98/73/1054489873.db2.gz IDZQOQKGRFSYCS-RTBURBONSA-N 2 0 338.580 4.462 20 0 EIADRP [NH3+][C@H](C[C@@H]1CCC[N@H+](Cc2scnc2C2CC2)C1)C1CCCC1 ZINC000873232496 1054509580 /nfs/dbraw/zinc/50/95/80/1054509580.db2.gz RPIAAMVDYVWVOG-WMLDXEAASA-N 2 0 333.545 4.140 20 0 EIADRP COc1c(C)cc([C@H](C)[NH2+]Cc2cccc3c2CC[NH2+]C3)cc1Cl ZINC000873235557 1054512567 /nfs/dbraw/zinc/51/25/67/1054512567.db2.gz ONYMQSCCSSFUAE-AWEZNQCLSA-N 2 0 344.886 4.154 20 0 EIADRP COc1cc([C@@H](C)[NH2+][C@H](C)C2CC[NH2+]CC2)ccc1SC(F)F ZINC000873267887 1054516264 /nfs/dbraw/zinc/51/62/64/1054516264.db2.gz LKQYYSXHJXSHNR-VXGBXAGGSA-N 2 0 344.471 4.049 20 0 EIADRP C[C@@H]([NH2+][C@H]1CCCc2nc(-c3ccccc3)sc21)C1CC[NH2+]CC1 ZINC000873267852 1054516902 /nfs/dbraw/zinc/51/69/02/1054516902.db2.gz KTQZHOXQHWLSEO-PBHICJAKSA-N 2 0 341.524 4.165 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873271703 1054519574 /nfs/dbraw/zinc/51/95/74/1054519574.db2.gz JSWVWRXKMOMEAI-UONOGXRCSA-N 2 0 329.513 4.157 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2ccc(CC(C)C)nc2)CC1 ZINC001200872287 1054561984 /nfs/dbraw/zinc/56/19/84/1054561984.db2.gz MAESTYHWPMXBIB-UHFFFAOYSA-N 2 0 331.548 4.128 20 0 EIADRP Cc1cccc2c1[nH+]c(N)n2C1=C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC001201470401 1054805192 /nfs/dbraw/zinc/80/51/92/1054805192.db2.gz RTVRIOLNUIHLPP-MSOLQXFVSA-N 2 0 344.462 4.205 20 0 EIADRP COC[C@H]1C[N@H+](CC2CC2)C[C@@]12CC[NH+](C[C@H](C)CCC=C(C)C)C2 ZINC001201486254 1054814701 /nfs/dbraw/zinc/81/47/01/1054814701.db2.gz HWJDCUUUPYLZGV-FCEUIQTBSA-N 2 0 348.575 4.049 20 0 EIADRP c1cc(C[N@H+]2CCC3(C2)CC[NH+](CCCc2ccccc2)CC3)co1 ZINC001201662820 1054879092 /nfs/dbraw/zinc/87/90/92/1054879092.db2.gz KWJSGSVRXBPOSZ-UHFFFAOYSA-N 2 0 338.495 4.200 20 0 EIADRP Cc1c(C[NH+]2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)ccnc1F ZINC000862251171 1055034268 /nfs/dbraw/zinc/03/42/68/1055034268.db2.gz WUAJQRXHWSJKNB-INIZCTEOSA-N 2 0 333.495 4.006 20 0 EIADRP CCO[C@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)C1 ZINC001202288320 1055124826 /nfs/dbraw/zinc/12/48/26/1055124826.db2.gz AZEBTNZZKJDQHO-YADHBBJMSA-N 2 0 344.543 4.356 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CC[C@H]2CCC[N@@H+]2C)ccc1OCCC(C)C ZINC001168604127 1055151226 /nfs/dbraw/zinc/15/12/26/1055151226.db2.gz KYBQANZSVTWHHW-IEBWSBKVSA-N 2 0 348.531 4.255 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1cn(C(F)F)c2ccccc12 ZINC000863546112 1055226744 /nfs/dbraw/zinc/22/67/44/1055226744.db2.gz JKIZTMMDQIPBSC-LBPRGKRZSA-N 2 0 344.409 4.049 20 0 EIADRP C[C@H](Cc1ccsc1)[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000542776147 1055972437 /nfs/dbraw/zinc/97/24/37/1055972437.db2.gz VDNLQTFQORFZME-UWVAXJGDSA-N 2 0 328.525 4.179 20 0 EIADRP C[C@H]([NH2+]CCCc1cccs1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000542818641 1056115514 /nfs/dbraw/zinc/11/55/14/1056115514.db2.gz XZRXJUXHEZVART-HKUYNNGSSA-N 2 0 328.525 4.181 20 0 EIADRP C[N@@H+](Cc1cccc2cnccc21)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000183294984 1059980688 /nfs/dbraw/zinc/98/06/88/1059980688.db2.gz CYYNSBRIAXXUFC-FQEVSTJZSA-N 2 0 345.490 4.189 20 0 EIADRP C[C@@H]1CCCC[C@H]1C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001168825267 1060428379 /nfs/dbraw/zinc/42/83/79/1060428379.db2.gz HRUOHJMONODKKW-QUCCMNQESA-N 2 0 329.532 4.446 20 0 EIADRP COc1ccc2c(c1)CCC[C@@H]2[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000766511278 1060431263 /nfs/dbraw/zinc/43/12/63/1060431263.db2.gz CNSMLNMVMBVDBP-AJTFCVKESA-N 2 0 342.527 4.459 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)CCc2nsc3ccccc32)cc1 ZINC001168839027 1060451865 /nfs/dbraw/zinc/45/18/65/1060451865.db2.gz QJPVUTBBLSSSEK-UHFFFAOYSA-N 2 0 339.508 4.032 20 0 EIADRP C[C@H]1C[N@H+](Cc2cccc(C(F)(F)F)c2Cl)CCC[C@@H]1C[NH3+] ZINC001205995739 1060510402 /nfs/dbraw/zinc/51/04/02/1060510402.db2.gz PTMFGELENJHKPF-NWDGAFQWSA-N 2 0 334.813 4.166 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CCC[NH+](C(C)C)C(C)C)cc1 ZINC000348093937 1060551149 /nfs/dbraw/zinc/55/11/49/1060551149.db2.gz VFGVKMDEDNRGLP-GOSISDBHSA-N 2 0 342.531 4.340 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C(C)(C)c1cc(Cl)cc(Cl)c1)C2 ZINC001169101336 1060635796 /nfs/dbraw/zinc/63/57/96/1060635796.db2.gz RESCQYXJMXCGIH-MUJYYYPQSA-N 2 0 327.299 4.443 20 0 EIADRP CC1(C)C[C@H](Nc2cc(N3CCCCC3)cc[nH+]2)C[C@@](C)(C[NH3+])C1 ZINC001169147491 1060665622 /nfs/dbraw/zinc/66/56/22/1060665622.db2.gz XBRIIXYKLIQNTE-OXJNMPFZSA-N 2 0 330.520 4.028 20 0 EIADRP CC[N@H+](Cc1ccc(C(F)(F)F)cc1)[C@H]1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC001169154970 1060670575 /nfs/dbraw/zinc/67/05/75/1060670575.db2.gz VGTCDVTZZDTYDA-FVQHAEBGSA-N 2 0 326.406 4.153 20 0 EIADRP Cc1ccsc1C[N@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001204024435 1060797138 /nfs/dbraw/zinc/79/71/38/1060797138.db2.gz XSJVLGXUUFDVPY-UHFFFAOYSA-N 2 0 328.525 4.401 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@@H]3C)s2)cc1 ZINC000532249384 1032110274 /nfs/dbraw/zinc/11/02/74/1032110274.db2.gz WYXNNSZKMKCTEY-YZVOILCLSA-N 2 0 344.524 4.242 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)C1CC[NH+](C)CC1)c1ccccc1OC(F)F ZINC000151935340 1032136944 /nfs/dbraw/zinc/13/69/44/1032136944.db2.gz LJDYYPQBPBGPPQ-BBRMVZONSA-N 2 0 326.431 4.059 20 0 EIADRP CC[C@@H]1C[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)CCO1 ZINC000648438665 1032308899 /nfs/dbraw/zinc/30/88/99/1032308899.db2.gz YRVYQQCHBGBGSC-LEWJYISDSA-N 2 0 330.516 4.110 20 0 EIADRP CC[C@H]1C[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)CCO1 ZINC000648438133 1032310351 /nfs/dbraw/zinc/31/03/51/1032310351.db2.gz RFZZXRRBHPRODL-SFTDATJTSA-N 2 0 330.516 4.110 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]Cc2ccc(Sc3ccccc3)cc2)CC[N@@H+]1C ZINC000532804326 1032322575 /nfs/dbraw/zinc/32/25/75/1032322575.db2.gz BEVNNXQPISFUKI-WMZOPIPTSA-N 2 0 326.509 4.410 20 0 EIADRP Cc1c2ccccc2oc1[C@@H](C)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459383840 1032396949 /nfs/dbraw/zinc/39/69/49/1032396949.db2.gz FWEAZMUJIWRITL-MRXNPFEDSA-N 2 0 335.451 4.456 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)cc1 ZINC000120743000 1032412828 /nfs/dbraw/zinc/41/28/28/1032412828.db2.gz NETRYIDIIARNPJ-UNMCSNQZSA-N 2 0 338.495 4.006 20 0 EIADRP CC(C)[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1 ZINC000392157079 1032419425 /nfs/dbraw/zinc/41/94/25/1032419425.db2.gz PANDHVLGWWCETH-FQEVSTJZSA-N 2 0 327.447 4.176 20 0 EIADRP CC[N@H+](CC=C(C)C)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 ZINC000533074421 1032474395 /nfs/dbraw/zinc/47/43/95/1032474395.db2.gz DSOZDWXLZDAURN-UHFFFAOYSA-N 2 0 330.520 4.165 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1cnc2ccsc2c1 ZINC000120953642 1032481990 /nfs/dbraw/zinc/48/19/90/1032481990.db2.gz VHZIXUOWTUZURC-ZDUSSCGKSA-N 2 0 343.471 4.348 20 0 EIADRP CC[C@H](C)Oc1cc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)ccc1OC ZINC000666755297 1032510578 /nfs/dbraw/zinc/51/05/78/1032510578.db2.gz KMCOEADNZASEOO-HOTGVXAUSA-N 2 0 342.483 4.182 20 0 EIADRP FC1(F)CC(C[N@@H+]2CC[C@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000450499641 1032541065 /nfs/dbraw/zinc/54/10/65/1032541065.db2.gz JJFKJTIQZGGCHZ-OALUTQOASA-N 2 0 334.454 4.018 20 0 EIADRP FC1(F)CC(C[N@@H+]2CC[C@@H]3[C@@H](CCC[NH+]3Cc3ccccc3)C2)C1 ZINC000450499642 1032541248 /nfs/dbraw/zinc/54/12/48/1032541248.db2.gz JJFKJTIQZGGCHZ-RBUKOAKNSA-N 2 0 334.454 4.018 20 0 EIADRP COc1ccccc1-c1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)cc1 ZINC000093089039 1032656498 /nfs/dbraw/zinc/65/64/98/1032656498.db2.gz BTDJTKAZFJLKMS-UHFFFAOYSA-N 2 0 338.495 4.136 20 0 EIADRP CCC[N@H+](CC)Cc1ccc(-c2nc([C@H]([NH3+])CC(C)C)no2)cc1 ZINC000339392476 1018838773 /nfs/dbraw/zinc/83/87/73/1018838773.db2.gz FFIAJDWGVKSPBU-QGZVFWFLSA-N 2 0 330.476 4.014 20 0 EIADRP COc1ccc(-c2ccccc2)cc1CNC[C@H]1CC[N@@H+](C(C)C)C1 ZINC000579765406 1018873526 /nfs/dbraw/zinc/87/35/26/1018873526.db2.gz XUVIFFJWQLZYET-GOSISDBHSA-N 2 0 338.495 4.182 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1OC ZINC000643545865 1018892705 /nfs/dbraw/zinc/89/27/05/1018892705.db2.gz DRYHUKFHIAWWPC-FUHWJXTLSA-N 2 0 346.515 4.199 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC[NH2+]C2(CCC2)C1)c1ccc(Br)cc1 ZINC000643546170 1018898784 /nfs/dbraw/zinc/89/87/84/1018898784.db2.gz JXMBMOPLNXMPFK-CVEARBPZSA-N 2 0 337.305 4.165 20 0 EIADRP C[NH+](C)CC(C)(C)C[NH2+]Cc1ccc(OCc2cccc(F)c2)cc1 ZINC000683141525 1018907980 /nfs/dbraw/zinc/90/79/80/1018907980.db2.gz YPAXAOYRJSINOW-UHFFFAOYSA-N 2 0 344.474 4.082 20 0 EIADRP C[NH+](C)[C@H]1CCC[N@H+](CCCc2ccc(C(F)(F)F)cc2)CC1 ZINC000683227150 1019544583 /nfs/dbraw/zinc/54/45/83/1019544583.db2.gz CCPLVWMVXCFVGI-KRWDZBQOSA-N 2 0 328.422 4.054 20 0 EIADRP C[N@H+](Cc1ccccc1NC(=O)CCCCCC[NH3+])C1CCCCC1 ZINC000237166636 1032850466 /nfs/dbraw/zinc/85/04/66/1032850466.db2.gz IWSWXGIRNUIYKG-UHFFFAOYSA-N 2 0 345.531 4.299 20 0 EIADRP Cc1ccccc1C[NH+]1CCC(N[C@H](C)c2ccc(Cl)cn2)CC1 ZINC000274875953 1019825893 /nfs/dbraw/zinc/82/58/93/1019825893.db2.gz GOMVNKIFWDYMKT-MRXNPFEDSA-N 2 0 343.902 4.359 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000579869411 1019826859 /nfs/dbraw/zinc/82/68/59/1019826859.db2.gz DVIBUXJRQAABDP-QFIPXVFZSA-N 2 0 349.478 4.239 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)cn2)c1 ZINC000274912113 1019853361 /nfs/dbraw/zinc/85/33/61/1019853361.db2.gz NHXYPABTEXVOKI-HNNXBMFYSA-N 2 0 331.891 4.428 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3c2cc(F)cc3F)c1 ZINC000121279942 1020794880 /nfs/dbraw/zinc/79/48/80/1020794880.db2.gz NNUAFLAQVZWUOA-FQEVSTJZSA-N 2 0 330.422 4.194 20 0 EIADRP c1ccc(C[NH+]2CCC(C[NH2+]Cc3cccc4cccnc43)CC2)cc1 ZINC000397511611 1020890024 /nfs/dbraw/zinc/89/00/24/1020890024.db2.gz MZDCYSZVMAIHSR-UHFFFAOYSA-N 2 0 345.490 4.237 20 0 EIADRP CC(C)[C@H]1CC[C@@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000579939189 1020905789 /nfs/dbraw/zinc/90/57/89/1020905789.db2.gz ORECVWPARJEOEJ-YADHBBJMSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@@H](Oc1ccc(Cl)cc1Cl)[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655804784 1020972360 /nfs/dbraw/zinc/97/23/60/1020972360.db2.gz BKJDXRAYDDKWFZ-SFDCQRBFSA-N 2 0 345.314 4.079 20 0 EIADRP Cc1cccc([C@@H]([NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c2cccc(F)c2)c1 ZINC000655803945 1020975722 /nfs/dbraw/zinc/97/57/22/1020975722.db2.gz JKSIZLTUBOIEPE-TYCQWZJGSA-N 2 0 326.459 4.153 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000655805907 1020976026 /nfs/dbraw/zinc/97/60/26/1020976026.db2.gz URURYZRGZULPRK-OAUYIBNBSA-N 2 0 326.406 4.086 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1cccc(OCc2ccccc2)c1 ZINC000655805689 1020976496 /nfs/dbraw/zinc/97/64/96/1020976496.db2.gz KEXYDCNTDGYCRV-QFUCXCTJSA-N 2 0 338.495 4.256 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655806182 1020976603 /nfs/dbraw/zinc/97/66/03/1020976603.db2.gz QRCOGRZSAYMOJK-AEGPPILISA-N 2 0 347.503 4.248 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000655823940 1020991559 /nfs/dbraw/zinc/99/15/59/1020991559.db2.gz CVAZIJBCMPDEFU-GSXCWMCISA-N 2 0 344.449 4.027 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655825072 1020992583 /nfs/dbraw/zinc/99/25/83/1020992583.db2.gz VPVQGJXSAMIQEX-VOQZQIFKSA-N 2 0 326.406 4.039 20 0 EIADRP Cc1ccncc1[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000683691513 1021099265 /nfs/dbraw/zinc/09/92/65/1021099265.db2.gz YNVFDSFOHIZERQ-ZIBCJSCZSA-N 2 0 335.495 4.236 20 0 EIADRP CC[C@H]1CN(Cc2c(OC(F)F)ccc3ccccc32)CC[C@@H]1[NH3+] ZINC000647498169 1021623676 /nfs/dbraw/zinc/62/36/76/1021623676.db2.gz BXDSOQLSCBITEI-GUYCJALGSA-N 2 0 334.410 4.000 20 0 EIADRP Cc1nc(C)c([C@H](C)[NH2+]C[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)s1 ZINC000376165589 1021639778 /nfs/dbraw/zinc/63/97/78/1021639778.db2.gz ZQUICPWTRUDVGG-KKXDTOCCSA-N 2 0 329.513 4.104 20 0 EIADRP C[NH+](C)C1CC[NH+](CC(Cc2ccccc2)Cc2ccccc2)CC1 ZINC000685833980 1021649073 /nfs/dbraw/zinc/64/90/73/1021649073.db2.gz DAWAHRZGEBYRCT-UHFFFAOYSA-N 2 0 336.523 4.114 20 0 EIADRP Fc1ccc(CC[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000685845601 1021711115 /nfs/dbraw/zinc/71/11/15/1021711115.db2.gz CFXDXEQRMMONLO-QGZVFWFLSA-N 2 0 346.877 4.133 20 0 EIADRP CCc1ccccc1[C@H](N)C[NH2+][C@H]1CCC[C@H](c2ncccc2C)C1 ZINC000580302500 1021829762 /nfs/dbraw/zinc/82/97/62/1021829762.db2.gz WXTRPZISMMDWRZ-IRFCIJBXSA-N 2 0 337.511 4.268 20 0 EIADRP CC(C)[C@@H](C[NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccccc1 ZINC000613259812 1021832917 /nfs/dbraw/zinc/83/29/17/1021832917.db2.gz FRQRHRMNZZQREP-JOCHJYFZSA-N 2 0 340.511 4.156 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H]2CCc3ccc(OC)cc32)cc1 ZINC000173228507 1021872939 /nfs/dbraw/zinc/87/29/39/1021872939.db2.gz JQMGIHIHUPKGPJ-JOCHJYFZSA-N 2 0 338.495 4.314 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1csc(-c2ccccc2)n1 ZINC000414169527 1022019639 /nfs/dbraw/zinc/01/96/39/1022019639.db2.gz BGFOFIAVLFHPPW-HOTGVXAUSA-N 2 0 329.513 4.193 20 0 EIADRP C[N@@H+]1CCC[C@H](CC[NH2+][C@@H](c2cc3ccccc3o2)c2cccnc2)C1 ZINC000414170382 1022022289 /nfs/dbraw/zinc/02/22/89/1022022289.db2.gz BYYWSLMPMFOGJZ-VGOFRKELSA-N 2 0 349.478 4.239 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1csc(-c2ccccc2F)n1 ZINC000414193958 1022089470 /nfs/dbraw/zinc/08/94/70/1022089470.db2.gz UCIIGDPNIDCMKY-GJZGRUSLSA-N 2 0 347.503 4.332 20 0 EIADRP Clc1cccc2c1SCC[C@@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447555105 1033033044 /nfs/dbraw/zinc/03/30/44/1033033044.db2.gz BVPXPGNZXWMDHT-KRWDZBQOSA-N 2 0 336.932 4.341 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](CCSc2ccccc2F)CC1 ZINC000613491538 1022163807 /nfs/dbraw/zinc/16/38/07/1022163807.db2.gz WSJQQRUSTCNLOS-UHFFFAOYSA-N 2 0 338.536 4.362 20 0 EIADRP c1ccc(CC2(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CCCCC2)cc1 ZINC000471592360 1022201819 /nfs/dbraw/zinc/20/18/19/1022201819.db2.gz DJPQTPURGMURLR-NHCUHLMSSA-N 2 0 326.528 4.396 20 0 EIADRP CC[N@H+](CCC1CC[NH+](C[C@H](OC)c2ccccc2)CC1)CC1CC1 ZINC000549387777 1022204602 /nfs/dbraw/zinc/20/46/02/1022204602.db2.gz PIPYXMHVFSMEPF-QFIPXVFZSA-N 2 0 344.543 4.208 20 0 EIADRP CO[C@](C)([C@H](C)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)C1CC1 ZINC000414249797 1022309146 /nfs/dbraw/zinc/30/91/46/1022309146.db2.gz XINUBNHKNBESPJ-SQIAZXFVSA-N 2 0 344.543 4.223 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCC[NH+](C[C@@H]2CCCC23CCOCC3)C1 ZINC001167424091 1022317176 /nfs/dbraw/zinc/31/71/76/1022317176.db2.gz AXNRWPIMZJTFCO-HKBOAZHASA-N 2 0 348.575 4.170 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1cncc(Br)c1 ZINC000580659959 1022347711 /nfs/dbraw/zinc/34/77/11/1022347711.db2.gz MARLMWJFOQTYLG-ZIAGYGMSSA-N 2 0 342.325 4.005 20 0 EIADRP c1c2ccccc2[nH]c1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000684021629 1022362411 /nfs/dbraw/zinc/36/24/11/1022362411.db2.gz QQRKONQFTMXEJR-UHFFFAOYSA-N 2 0 325.500 4.256 20 0 EIADRP C[C@H](Cc1ccc(F)cc1)[NH2+][C@@H]1CCN(Cc2ccccc2)C[C@@H]1C ZINC000398165577 1022409154 /nfs/dbraw/zinc/40/91/54/1022409154.db2.gz GSYBSAHFRJSWIH-NJNPRVFISA-N 2 0 340.486 4.257 20 0 EIADRP CCOc1cccc2cc([C@H](C)[NH2+]CC3CC[NH+](CC)CC3)oc21 ZINC000580791506 1022500882 /nfs/dbraw/zinc/50/08/82/1022500882.db2.gz QHZLHVMOICTDPG-HNNXBMFYSA-N 2 0 330.472 4.214 20 0 EIADRP c1cc(-c2nc(C[N@@H+]3CCC[C@@H]([C@@H]4CCC[NH2+]C4)C3)cs2)cs1 ZINC000647542795 1022777569 /nfs/dbraw/zinc/77/75/69/1022777569.db2.gz BXMMMHGZBCDVMS-HUUCEWRRSA-N 2 0 347.553 4.083 20 0 EIADRP Clc1cc2cccnc2c(C[N@@H+]2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c1 ZINC000647543894 1022797414 /nfs/dbraw/zinc/79/74/14/1022797414.db2.gz UDWOJAYPLJFYHZ-IAGOWNOFSA-N 2 0 343.902 4.100 20 0 EIADRP C[C@H]([NH2+]CCc1c(F)cccc1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000402101120 1022800425 /nfs/dbraw/zinc/80/04/25/1022800425.db2.gz VGCRZWLMUXDAJU-FUHWJXTLSA-N 2 0 344.449 4.008 20 0 EIADRP CCOc1cccc(C[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)c1 ZINC000311003475 1022812071 /nfs/dbraw/zinc/81/20/71/1022812071.db2.gz KGMUZTVRSYCCND-QFIPXVFZSA-N 2 0 338.495 4.087 20 0 EIADRP CC[NH+]1CCC(CC2CC[NH+](Cc3cccc(F)c3OC)CC2)CC1 ZINC001143537405 1033085209 /nfs/dbraw/zinc/08/52/09/1033085209.db2.gz WBKOJBSVMLZYAI-UHFFFAOYSA-N 2 0 348.506 4.168 20 0 EIADRP Fc1ccc([C@H]2C[C@H]([NH2+]C3CC[NH+](C4CCCC4)CC3)CCO2)cc1 ZINC000363863324 1022867039 /nfs/dbraw/zinc/86/70/39/1022867039.db2.gz KMJMBPYEJWDPPE-TZIWHRDSSA-N 2 0 346.490 4.042 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1)C1CC[NH+](C)CC1 ZINC000311094459 1022878277 /nfs/dbraw/zinc/87/82/77/1022878277.db2.gz QMEYJPGXDUMWDO-GOSISDBHSA-N 2 0 338.495 4.086 20 0 EIADRP CC[NH2+]CC1CCN(Cc2csc(Nc3ccc(C)cc3)n2)CC1 ZINC000430540746 1022890745 /nfs/dbraw/zinc/89/07/45/1022890745.db2.gz AMOYIZSSRDZQDY-UHFFFAOYSA-N 2 0 344.528 4.017 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)C[C@H](C)O1 ZINC000581231725 1022892123 /nfs/dbraw/zinc/89/21/23/1022892123.db2.gz GVIPEHBNXGJLGA-WGMWDUQUSA-N 2 0 330.516 4.108 20 0 EIADRP CC(C)c1ccc(-c2ncc(C[N@@H+]3CCC[C@@H]([C@@H](C)[NH3+])C3)s2)cc1 ZINC000430556795 1023005536 /nfs/dbraw/zinc/00/55/36/1023005536.db2.gz VKDCODRWJDXUEO-CRAIPNDOSA-N 2 0 343.540 4.493 20 0 EIADRP CC[N@H+](Cc1ccc(Cl)cc1C(F)(F)F)C1CCN(C)CC1 ZINC001143505964 1023028660 /nfs/dbraw/zinc/02/86/60/1023028660.db2.gz QMOBTSHOIKVSOR-UHFFFAOYSA-N 2 0 334.813 4.275 20 0 EIADRP C[C@@H](CSC(C)(C)C)[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000165313484 1023029004 /nfs/dbraw/zinc/02/90/04/1023029004.db2.gz PINRHQNEEJFJCZ-PKOBYXMFSA-N 2 0 334.573 4.061 20 0 EIADRP Clc1oc2ccccc2c1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000628423993 1023039599 /nfs/dbraw/zinc/03/95/99/1023039599.db2.gz TTWLRDPGMAHZKC-UHFFFAOYSA-N 2 0 341.842 4.240 20 0 EIADRP C[C@H](C[NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000565272512 1023083190 /nfs/dbraw/zinc/08/31/90/1023083190.db2.gz OSCKFYHBKYCPCS-CQSZACIVSA-N 2 0 328.422 4.130 20 0 EIADRP C[N@@H+]1CC[C@@H]2[C@H](CCC[NH+]2Cc2ccc(-c3ccccc3F)o2)C1 ZINC000584687839 1023188686 /nfs/dbraw/zinc/18/86/86/1023188686.db2.gz PXEIDOKANLTINQ-DNVCBOLYSA-N 2 0 328.431 4.002 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@@H](C)Cc2ccsc2)CC1 ZINC000584760793 1023290520 /nfs/dbraw/zinc/29/05/20/1023290520.db2.gz GBWNMDLBEAGIFK-ZWKOTPCHSA-N 2 0 342.552 4.364 20 0 EIADRP CC[C@@H](c1ccc(Br)cc1)[NH+]1CCC(C[NH+](C)C)CC1 ZINC000472647264 1023307035 /nfs/dbraw/zinc/30/70/35/1023307035.db2.gz FELSKLHJLFWBJS-KRWDZBQOSA-N 2 0 339.321 4.174 20 0 EIADRP c1ccc([C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C2CCC2)cc1 ZINC000641784118 1023317639 /nfs/dbraw/zinc/31/76/39/1023317639.db2.gz WODPNJANWBAHAY-JOCHJYFZSA-N 2 0 342.527 4.008 20 0 EIADRP COC[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCC1)c1ccccc1 ZINC000581539731 1023343889 /nfs/dbraw/zinc/34/38/89/1023343889.db2.gz RHOHZNZORYHITB-QFIPXVFZSA-N 2 0 338.495 4.150 20 0 EIADRP CC(C)c1ccc(-c2ncc(C[NH+]3CCC(C[NH3+])CC3)s2)cc1 ZINC000430611627 1023364607 /nfs/dbraw/zinc/36/46/07/1023364607.db2.gz PBVICKUAVOYQAO-UHFFFAOYSA-N 2 0 329.513 4.104 20 0 EIADRP Cc1cc(C[NH2+]C[C@H]2CC[C@H](C[NH3+])CC2)ccc1Oc1cccnc1 ZINC000415028496 1023396663 /nfs/dbraw/zinc/39/66/63/1023396663.db2.gz YWMILVPTNJBPSI-IYARVYRRSA-N 2 0 339.483 4.037 20 0 EIADRP Cc1ccc(-c2nc(CN3CCCC[C@H]3[C@@H]3CC[NH2+]C3)cs2)cc1 ZINC000415034249 1023402505 /nfs/dbraw/zinc/40/25/05/1023402505.db2.gz CLTYFKNSNKWGIW-MJGOQNOKSA-N 2 0 341.524 4.083 20 0 EIADRP Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC000924605110 1023404751 /nfs/dbraw/zinc/40/47/51/1023404751.db2.gz SLMZKURXTBIRGN-INIZCTEOSA-N 2 0 341.499 4.374 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@H](CCC[NH3+])c2ccccc2)CC1 ZINC000415052866 1023409807 /nfs/dbraw/zinc/40/98/07/1023409807.db2.gz LVQOOQNRRYKSRT-STZQEDGTSA-N 3 0 343.559 4.099 20 0 EIADRP Cc1ccc(-c2ncc(C[NH2+][C@@H](CCC[NH3+])c3ccccc3)s2)o1 ZINC000415044755 1023409906 /nfs/dbraw/zinc/40/99/06/1023409906.db2.gz BCMPDNRTZDOLJV-KRWDZBQOSA-N 2 0 341.480 4.281 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc(F)c(C(F)(F)F)c1)c1ccccc1 ZINC000415051934 1023409939 /nfs/dbraw/zinc/40/99/39/1023409939.db2.gz KAMDGTOEIAUECW-QGZVFWFLSA-N 2 0 340.364 4.414 20 0 EIADRP CC(C)c1ccc([C@H](C)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000656679292 1023428150 /nfs/dbraw/zinc/42/81/50/1023428150.db2.gz WYSYFEWHSZIFFY-SFHVURJKSA-N 2 0 344.543 4.352 20 0 EIADRP CN1CC[C@@H]([NH2+]CC(C)(C)Oc2ccccc2)C[C@@H]1c1ccccc1 ZINC000581621801 1023440870 /nfs/dbraw/zinc/44/08/70/1023440870.db2.gz HGAOZWZIEBGCFV-TZIWHRDSSA-N 2 0 338.495 4.269 20 0 EIADRP COc1ccc([C@@H]([NH2+]C2CCC([NH3+])CC2)c2ccccc2Cl)cc1 ZINC000415090862 1023442360 /nfs/dbraw/zinc/44/23/60/1023442360.db2.gz PLXQHZZMZDKZNL-ALLBUHFWSA-N 2 0 344.886 4.298 20 0 EIADRP CCOc1ccc([C@H]([NH2+]C2CCC(C[NH3+])CC2)c2ccccc2)cc1 ZINC000415105425 1023445519 /nfs/dbraw/zinc/44/55/19/1023445519.db2.gz MFNOQIQGXXNHAP-INXVGGANSA-N 2 0 338.495 4.282 20 0 EIADRP C[C@H](C[NH2+][C@H]1CCN[C@@H](c2ccccc2)C1)c1ccc(F)cc1F ZINC000415121014 1023451637 /nfs/dbraw/zinc/45/16/37/1023451637.db2.gz YSKPEYXAAKBRNR-CFLQYTFWSA-N 2 0 330.422 4.151 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cc(Br)ccc1F ZINC000019914640 1023452909 /nfs/dbraw/zinc/45/29/09/1023452909.db2.gz OXHOOAJRZPTUJZ-CYBMUJFWSA-N 2 0 345.300 4.188 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]Cc1cccc2c1NCC2 ZINC000415129051 1023454601 /nfs/dbraw/zinc/45/46/01/1023454601.db2.gz YHUFKBVNEHGCSG-GOSISDBHSA-N 2 0 349.522 4.319 20 0 EIADRP c1sc(C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)nc1-c1ccccc1 ZINC000656784829 1023531824 /nfs/dbraw/zinc/53/18/24/1023531824.db2.gz HSQOAODBBXUUGG-GOSISDBHSA-N 2 0 341.524 4.022 20 0 EIADRP CC[C@H]([NH2+][C@H]1CC[NH2+]C(C)(C)C1)c1ccc(Br)cc1 ZINC000709357890 1023574061 /nfs/dbraw/zinc/57/40/61/1023574061.db2.gz WAINSYMLZKICNH-GJZGRUSLSA-N 2 0 325.294 4.020 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)c2cnc(C)s2)cc1 ZINC000090403129 1023620328 /nfs/dbraw/zinc/62/03/28/1023620328.db2.gz QKJASANGKRJSQW-HNNXBMFYSA-N 2 0 347.528 4.023 20 0 EIADRP Cc1n[nH]cc1C1CC[NH+]([C@H](C)c2ccc(-n3ccnc3C)cc2)CC1 ZINC000377632569 1023649053 /nfs/dbraw/zinc/64/90/53/1023649053.db2.gz SYRAFZGIQXJMSZ-MRXNPFEDSA-N 2 0 349.482 4.153 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc(Cl)cc1 ZINC000398097549 1023683108 /nfs/dbraw/zinc/68/31/08/1023683108.db2.gz KWUSLTALRXMGNE-OXJNMPFZSA-N 2 0 328.887 4.340 20 0 EIADRP Cc1ccc([C@@H](C2CC2)[N@@H+](C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1 ZINC000377688615 1023687133 /nfs/dbraw/zinc/68/71/33/1023687133.db2.gz AFPXSLHYNQRNEL-VABKMULXSA-N 2 0 349.522 4.466 20 0 EIADRP Cc1cc(F)ccc1-c1ccc(CN[C@H]2CC[N@@H+]3CCC[C@H]3C2)o1 ZINC000377750836 1023741656 /nfs/dbraw/zinc/74/16/56/1023741656.db2.gz WTCJWEDELPJKBG-IRXDYDNUSA-N 2 0 328.431 4.111 20 0 EIADRP C/C(=C\c1ccccc1C(F)(F)F)C[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000500405437 1023800976 /nfs/dbraw/zinc/80/09/76/1023800976.db2.gz ROVJHGXZFYEPBI-NTCAYCPXSA-N 2 0 340.433 4.430 20 0 EIADRP COc1cccc([C@H](C)[N@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC000430710902 1023965642 /nfs/dbraw/zinc/96/56/42/1023965642.db2.gz UYBMRFRSVCJWNL-ICSRJNTNSA-N 2 0 338.495 4.210 20 0 EIADRP COCC[C@@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2ccccc2)CC1 ZINC000660677824 1024012567 /nfs/dbraw/zinc/01/25/67/1024012567.db2.gz PJVIUZJXKRQJNP-QFIPXVFZSA-N 2 0 338.495 4.018 20 0 EIADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000510673080 1024207493 /nfs/dbraw/zinc/20/74/93/1024207493.db2.gz YMOKLAIZALSYGV-ACRUOGEOSA-N 2 0 332.507 4.059 20 0 EIADRP CC[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000510671960 1024207703 /nfs/dbraw/zinc/20/77/03/1024207703.db2.gz ROOZVPMIOSWFJY-WBVHZDCISA-N 2 0 342.449 4.348 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CCN2CCCC[C@@H]12 ZINC000510683428 1024229242 /nfs/dbraw/zinc/22/92/42/1024229242.db2.gz FVYSFJYSYGNDND-OLMNPRSZSA-N 2 0 340.433 4.243 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CCN2CCCC[C@H]12 ZINC000510683429 1024231026 /nfs/dbraw/zinc/23/10/26/1024231026.db2.gz FVYSFJYSYGNDND-ZTFGCOKTSA-N 2 0 340.433 4.243 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H]1CCN2CCCC[C@@H]12 ZINC000510683427 1024231161 /nfs/dbraw/zinc/23/11/61/1024231161.db2.gz FVYSFJYSYGNDND-JLSDUUJJSA-N 2 0 340.433 4.243 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)CCc2ccc(C(F)(F)F)cc2)C1 ZINC000510699550 1024252643 /nfs/dbraw/zinc/25/26/43/1024252643.db2.gz BZSMHBUQTFDQRG-DOTOQJQBSA-N 2 0 342.449 4.348 20 0 EIADRP Cc1cc(OCCC[C@H](C)[NH2+][C@@H]2CCN(C)[C@@H](C)C2)ccc1Cl ZINC000510738282 1024380186 /nfs/dbraw/zinc/38/01/86/1024380186.db2.gz VGMPBVKTDJRKKI-YESZJQIVSA-N 2 0 338.923 4.268 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(Br)cn1 ZINC000684549450 1024526323 /nfs/dbraw/zinc/52/63/23/1024526323.db2.gz ORYWBSRUJWMIRG-KGLIPLIRSA-N 2 0 342.325 4.005 20 0 EIADRP Fc1cc2c(c(F)c1)CC[C@@H]2[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000684556847 1024658460 /nfs/dbraw/zinc/65/84/60/1024658460.db2.gz CRAJJJLTJLUNBK-IERDGZPVSA-N 2 0 342.433 4.064 20 0 EIADRP C[NH+](C)[C@@H](CNc1cc[nH+]c2cc(F)ccc12)c1ccc(F)cc1 ZINC000500436602 1024708963 /nfs/dbraw/zinc/70/89/63/1024708963.db2.gz AXEPBPWFYZPRBW-IBGZPJMESA-N 2 0 327.378 4.228 20 0 EIADRP C[C@@H](c1ccc(OC(F)F)cc1)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662295870 1025050321 /nfs/dbraw/zinc/05/03/21/1025050321.db2.gz IIEDUBYJKJMPJO-WMLDXEAASA-N 2 0 338.442 4.061 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H]2CC(C)(C)Cc3occc32)cc1 ZINC000162501084 1025146161 /nfs/dbraw/zinc/14/61/61/1025146161.db2.gz QPDIOKXXGDCXGC-IBGZPJMESA-N 2 0 342.483 4.023 20 0 EIADRP CC[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(F)cc1F ZINC000162568440 1025155454 /nfs/dbraw/zinc/15/54/54/1025155454.db2.gz GNBGVCFYDYEQLT-FQEVSTJZSA-N 2 0 348.437 4.146 20 0 EIADRP CC(C)Oc1ccc([C@H](C)[NH2+]C2CCN(c3ccccn3)CC2)cc1 ZINC000121357343 1025207628 /nfs/dbraw/zinc/20/76/28/1025207628.db2.gz YXJHOWQYENDQPM-KRWDZBQOSA-N 2 0 339.483 4.188 20 0 EIADRP CSc1ccccc1C[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000663467332 1025397456 /nfs/dbraw/zinc/39/74/56/1025397456.db2.gz DWCAFYHQDXYNPX-AEFFLSMTSA-N 2 0 332.557 4.051 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cnc2ccsc2c1 ZINC000663470616 1025421185 /nfs/dbraw/zinc/42/11/85/1025421185.db2.gz VMOQNMWCNJMMKX-HOCLYGCPSA-N 2 0 329.513 4.069 20 0 EIADRP C[C@@H]([NH2+]CC(C)(C)CC(F)(F)F)c1ccc(OCC[NH+](C)C)cc1 ZINC000663479161 1025455424 /nfs/dbraw/zinc/45/54/24/1025455424.db2.gz OATHVOMKRCPPSJ-CQSZACIVSA-N 2 0 346.437 4.256 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1nc2c(s1)C[C@H](c1ccccc1)CC2 ZINC000415006885 1025487070 /nfs/dbraw/zinc/48/70/70/1025487070.db2.gz AQOCIQHWVKGXGN-DOTOQJQBSA-N 2 0 343.540 4.023 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+]Cc1nc2c(s1)C[C@@H](c1ccccc1)CC2 ZINC000415006897 1025490457 /nfs/dbraw/zinc/49/04/57/1025490457.db2.gz AQOCIQHWVKGXGN-WBVHZDCISA-N 2 0 343.540 4.023 20 0 EIADRP CC[C@@H](CC(F)(F)F)[NH2+]C1CCN(CCc2ccccc2)CC1 ZINC000546165261 1025598215 /nfs/dbraw/zinc/59/82/15/1025598215.db2.gz BEINYOYJCRZTMT-INIZCTEOSA-N 2 0 328.422 4.014 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](N[C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000643524155 1025679479 /nfs/dbraw/zinc/67/94/79/1025679479.db2.gz QLGZEWXEDHDCHO-URVUXULASA-N 2 0 349.453 4.323 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@@H]2CCC[C@@H]([NH+](C)C)C2)sc1Br ZINC000512011438 1025713399 /nfs/dbraw/zinc/71/33/99/1025713399.db2.gz VUNJVCATZGETLG-YNEHKIRRSA-N 2 0 345.350 4.342 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCSC[C@H]1c1ccc(F)cc1 ZINC001167833327 1025789717 /nfs/dbraw/zinc/78/97/17/1025789717.db2.gz AFRDRCNGTCXCIM-APWZRJJASA-N 2 0 338.536 4.426 20 0 EIADRP CCC[C@H](C(=O)c1ccccc1)[N@H+](C)[C@@H](C)CCC[NH+](CC)CC ZINC001167835290 1025836879 /nfs/dbraw/zinc/83/68/79/1025836879.db2.gz RBOJGSXQGMSUTF-AZUAARDMSA-N 2 0 332.532 4.480 20 0 EIADRP CCc1ccc(C[NH2+]CC[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cn1 ZINC000512047145 1025844007 /nfs/dbraw/zinc/84/40/07/1025844007.db2.gz XRMRDKQSQYBOHP-AZUAARDMSA-N 2 0 337.511 4.034 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCc2nccn2C1)c1ccc(SC(F)F)cc1 ZINC000278943187 1025855727 /nfs/dbraw/zinc/85/57/27/1025855727.db2.gz KJZVIACXTKNKGS-STQMWFEESA-N 2 0 337.439 4.111 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CCCc2ccc(C)cc21 ZINC000342328844 1025859341 /nfs/dbraw/zinc/85/93/41/1025859341.db2.gz YCPFSPBZNDKDER-NRFANRHFSA-N 2 0 332.451 4.051 20 0 EIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@H](c2ccccc2)C2CCCC2)CCCO1 ZINC000432404669 1025871735 /nfs/dbraw/zinc/87/17/35/1025871735.db2.gz FFCPEKVNRQKPJN-WIYYLYMNSA-N 2 0 330.516 4.008 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]C[C@H]1CC[NH2+][C@H](C)C1 ZINC000415075438 1025878498 /nfs/dbraw/zinc/87/84/98/1025878498.db2.gz FKNRKXONWKKBJQ-VYDXJSESSA-N 2 0 343.540 4.466 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2csc(-c3ccsc3)n2)CC1 ZINC000123486871 1025880118 /nfs/dbraw/zinc/88/01/18/1025880118.db2.gz WCBFUDLNAGWZRN-UHFFFAOYSA-N 2 0 349.569 4.425 20 0 EIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@@H](c2ccccc2F)C2CCCC2)CCCO1 ZINC000432420123 1025898127 /nfs/dbraw/zinc/89/81/27/1025898127.db2.gz IYVIVNZMTWAMQW-DYESRHJHSA-N 2 0 348.506 4.148 20 0 EIADRP C[C@H]1C[N@H+](CCC[NH2+][C@H](CC2CCC2)c2ccccc2)CCCO1 ZINC000432421193 1025902607 /nfs/dbraw/zinc/90/26/07/1025902607.db2.gz OKJFVISBYQILHB-GHTZIAJQSA-N 2 0 330.516 4.008 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1cc2ccccc2o1 ZINC000048683745 1026155065 /nfs/dbraw/zinc/15/50/65/1026155065.db2.gz OXMZUQQQGQNUNW-INIZCTEOSA-N 2 0 338.451 4.224 20 0 EIADRP CCC[NH+]1CCC(C[NH2+]Cc2ccc(-c3scnc3C)cc2)CC1 ZINC000657347423 1026212202 /nfs/dbraw/zinc/21/22/02/1026212202.db2.gz QSLBHWLLCORBPN-UHFFFAOYSA-N 2 0 343.540 4.330 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCCOc3c(Cl)c(Cl)ccc32)CC1 ZINC000344307603 1026229996 /nfs/dbraw/zinc/22/99/96/1026229996.db2.gz XEZLEJIGMYBFIN-OAHLLOKOSA-N 2 0 341.282 4.059 20 0 EIADRP Cc1ccccc1CC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167975657 1026279768 /nfs/dbraw/zinc/27/97/68/1026279768.db2.gz TVPNOLOIWUVWKM-FRIKZZABSA-N 2 0 338.539 4.313 20 0 EIADRP COc1cccc(CCC[N@@H+]2CCC[C@@H](C[NH+]3CCCC[C@H]3C)C2)c1 ZINC000303950948 1026297546 /nfs/dbraw/zinc/29/75/46/1026297546.db2.gz VRMRGZNYEFNSAA-TZIWHRDSSA-N 2 0 344.543 4.214 20 0 EIADRP COCCCC[N@@H+]1CC(C)(C)[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC000664836026 1026306860 /nfs/dbraw/zinc/30/68/60/1026306860.db2.gz IJXJNOVMCUGQTR-OAQYLSRUSA-N 2 0 344.543 4.036 20 0 EIADRP Fc1ccccc1CC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CC1 ZINC001167979096 1026343106 /nfs/dbraw/zinc/34/31/06/1026343106.db2.gz VDCSLBORHDBWRV-IHWFROFDSA-N 2 0 342.502 4.143 20 0 EIADRP COc1ccccc1CC(C)(C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167979045 1026348544 /nfs/dbraw/zinc/34/85/44/1026348544.db2.gz TXFCKZJHFVCVKN-IHWFROFDSA-N 2 0 342.527 4.011 20 0 EIADRP CCC[N@H+](C)C[C@@H]1CC[NH+](CCCSc2ccccc2Cl)C1 ZINC001167558782 1026384341 /nfs/dbraw/zinc/38/43/41/1026384341.db2.gz SPVODWVLHROCBW-INIZCTEOSA-N 2 0 340.964 4.486 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+]Cc2cc3ccncc3s2)CC1 ZINC000657390344 1026437754 /nfs/dbraw/zinc/43/77/54/1026437754.db2.gz ALHMKEHMEZQKHB-UHFFFAOYSA-N 2 0 331.529 4.144 20 0 EIADRP c1cncc([C@@H]2CCC[C@H]([NH2+]Cc3cccc(C[NH+]4CCCC4)c3)C2)c1 ZINC000337333436 1026466628 /nfs/dbraw/zinc/46/66/28/1026466628.db2.gz JOLKVBCNNLWJQB-GGAORHGYSA-N 2 0 349.522 4.493 20 0 EIADRP Fc1ccccc1CN(Cc1ccsc1)[C@H]1CC12CC[NH2+]CC2 ZINC000432664770 1026689322 /nfs/dbraw/zinc/68/93/22/1026689322.db2.gz OJFKBVJKTJCGAA-SFHVURJKSA-N 2 0 330.472 4.032 20 0 EIADRP Cc1cc(OCC[N@@H+](C)C2CC[NH+](C(C)C)CC2)ccc1C(C)C ZINC000507341323 1026751789 /nfs/dbraw/zinc/75/17/89/1026751789.db2.gz RAIBGEZSUFHAAJ-UHFFFAOYSA-N 2 0 332.532 4.302 20 0 EIADRP Fc1ccc2c(NC3CC[NH+](CCc4ccccc4)CC3)cc[nH+]c2c1 ZINC000500484170 1026784454 /nfs/dbraw/zinc/78/44/54/1026784454.db2.gz YWLNKGLUZGNPJK-UHFFFAOYSA-N 2 0 349.453 4.493 20 0 EIADRP CC[C@H]1C[C@]1([NH2+]Cc1cn(-c2cc[nH+]cc2)nc1C)c1cccc(C)c1 ZINC000500493365 1026793998 /nfs/dbraw/zinc/79/39/98/1026793998.db2.gz YAASJKYNYHQDQY-SIKLNZKXSA-N 2 0 346.478 4.299 20 0 EIADRP CC[NH+]1CCN(c2ccccc2C[N@H+](C)[C@H](C)c2cccs2)CC1 ZINC000507440095 1026794794 /nfs/dbraw/zinc/79/47/94/1026794794.db2.gz HEBNQILQBPJIHC-QGZVFWFLSA-N 2 0 343.540 4.083 20 0 EIADRP COc1ccc([C@@H]2CCCC[C@H]2[NH2+]CC2(C)CC[NH+](C)CC2)cc1F ZINC000507446443 1026798045 /nfs/dbraw/zinc/79/80/45/1026798045.db2.gz UFOVWFZMYBATAM-PKOBYXMFSA-N 2 0 348.506 4.182 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CCCc3cccnc32)C[N@@H+]1Cc1ccccc1 ZINC000684960976 1026900236 /nfs/dbraw/zinc/90/02/36/1026900236.db2.gz VVQREQUABORPIE-SYYKKAFVSA-N 2 0 349.522 4.349 20 0 EIADRP CCC[C@H](CCc1ccccc1)[NH2+]CC1(SC)CC[NH+](C)CC1 ZINC000519655994 1026935679 /nfs/dbraw/zinc/93/56/79/1026935679.db2.gz RQSQWZSTVXKGME-LJQANCHMSA-N 2 0 334.573 4.205 20 0 EIADRP Cc1ccccc1SC[C@H](C)C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC001167599047 1026943829 /nfs/dbraw/zinc/94/38/29/1026943829.db2.gz NWSPWVTUTKYFDW-YLJYHZDGSA-N 2 0 346.584 4.387 20 0 EIADRP C(CC[NH+]1CCC(C[NH+]2CCCCCC2)CC1)CC1CCOCC1 ZINC000685000957 1026992517 /nfs/dbraw/zinc/99/25/17/1026992517.db2.gz ZJPGTIHQVZTFIK-UHFFFAOYSA-N 2 0 336.564 4.171 20 0 EIADRP CCC1(CC)CCC([NH2+]CC2CC[NH+](C3CCOCC3)CC2)CC1 ZINC000657537581 1026995892 /nfs/dbraw/zinc/99/58/92/1026995892.db2.gz PNYMGQCGUKHUFM-UHFFFAOYSA-N 2 0 336.564 4.216 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccccc1Br ZINC000519776891 1026996141 /nfs/dbraw/zinc/99/61/41/1026996141.db2.gz PYTFIQRUDNGXJJ-KRWDZBQOSA-N 2 0 333.273 4.149 20 0 EIADRP COc1ccc([C@H](C)[C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cc1OC ZINC000474476296 1027107437 /nfs/dbraw/zinc/10/74/37/1027107437.db2.gz WXGBPMYDZGKMPK-KSZLIROESA-N 2 0 348.531 4.050 20 0 EIADRP C[C@H](Cn1ccnc1)[NH2+]CCCCc1ccc(Cl)c(Cl)c1 ZINC000474480441 1027113486 /nfs/dbraw/zinc/11/34/86/1027113486.db2.gz UYMOKYIAETZXGF-CYBMUJFWSA-N 2 0 326.271 4.191 20 0 EIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@H]3CCC[C@H]3CCCF)cc2)CC1 ZINC000342824897 1027178472 /nfs/dbraw/zinc/17/84/72/1027178472.db2.gz KLDULINDHQEJIA-RXVVDRJESA-N 2 0 348.506 4.168 20 0 EIADRP Cc1oc2ccccc2c1C[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC000657613196 1027288297 /nfs/dbraw/zinc/28/82/97/1027288297.db2.gz HZTGKTMPLFYJNU-UHFFFAOYSA-N 2 0 349.478 4.138 20 0 EIADRP c1ccc([C@@H]2CC[C@H]([NH2+]CC3CC[NH+](Cc4ccncc4)CC3)C2)cc1 ZINC000657613549 1027290224 /nfs/dbraw/zinc/29/02/24/1027290224.db2.gz NJJPKECTHKHIBF-PKTZIBPZSA-N 2 0 349.522 4.220 20 0 EIADRP Cc1ccc(C[NH2+]C[C@@H]2CCCN(Cc3cccs3)C2)cc1C ZINC000520220983 1027333271 /nfs/dbraw/zinc/33/32/71/1027333271.db2.gz BTPKRVIMRGQTLL-IBGZPJMESA-N 2 0 328.525 4.367 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1 ZINC000474628560 1027337666 /nfs/dbraw/zinc/33/76/66/1027337666.db2.gz LBXKIXAXRKKFOX-ZQDZILKHSA-N 2 0 326.937 4.215 20 0 EIADRP CO[C@@H](C[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)C(C)(C)C ZINC000520262621 1027371502 /nfs/dbraw/zinc/37/15/02/1027371502.db2.gz PCCGHGNNFCFVKQ-MHJFOBGBSA-N 2 0 332.532 4.080 20 0 EIADRP C[C@@H]1CC([N@@H+]2CCC(F)(F)[C@H](C)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168041208 1027433884 /nfs/dbraw/zinc/43/38/84/1027433884.db2.gz QZIAUKFOONSEBV-BRWVUGGUSA-N 2 0 336.470 4.405 20 0 EIADRP CC(C)OC1CCC([NH2+]C2CC[NH+]([C@H]3CCC[C@@H](C)C3)CC2)CC1 ZINC000090772056 1027582685 /nfs/dbraw/zinc/58/26/85/1027582685.db2.gz YHNWNNLOVFKNPK-OMZYAQQMSA-N 2 0 336.564 4.355 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)c2cccc(Br)c21 ZINC000152452680 1027596227 /nfs/dbraw/zinc/59/62/27/1027596227.db2.gz KVIRHUJTDJHUEY-IGCXYCKISA-N 2 0 349.316 4.071 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)cc1OC ZINC000152465961 1027660801 /nfs/dbraw/zinc/66/08/01/1027660801.db2.gz LGEWIZXJLJYNJQ-IAGOWNOFSA-N 2 0 346.515 4.009 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000249124409 1027792224 /nfs/dbraw/zinc/79/22/24/1027792224.db2.gz UNCDKBBRJUTRME-XYPHTWIQSA-N 2 0 326.406 4.025 20 0 EIADRP C[C@H]([NH2+]C[C@@H](C1CC1)N(C)Cc1ccccc1)C1CCSCC1 ZINC000474921564 1027802061 /nfs/dbraw/zinc/80/20/61/1027802061.db2.gz DAXZWKCQAKUHSH-JXFKEZNVSA-N 2 0 332.557 4.018 20 0 EIADRP C[N@H+](CCc1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1 ZINC001167996235 1027842423 /nfs/dbraw/zinc/84/24/23/1027842423.db2.gz ZXMWMBZLFGUTBM-YOFSQIOKSA-N 2 0 332.919 4.220 20 0 EIADRP c1csc(-c2ccc(C[N@H+]3CC[C@H](C[NH+]4CCCC4)C3)cc2)c1 ZINC000444651470 1027918607 /nfs/dbraw/zinc/91/86/07/1027918607.db2.gz GQRUOJNZVHHCIR-GOSISDBHSA-N 2 0 326.509 4.333 20 0 EIADRP CCc1ccccc1CC[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000444685561 1027944565 /nfs/dbraw/zinc/94/45/65/1027944565.db2.gz ALPHANVXTGHZLZ-UHFFFAOYSA-N 2 0 337.511 4.035 20 0 EIADRP CC(C)COc1ccccc1CN1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000441449612 1028004389 /nfs/dbraw/zinc/00/43/89/1028004389.db2.gz PNUDYZQXPZSECH-IBGZPJMESA-N 2 0 330.516 4.029 20 0 EIADRP c1ccc2c(c1)cccc2OCC[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000441453154 1028024498 /nfs/dbraw/zinc/02/44/98/1028024498.db2.gz XMLVHJLOAWDSNA-LJQANCHMSA-N 2 0 338.495 4.026 20 0 EIADRP Cc1cc(C)cc(OCCC[N@@H+]2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000523439827 1028119676 /nfs/dbraw/zinc/11/96/76/1028119676.db2.gz OSRRWJWFMKQMDJ-FQEVSTJZSA-N 2 0 330.516 4.023 20 0 EIADRP FC(F)(F)c1ccc([C@H]2C[C@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)C2)cc1 ZINC000280963619 1028311176 /nfs/dbraw/zinc/31/11/76/1028311176.db2.gz ZGTUYTMNSFGFMK-DKIMLUQUSA-N 2 0 338.417 4.168 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000346216062 1028313784 /nfs/dbraw/zinc/31/37/84/1028313784.db2.gz QTBIIKMEEDBLCQ-FQEVSTJZSA-N 2 0 336.414 4.052 20 0 EIADRP C[C@@H](Cc1cccc(C(F)(F)F)c1)[NH2+]C1CC[NH+](C2CCC2)CC1 ZINC000281146182 1028395519 /nfs/dbraw/zinc/39/55/19/1028395519.db2.gz GFOUATQIQWMDSZ-AWEZNQCLSA-N 2 0 340.433 4.243 20 0 EIADRP C[NH+](C)CC[C@@H]([NH2+]Cc1ccc(OC(F)(F)F)cc1)C(C)(C)C ZINC000523864752 1028435582 /nfs/dbraw/zinc/43/55/82/1028435582.db2.gz ZNGKYKZFBJOMQC-OAHLLOKOSA-N 2 0 332.410 4.041 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[NH+]1CCC(O)CC1)C1CCCCCC1 ZINC000346551094 1028512220 /nfs/dbraw/zinc/51/22/20/1028512220.db2.gz GUQFBHBVROZHIH-SFHVURJKSA-N 2 0 344.543 4.092 20 0 EIADRP Cc1ccc(C[NH+]2CC[C@@H](C[N@@H+](C)C[C@@H]3CCC(F)(F)C3)C2)s1 ZINC000583325118 1028517633 /nfs/dbraw/zinc/51/76/33/1028517633.db2.gz APPVRYBLUIIIQQ-CVEARBPZSA-N 2 0 342.499 4.246 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](c2cncc(F)c2)C2CC2)c1 ZINC000281354957 1028536664 /nfs/dbraw/zinc/53/66/64/1028536664.db2.gz VSDKJIDMZGUIMM-OAQYLSRUSA-N 2 0 341.474 4.303 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CCN(Cc2ccccn2)C[C@@H]1C)c1cccs1 ZINC000156376888 1028720167 /nfs/dbraw/zinc/72/01/67/1028720167.db2.gz OTQPRYZSKQVZED-RYQLBKOJSA-N 2 0 329.513 4.094 20 0 EIADRP C[C@@H]([NH2+]CCCn1ccnc1)c1cccc(OCc2ccccc2)c1 ZINC000151108785 1029054738 /nfs/dbraw/zinc/05/47/38/1029054738.db2.gz HCTAEXWZNBJBGF-GOSISDBHSA-N 2 0 335.451 4.203 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CCC1(C[NH3+])CC1 ZINC000650744425 1029065142 /nfs/dbraw/zinc/06/51/42/1029065142.db2.gz NNUZKKGDSOXEIS-LBPRGKRZSA-N 2 0 333.476 4.037 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)cc1 ZINC000650756191 1029182935 /nfs/dbraw/zinc/18/29/35/1029182935.db2.gz WGXDVNUIQQSDQD-OAHLLOKOSA-N 2 0 330.447 4.314 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CC[C@H](C[C@@H]3CC[C@H]([NH3+])[C@H](C)C3)C[C@H]2C)CCO1 ZINC001168087490 1029185885 /nfs/dbraw/zinc/18/58/85/1029185885.db2.gz LYMXSDHTMGCEQE-XYADGQQDSA-N 2 0 336.564 4.102 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)CCS2 ZINC000343456180 1029284810 /nfs/dbraw/zinc/28/48/10/1029284810.db2.gz DJCKPJIOLPZOQY-IBGZPJMESA-N 2 0 348.556 4.478 20 0 EIADRP Clc1ccc2cccnc2c1C[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000657812894 1029478452 /nfs/dbraw/zinc/47/84/52/1029478452.db2.gz JXIPUFOTFCQVCY-UHFFFAOYSA-N 2 0 343.902 4.100 20 0 EIADRP Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(OCC[NH+](C)C)c2)cc1F ZINC000168509415 1029487951 /nfs/dbraw/zinc/48/79/51/1029487951.db2.gz LKQMIDIMABTCPU-IAGOWNOFSA-N 2 0 344.474 4.486 20 0 EIADRP C[C@@H](CCc1cccc(F)c1)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475272454 1029488933 /nfs/dbraw/zinc/48/89/33/1029488933.db2.gz BSHNFTOZHSPGPY-RXVVDRJESA-N 2 0 340.486 4.259 20 0 EIADRP C[C@@H](CCc1cccc(F)c1)[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000475272452 1029489752 /nfs/dbraw/zinc/48/97/52/1029489752.db2.gz BSHNFTOZHSPGPY-GHTZIAJQSA-N 2 0 340.486 4.259 20 0 EIADRP CC(C)(C)[C@@H]1C[C@@H]([NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)CS1 ZINC000475291258 1029503286 /nfs/dbraw/zinc/50/32/86/1029503286.db2.gz NRATXTNUWIULCC-OTWHNJEPSA-N 2 0 332.557 4.018 20 0 EIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CCCCOC(C)(C)C ZINC000475321685 1029517438 /nfs/dbraw/zinc/51/74/38/1029517438.db2.gz ZXGVUHSGOBYDSG-OALUTQOASA-N 2 0 346.559 4.328 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+]Cc2ccc(-c3ccc(F)cc3)o2)cc1 ZINC000017319394 1029530140 /nfs/dbraw/zinc/53/01/40/1029530140.db2.gz QVVYYRKCDQKKSV-UHFFFAOYSA-N 2 0 338.426 4.437 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+]([C@@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC000523017341 1029551856 /nfs/dbraw/zinc/55/18/56/1029551856.db2.gz KUGMSOPHWMBAOX-HNNXBMFYSA-N 2 0 340.458 4.401 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H](c2ccccc2)c2ccc3ccccc3n2)C1 ZINC000584047448 1029566161 /nfs/dbraw/zinc/56/61/61/1029566161.db2.gz AGWTUCCHIUINKR-HCLVMJGWSA-N 2 0 345.490 4.431 20 0 EIADRP C[C@@H]1c2ccccc2C[NH+]1CCOCC[N@@H+]1Cc2ccccc2[C@H]1C ZINC000343738206 1029730832 /nfs/dbraw/zinc/73/08/32/1029730832.db2.gz JKKYDOKJLAARFX-QZTJIDSGSA-N 2 0 336.479 4.157 20 0 EIADRP C[C@@H]1c2ccccc2C[N@H+]1CCOCC[NH+]1Cc2ccccc2[C@@H]1C ZINC000343738205 1029731201 /nfs/dbraw/zinc/73/12/01/1029731201.db2.gz JKKYDOKJLAARFX-HDICACEKSA-N 2 0 336.479 4.157 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C[NH2+]Cc1cccc(C2CC2)c1 ZINC000708502465 1029744143 /nfs/dbraw/zinc/74/41/43/1029744143.db2.gz HNSCXKKPRRKWIP-FDDCHVKYSA-N 2 0 334.507 4.422 20 0 EIADRP Cc1cc(N2CCC[C@@H]([NH+]3CCCC3)CC2)c2cc(F)ccc2[nH+]1 ZINC000301642633 1029779903 /nfs/dbraw/zinc/77/99/03/1029779903.db2.gz BUKAOCLZKFURPH-QGZVFWFLSA-N 2 0 327.447 4.137 20 0 EIADRP C[N@@H+]1CC[C@H](C[NH2+]C/C=C/c2ccc(F)c(F)c2)[C@@H]1c1cccs1 ZINC000375751956 1029859563 /nfs/dbraw/zinc/85/95/63/1029859563.db2.gz YWUBBPJFJMGRDR-OSLWLWRUSA-N 2 0 348.462 4.322 20 0 EIADRP C[N@@H+]1CC[C@H](C[NH2+]Cc2ccc3occc3c2)[C@H]1c1cccs1 ZINC000375751889 1029864676 /nfs/dbraw/zinc/86/46/76/1029864676.db2.gz YBYZZMBGUXNQDJ-APWZRJJASA-N 2 0 326.465 4.277 20 0 EIADRP FCC1(CF)CC([NH2+]Cc2cccc(C[NH+]3CCCCCC3)c2)C1 ZINC000657861176 1029871476 /nfs/dbraw/zinc/87/14/76/1029871476.db2.gz QGTGEVMTBIPDCL-UHFFFAOYSA-N 2 0 336.470 4.240 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCCOc3cc(F)ccc32)c1 ZINC000182062707 1029936896 /nfs/dbraw/zinc/93/68/96/1029936896.db2.gz DUCRFHJDLILIEK-FQEVSTJZSA-N 2 0 342.458 4.281 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCSc2ccccc21)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183183479 1029987158 /nfs/dbraw/zinc/98/71/58/1029987158.db2.gz UDTWLPJFSYPALN-FRQCXROJSA-N 2 0 330.541 4.466 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)[C@@H](C)C1 ZINC000525860285 1030082182 /nfs/dbraw/zinc/08/21/82/1030082182.db2.gz REHZEMRASDYTNT-PDGJWGCVSA-N 2 0 344.543 4.049 20 0 EIADRP Cc1cc2c(cc1C)[C@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CCS2 ZINC000447568326 1030154411 /nfs/dbraw/zinc/15/44/11/1030154411.db2.gz JAQQZDUYYOHMIY-LJQANCHMSA-N 2 0 330.541 4.304 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]CC2(c3c(Cl)cccc3Cl)CCC2)CC[N@@H+]1C ZINC000447563836 1030171075 /nfs/dbraw/zinc/17/10/75/1030171075.db2.gz FWOBGAWISJEGNH-ZIAGYGMSSA-N 2 0 341.326 4.487 20 0 EIADRP CCc1cnccc1[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000447579676 1030205556 /nfs/dbraw/zinc/20/55/56/1030205556.db2.gz LIYQORLFAAVAOQ-AGOPTVSRSA-N 2 0 349.522 4.490 20 0 EIADRP C[C@@H](c1ccc(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](C)C3)cc1)C(F)(F)F ZINC000451066193 1030218305 /nfs/dbraw/zinc/21/83/05/1030218305.db2.gz BTWDZOIDUNLJKO-YJBOKZPZSA-N 2 0 340.433 4.270 20 0 EIADRP CCn1c2ccccc2c2cc(C[NH2+]CC3=CC[N@H+](C)CC3)ccc21 ZINC000392240283 1030306978 /nfs/dbraw/zinc/30/69/78/1030306978.db2.gz AVANXKRORXGHEM-UHFFFAOYSA-N 2 0 333.479 4.166 20 0 EIADRP CC[N@@H+](Cc1ccc(C[NH+](C)C)cc1)C[C@@H]1CCOc2ccccc21 ZINC000685456693 1030334408 /nfs/dbraw/zinc/33/44/08/1030334408.db2.gz JAROUSWNDBVKGC-FQEVSTJZSA-N 2 0 338.495 4.136 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C[C@H]2CCC3(CCCC3)O2)C1 ZINC000530358420 1030337125 /nfs/dbraw/zinc/33/71/25/1030337125.db2.gz ZQKPMSQORVLIAF-HSALFYBXSA-N 2 0 334.548 4.065 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000685455207 1030338987 /nfs/dbraw/zinc/33/89/87/1030338987.db2.gz JCNOLGUBXHZBKJ-CABCVRRESA-N 2 0 328.422 4.129 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2ccc(C)c(OC)c2)cc1 ZINC000447854363 1030382336 /nfs/dbraw/zinc/38/23/36/1030382336.db2.gz LJGQBCRATUUQOT-UHFFFAOYSA-N 2 0 326.484 4.135 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1C ZINC000708566639 1030386343 /nfs/dbraw/zinc/38/63/43/1030386343.db2.gz RHWMYNHBYYZAGA-OPYAIIAOSA-N 2 0 340.486 4.114 20 0 EIADRP c1cc2ccc(C[NH2+]CC3CC[NH+](Cc4ccccc4)CC3)cc2[nH]1 ZINC000397594130 1030455328 /nfs/dbraw/zinc/45/53/28/1030455328.db2.gz KXKCMOVTZNXFEO-UHFFFAOYSA-N 2 0 333.479 4.170 20 0 EIADRP CC(C)[N@@H+](C)CC1CC[NH+](CC[C@H](C)OCc2ccccc2)CC1 ZINC000530496357 1030472411 /nfs/dbraw/zinc/47/24/11/1030472411.db2.gz BHHZEMHVRFUNSA-IBGZPJMESA-N 2 0 332.532 4.034 20 0 EIADRP C[C@@H](N[C@@H](C)c1cc2cnccc2o1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000657968524 1030712813 /nfs/dbraw/zinc/71/28/13/1030712813.db2.gz AVYDFSDXBNKYKE-OWCLPIDISA-N 2 0 327.472 4.131 20 0 EIADRP Cc1cc(C[NH2+][C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cc(C)c1O ZINC000398182644 1030734155 /nfs/dbraw/zinc/73/41/55/1030734155.db2.gz KKMMTTGOQHOVJI-WIYYLYMNSA-N 2 0 338.495 4.009 20 0 EIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3noc4ccccc43)CC2)C1 ZINC000658067709 1030813634 /nfs/dbraw/zinc/81/36/34/1030813634.db2.gz YCSCMAPOSXRDCT-FUHWJXTLSA-N 2 0 341.499 4.003 20 0 EIADRP Brc1ccc(/C=C\CC[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000527741680 1030838637 /nfs/dbraw/zinc/83/86/37/1030838637.db2.gz AEKFDMYGDLWECB-AUVNQSNOSA-N 2 0 349.316 4.069 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(C)cc1 ZINC000658166873 1030862089 /nfs/dbraw/zinc/86/20/89/1030862089.db2.gz QJKYHQZQQQYOLX-QFIPXVFZSA-N 2 0 337.511 4.343 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cc2ccccc2o1 ZINC000658166795 1030862287 /nfs/dbraw/zinc/86/22/87/1030862287.db2.gz OZLOIYJLXRBMRR-QGZVFWFLSA-N 2 0 349.478 4.391 20 0 EIADRP c1ccc([C@@H]2CCC[C@H]2[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658168783 1030864246 /nfs/dbraw/zinc/86/42/46/1030864246.db2.gz YSOOTCPXIWSFSZ-XZOQPEGZSA-N 2 0 349.522 4.220 20 0 EIADRP c1ccc([C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C2CC2)cc1 ZINC000658166175 1030865003 /nfs/dbraw/zinc/86/50/03/1030865003.db2.gz MXIKIOUEBWXYDM-JOCHJYFZSA-N 2 0 335.495 4.035 20 0 EIADRP Cc1cc(C)cc(C[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)c1 ZINC000658177707 1030870312 /nfs/dbraw/zinc/87/03/12/1030870312.db2.gz WZISXOUDKUOXLV-SFHVURJKSA-N 2 0 326.484 4.095 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CC[C@]2(C)CC2(F)F)CC1 ZINC000658220210 1030885917 /nfs/dbraw/zinc/88/59/17/1030885917.db2.gz KNETZZVOTAPNIG-VQIMIIECSA-N 2 0 336.470 4.107 20 0 EIADRP Cc1nccn1-c1ccc(C[NH2+][C@H](c2cccc(C)c2)C(C)C)cn1 ZINC000527849619 1030891479 /nfs/dbraw/zinc/89/14/79/1030891479.db2.gz MOJQYVNBJSIQHK-NRFANRHFSA-N 2 0 334.467 4.371 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CC[C@@H]2CCCOC2)ccc1OC ZINC000527930120 1030973033 /nfs/dbraw/zinc/97/30/33/1030973033.db2.gz PVHNLVVAKDDYHW-MSOLQXFVSA-N 2 0 348.531 4.004 20 0 EIADRP Cc1cncc([C@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)c1 ZINC000658320183 1030982311 /nfs/dbraw/zinc/98/23/11/1030982311.db2.gz PLRQHZYWPSYAOD-UGKGYDQZSA-N 2 0 349.522 4.343 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]CCCc2ccco2)CC1 ZINC000658325289 1030989026 /nfs/dbraw/zinc/98/90/26/1030989026.db2.gz LLVDWTOTVIYAIC-UHFFFAOYSA-N 2 0 326.484 4.245 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]CC2CC[NH+](CC3CC3)CC2)C1 ZINC000658353734 1031020839 /nfs/dbraw/zinc/02/08/39/1031020839.db2.gz QRIHGLPMLKDTMJ-RTWAWAEBSA-N 2 0 341.543 4.128 20 0 EIADRP c1cnc2c(c1)CC[C@H]([NH2+]Cc1ccc(C[NH+]3CCCCC3)cc1)CC2 ZINC000421820526 1031024215 /nfs/dbraw/zinc/02/42/15/1031024215.db2.gz MQVWICVQPLDEAX-QFIPXVFZSA-N 2 0 349.522 4.105 20 0 EIADRP COc1cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)ccc1C ZINC000532469187 1031147103 /nfs/dbraw/zinc/14/71/03/1031147103.db2.gz MPCNBZGDBIKGNO-RXVVDRJESA-N 2 0 338.495 4.004 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@H](CC2CC2)c2ccccc2)cc1 ZINC000532474942 1031178936 /nfs/dbraw/zinc/17/89/36/1031178936.db2.gz HJVMIUGSWSBHAP-JOCHJYFZSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000171126891 1031187107 /nfs/dbraw/zinc/18/71/07/1031187107.db2.gz ZOGLPBXZPBLDCH-INIZCTEOSA-N 2 0 330.447 4.007 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(Sc2ccccc2)CCCC1 ZINC000532506782 1031229174 /nfs/dbraw/zinc/22/91/74/1031229174.db2.gz FXUMAODPFZMWOV-AOIWGVFYSA-N 2 0 332.557 4.410 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3cc4cccnc4o3)cc2)C1 ZINC000449073827 1031429507 /nfs/dbraw/zinc/42/95/07/1031429507.db2.gz AHOLKTSNWRNMGV-KRWDZBQOSA-N 2 0 349.478 4.350 20 0 EIADRP C[C@H](Cc1cccs1)[NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1 ZINC000449078525 1031431690 /nfs/dbraw/zinc/43/16/90/1031431690.db2.gz YGZSEDMFURFVGN-MSOLQXFVSA-N 2 0 342.552 4.364 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(C[N@H+](C)CC)c1)c1ccccc1OC ZINC000123986859 1031495005 /nfs/dbraw/zinc/49/50/05/1031495005.db2.gz KFXJFLMNMKGIPM-HXUWFJFHSA-N 2 0 326.484 4.388 20 0 EIADRP COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000531712253 1031499565 /nfs/dbraw/zinc/49/95/65/1031499565.db2.gz OVNBZZOKMNEVFG-HNNXBMFYSA-N 2 0 330.447 4.055 20 0 EIADRP CC[C@H]([NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)c1ccncc1 ZINC000449165038 1031503427 /nfs/dbraw/zinc/50/34/27/1031503427.db2.gz SPNOMXKDMWCKSH-AVRDEDQJSA-N 2 0 337.511 4.218 20 0 EIADRP COc1ccc2c(c1)C[C@H]([N@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001168251735 1031524683 /nfs/dbraw/zinc/52/46/83/1031524683.db2.gz KYUAERVMTHGZJO-HMXCVIKNSA-N 2 0 342.527 4.067 20 0 EIADRP C[C@@H](CCCc1cccnc1)[NH2+]CCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC000453070098 1031534806 /nfs/dbraw/zinc/53/48/06/1031534806.db2.gz ZVUABRYSDLFWLO-AQNXPRMDSA-N 2 0 331.548 4.141 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]C2CCC(OC3CCCC3)CC2)C1 ZINC000449211846 1031537848 /nfs/dbraw/zinc/53/78/48/1031537848.db2.gz SDJPSPAUVODCQJ-LWEYNCJUSA-N 2 0 336.564 4.214 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(C[N@H+]3C[C@@H](C)O[C@@H](C)C3)cc2)o1 ZINC000124649916 1031545246 /nfs/dbraw/zinc/54/52/46/1031545246.db2.gz KWLNYRNDEJJFQJ-KSZLIROESA-N 2 0 342.483 4.048 20 0 EIADRP CCC1(C[NH2+]Cc2ncc(C)s2)CC[NH+](Cc2ccccc2)CC1 ZINC000449216731 1031551488 /nfs/dbraw/zinc/55/14/88/1031551488.db2.gz UVJJBRDXISDVDO-UHFFFAOYSA-N 2 0 343.540 4.234 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCC[C@@H]2CCCCO2)CC1 ZINC000449241850 1031578597 /nfs/dbraw/zinc/57/85/97/1031578597.db2.gz CMGINWABOUQYFU-UGKGYDQZSA-N 2 0 344.543 4.021 20 0 EIADRP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@H](C)CCCc2cccnc2)c1 ZINC000453098350 1031593408 /nfs/dbraw/zinc/59/34/08/1031593408.db2.gz XHIGYEBIOYJSFV-LJQANCHMSA-N 2 0 339.527 4.423 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccsc1 ZINC000453107351 1031597731 /nfs/dbraw/zinc/59/77/31/1031597731.db2.gz ISRYOSHMSKEHOX-HXUWFJFHSA-N 2 0 344.524 4.464 20 0 EIADRP C[C@@H](CCCc1cccnc1)[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000453121903 1031615142 /nfs/dbraw/zinc/61/51/42/1031615142.db2.gz DJFLALDBKIWIFR-SFHVURJKSA-N 2 0 329.532 4.180 20 0 EIADRP COCC[C@@H]([NH2+]C1CC[NH+]([C@@H](C)Cc2ccccc2)CC1)C(C)(C)C ZINC000449312756 1031629067 /nfs/dbraw/zinc/62/90/67/1031629067.db2.gz NFQQKNWSQVMAJP-GHTZIAJQSA-N 2 0 346.559 4.123 20 0 EIADRP CC[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000453184465 1031687811 /nfs/dbraw/zinc/68/78/11/1031687811.db2.gz ZZHTURGNDMOUHT-UZKOGDIHSA-N 2 0 337.511 4.423 20 0 EIADRP C1CCC([NH+]2CCC([NH2+][C@@H]3CCOC4(CCCCC4)C3)CC2)CC1 ZINC000127370635 1031688524 /nfs/dbraw/zinc/68/85/24/1031688524.db2.gz VXTUOKZDZKSZBV-LJQANCHMSA-N 2 0 334.548 4.255 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@H]2CCC[C@@H]21)C(F)(F)F ZINC000453207614 1031719635 /nfs/dbraw/zinc/71/96/35/1031719635.db2.gz WMJQURBRAGWVNG-DDBAPUKQSA-N 2 0 340.433 4.218 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1)c1ccsc1 ZINC000453211167 1031728124 /nfs/dbraw/zinc/72/81/24/1031728124.db2.gz NDDSJBDKXUPHAK-FQEVSTJZSA-N 2 0 344.524 4.462 20 0 EIADRP FC1(F)CC(C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]3CCC[C@@H]32)C1 ZINC000453242255 1031796612 /nfs/dbraw/zinc/79/66/12/1031796612.db2.gz PYGGRXLLNVIYBE-GUDVDZBRSA-N 2 0 334.454 4.065 20 0 EIADRP CCN(CC)[C@@H](C[NH2+]C1CCC2(CCOCC2)CC1)c1ccccc1 ZINC000531932701 1031840786 /nfs/dbraw/zinc/84/07/86/1031840786.db2.gz DXLXWQHBPWNESZ-NRFANRHFSA-N 2 0 344.543 4.399 20 0 EIADRP C/C=C\COc1ccc(CC[C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000449560320 1031847236 /nfs/dbraw/zinc/84/72/36/1031847236.db2.gz JJJMNEODENUPIH-KFEWKHROSA-N 2 0 342.527 4.177 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2ccccc2C(F)(F)F)C1 ZINC000531958970 1031878127 /nfs/dbraw/zinc/87/81/27/1031878127.db2.gz HCMKGAVIKAHKPO-GJZGRUSLSA-N 2 0 328.422 4.476 20 0 EIADRP C[N@H+](CCCC[NH2+][C@@H]1CCc2ccc(OC(F)(F)F)cc21)C1CC1 ZINC000453398541 1031933452 /nfs/dbraw/zinc/93/34/52/1031933452.db2.gz KPGFTBPYBCLKHB-QGZVFWFLSA-N 2 0 342.405 4.037 20 0 EIADRP Cc1nc(-c2cccnc2)sc1[C@H](C)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000453406498 1031942145 /nfs/dbraw/zinc/94/21/45/1031942145.db2.gz RFDWTTUUSNCGDP-AWEZNQCLSA-N 2 0 344.528 4.039 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(Oc2ccccc2)cn1 ZINC000453411609 1031947005 /nfs/dbraw/zinc/94/70/05/1031947005.db2.gz VQWQMUJQONIHLU-KRWDZBQOSA-N 2 0 339.483 4.399 20 0 EIADRP CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000453419659 1031972686 /nfs/dbraw/zinc/97/26/86/1031972686.db2.gz VVKSITMDZXNWTP-QMCAAQAGSA-N 2 0 342.527 4.119 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+]CCCC[N@H+](C)C1CC1)CCCS2 ZINC000453420455 1031976424 /nfs/dbraw/zinc/97/64/24/1031976424.db2.gz ZOWYIZKDDDQTEQ-GOSISDBHSA-N 2 0 334.529 4.086 20 0 EIADRP Clc1cccc([C@@H]2CC[C@H]([NH2+]C3CC[NH+](CC4CC4)CC3)C2)c1 ZINC000449771979 1031993189 /nfs/dbraw/zinc/99/31/89/1031993189.db2.gz KNFROFSIEZUJKI-XLIONFOSSA-N 2 0 332.919 4.440 20 0 EIADRP Clc1cccc([C@H]2CC[C@H]([NH2+]C3CC[NH+](CC4CC4)CC3)C2)c1 ZINC000449771978 1031995041 /nfs/dbraw/zinc/99/50/41/1031995041.db2.gz KNFROFSIEZUJKI-PXNSSMCTSA-N 2 0 332.919 4.440 20 0 EIADRP C[N@H+](CCCC[NH2+]Cc1ccc(-c2cccc(F)c2F)o1)C1CC1 ZINC000453603303 1032038660 /nfs/dbraw/zinc/03/86/60/1032038660.db2.gz XGKFTJYDEMQTMZ-UHFFFAOYSA-N 2 0 334.410 4.189 20 0 EIADRP c1ccc(C[N@@H+]2CC[C@H]([NH2+][C@H]3C[C@H]4C[C@H]4C3)[C@H](c3ccccc3)C2)cc1 ZINC001167917499 1033851461 /nfs/dbraw/zinc/85/14/61/1033851461.db2.gz MMHMYQVKLXQSAI-JTKSJCOOSA-N 2 0 346.518 4.433 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(C[NH+]2CCCCC2)c1)c1cncc(F)c1 ZINC000411509313 1033949176 /nfs/dbraw/zinc/94/91/76/1033949176.db2.gz WJOYYKWBXWSJJX-INIZCTEOSA-N 2 0 327.447 4.057 20 0 EIADRP COc1cc(-c2ccccc2)ccc1C[NH+]1CCC(C[NH+](C)C)CC1 ZINC000512792103 1033956824 /nfs/dbraw/zinc/95/68/24/1033956824.db2.gz HOZPBYCUMHZYBU-UHFFFAOYSA-N 2 0 338.495 4.136 20 0 EIADRP Cc1ccccc1CN1CCC([NH2+]Cc2cc(C)c(O)c(C)c2)CC1 ZINC000512815890 1034007060 /nfs/dbraw/zinc/00/70/60/1034007060.db2.gz ODAWACUNXAQUFA-UHFFFAOYSA-N 2 0 338.495 4.072 20 0 EIADRP CCc1ccc(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000397558162 1034284198 /nfs/dbraw/zinc/28/41/98/1034284198.db2.gz QJINSDXYLAOEEW-UHFFFAOYSA-N 2 0 328.525 4.312 20 0 EIADRP Clc1ccc([C@H]([NH2+][C@@H]2CC[C@H]3C[NH2+]C[C@H]3C2)c2ccsc2)cc1 ZINC000647792136 1034376816 /nfs/dbraw/zinc/37/68/16/1034376816.db2.gz UDTQRXHUULPDIO-WLWJZTKJSA-N 2 0 346.927 4.469 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCCc3nc(-c4ccccc4F)sc32)C1 ZINC000333303409 1034627495 /nfs/dbraw/zinc/62/74/95/1034627495.db2.gz QLCMFRXPUSOVPY-DVOMOZLQSA-N 2 0 345.487 4.186 20 0 EIADRP C[N@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+]([C@@H]3C[C@H]4C[C@H]4C3)C[C@H]21 ZINC001167934137 1034711105 /nfs/dbraw/zinc/71/11/05/1034711105.db2.gz GVMRSHOMCRAQES-WGEZERDCSA-N 2 0 330.541 4.079 20 0 EIADRP CC(C)(C[NH2+]C1CC[NH+](C2CCCCC2)CC1)Oc1ccccc1 ZINC000513234198 1034842069 /nfs/dbraw/zinc/84/20/69/1034842069.db2.gz UAZSZRGGKGOUAO-UHFFFAOYSA-N 2 0 330.516 4.231 20 0 EIADRP C[N@@H+](Cc1ccc(F)cc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000501083472 1035374649 /nfs/dbraw/zinc/37/46/49/1035374649.db2.gz UJOWHNRIDYIIRS-UHFFFAOYSA-N 2 0 347.865 4.223 20 0 EIADRP CCc1cc(OC)ccc1C[NH2+]Cc1ccccc1C[NH+](CC)CC ZINC000501379034 1035433289 /nfs/dbraw/zinc/43/32/89/1035433289.db2.gz ZRBWUEXGRPSRMD-UHFFFAOYSA-N 2 0 340.511 4.389 20 0 EIADRP CCc1cc(OC)ccc1C[NH2+]Cc1cccc(C[NH+](CC)CC)c1 ZINC000501377248 1035433411 /nfs/dbraw/zinc/43/34/11/1035433411.db2.gz JZPXBDYKOSVWIM-UHFFFAOYSA-N 2 0 340.511 4.389 20 0 EIADRP C[N@H+](CCC[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1)C1CCCCC1 ZINC000501379497 1035436567 /nfs/dbraw/zinc/43/65/67/1035436567.db2.gz BBZVFUPJFKATMS-UYAOXDASSA-N 2 0 329.532 4.352 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCC[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000501384131 1035436609 /nfs/dbraw/zinc/43/66/09/1035436609.db2.gz WRWVEMQVKNAFDD-JTJHWIPRSA-N 2 0 329.532 4.065 20 0 EIADRP C[C@@H]1CCCN(C(C)(C)C[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)C1 ZINC000501417431 1035437533 /nfs/dbraw/zinc/43/75/33/1035437533.db2.gz AYCWEIYDUWCEIA-WSTZPKSXSA-N 2 0 329.532 4.208 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+]C/C(C)=C/c2ccccc2C(F)(F)F)C1 ZINC000501419518 1035441402 /nfs/dbraw/zinc/44/14/02/1035441402.db2.gz GZYHKHYRHXXEET-YVGNARHYSA-N 2 0 326.406 4.040 20 0 EIADRP C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](CC[C@H]1CC[NH2+]C1)C1CC1 ZINC000420299092 1035501809 /nfs/dbraw/zinc/50/18/09/1035501809.db2.gz GGBHINVZIOAIMJ-UONOGXRCSA-N 2 0 326.406 4.230 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[N@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000420328277 1035532137 /nfs/dbraw/zinc/53/21/37/1035532137.db2.gz ZVTDIVMAVVLURT-CVEARBPZSA-N 2 0 329.513 4.111 20 0 EIADRP CSCC1(CC[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)CC1 ZINC000595067425 1035549827 /nfs/dbraw/zinc/54/98/27/1035549827.db2.gz ILNPRTXKAGURLZ-MJGOQNOKSA-N 2 0 332.557 4.020 20 0 EIADRP CSCC1(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC000595065893 1035551083 /nfs/dbraw/zinc/55/10/83/1035551083.db2.gz FWBZSBOXOLZYKV-OWZKRDHZSA-N 2 0 344.568 4.305 20 0 EIADRP Brc1ccc([C@H]2CCC[N@@H+]2CC[C@@H]2CCC[NH2+]C2)s1 ZINC000420372163 1035557347 /nfs/dbraw/zinc/55/73/47/1035557347.db2.gz LGSBFONKUOMVFO-QWHCGFSZSA-N 2 0 343.334 4.037 20 0 EIADRP CC(C)c1ccc([C@H](C)[NH+]2CCC([C@H]3OCCC[C@H]3[NH3+])CC2)cc1 ZINC000420388716 1035563946 /nfs/dbraw/zinc/56/39/46/1035563946.db2.gz XIPPFYBOQCYDQM-ZLGUVYLKSA-N 2 0 330.516 4.089 20 0 EIADRP C[C@H](c1ccc2ccccc2c1)[NH+]1CCC([C@@H]2OCCC[C@@H]2[NH3+])CC1 ZINC000420374244 1035572786 /nfs/dbraw/zinc/57/27/86/1035572786.db2.gz HFQMHERVDBIPSN-XGRCMKMKSA-N 2 0 338.495 4.119 20 0 EIADRP CCS[C@@H]1CCC[C@@H]1[NH2+]C/C=C\C[NH2+][C@@H]1CCC[C@@H]1SCC ZINC000595484658 1035682755 /nfs/dbraw/zinc/68/27/55/1035682755.db2.gz MSXHEYCDOLYHMV-JPVWCZMSSA-N 2 0 342.618 4.070 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)CC3 ZINC000491043098 1035792072 /nfs/dbraw/zinc/79/20/72/1035792072.db2.gz YZIYFYSDOWEDAL-QZTJIDSGSA-N 2 0 339.527 4.044 20 0 EIADRP Clc1cccc(Cl)c1CCC[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000666993797 1035826245 /nfs/dbraw/zinc/82/62/45/1035826245.db2.gz KBTTVXHZTZVTAU-ZDUSSCGKSA-N 2 0 327.299 4.190 20 0 EIADRP Nc1ccc2cc(-c3cccc(C[NH+]4CCC([NH3+])CC4)c3)ccc2c1 ZINC000906192732 1036109062 /nfs/dbraw/zinc/10/90/62/1036109062.db2.gz HIMVHOHEEAVJSD-UHFFFAOYSA-N 2 0 331.463 4.012 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2)cc1OC ZINC000571682778 1036120432 /nfs/dbraw/zinc/12/04/32/1036120432.db2.gz WKQJLLKKCVYEAL-MRXNPFEDSA-N 2 0 342.483 4.184 20 0 EIADRP Fc1cc(Cl)cc(C[NH2+]Cc2cccc(C[NH+]3CCCC3)c2)c1 ZINC000485710165 1036188545 /nfs/dbraw/zinc/18/85/45/1036188545.db2.gz MGFHCCZMEXSTAP-UHFFFAOYSA-N 2 0 332.850 4.365 20 0 EIADRP C[NH+](C)CCCOc1ccc(C[NH2+]Cc2cccc(C3CC3)c2)cc1 ZINC000421321908 1036271504 /nfs/dbraw/zinc/27/15/04/1036271504.db2.gz FENLTVVPBKTQAX-UHFFFAOYSA-N 2 0 338.495 4.184 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(-c2cnco2)cc1)c1cccc(C[NH+](C)C)c1 ZINC000906523926 1036313811 /nfs/dbraw/zinc/31/38/11/1036313811.db2.gz AHDFCXSYUZFZDZ-MRXNPFEDSA-N 2 0 335.451 4.254 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000421381920 1036339502 /nfs/dbraw/zinc/33/95/02/1036339502.db2.gz XMGUXAYIDFTTMS-HKKVPVCXSA-N 2 0 326.937 4.356 20 0 EIADRP Cc1cnccc1C[NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000572106299 1036433529 /nfs/dbraw/zinc/43/35/29/1036433529.db2.gz QRBZNHZJFFDNCE-ROUUACIJSA-N 2 0 337.511 4.158 20 0 EIADRP COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000502723870 1036583687 /nfs/dbraw/zinc/58/36/87/1036583687.db2.gz RZINJQFLCBFOSQ-IPJJNNNSSA-N 2 0 344.543 4.356 20 0 EIADRP COCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C ZINC000502723868 1036588225 /nfs/dbraw/zinc/58/82/25/1036588225.db2.gz RZINJQFLCBFOSQ-CNNODRBYSA-N 2 0 344.543 4.356 20 0 EIADRP c1ccc2c(c1)n[nH]c2C[NH2+]Cc1ccccc1C[NH+]1CCCCCC1 ZINC000602908981 1036663457 /nfs/dbraw/zinc/66/34/57/1036663457.db2.gz MDTZLOJKKTZQDB-UHFFFAOYSA-N 2 0 348.494 4.229 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000486479365 1036727937 /nfs/dbraw/zinc/72/79/37/1036727937.db2.gz VFVYEWZFCSNSIK-QGQQZZQASA-N 2 0 334.507 4.290 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1ccncc1Cl ZINC000421819195 1036805342 /nfs/dbraw/zinc/80/53/42/1036805342.db2.gz FQUIXCPPFAWWAS-HNNXBMFYSA-N 2 0 331.891 4.426 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1csc(-c2ccccc2)n1 ZINC000421867115 1036816924 /nfs/dbraw/zinc/81/69/24/1036816924.db2.gz AWGPZYPEHPDNNF-OOHWJJMZSA-N 2 0 329.513 4.334 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2cc3ccc(F)cc3[nH]2)C1 ZINC000486689702 1036817517 /nfs/dbraw/zinc/81/75/17/1036817517.db2.gz PGAPNTYSZYXKNU-HZPDHXFCSA-N 2 0 331.479 4.155 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)CCCS2 ZINC000421876765 1036828951 /nfs/dbraw/zinc/82/89/51/1036828951.db2.gz LCEFXOKEPPMQQH-JMLCCBQJSA-N 2 0 334.529 4.085 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+]C3CCC4(CC4)CC3)CC2)cc1 ZINC000486734992 1036834094 /nfs/dbraw/zinc/83/40/94/1036834094.db2.gz WNVKTMRWBCIQIL-UHFFFAOYSA-N 2 0 342.527 4.220 20 0 EIADRP CC1CC[NH+](Cc2ccc(C[NH2+]Cc3ccc4[nH]cnc4c3)cc2)CC1 ZINC000589638952 1036856056 /nfs/dbraw/zinc/85/60/56/1036856056.db2.gz IUMFECKHDJCUNW-UHFFFAOYSA-N 2 0 348.494 4.085 20 0 EIADRP CCOc1cccc2cc([C@@H](C)[NH2+]C3CCC([NH+](C)C)CC3)oc21 ZINC000513762628 1036866628 /nfs/dbraw/zinc/86/66/28/1036866628.db2.gz RPNYHEAHWAHAEK-ODIFPOPNSA-N 2 0 330.472 4.355 20 0 EIADRP Clc1ccsc1C[NH2+]CC1CC[NH+](Cc2cccs2)CC1 ZINC000486976217 1036928079 /nfs/dbraw/zinc/92/80/79/1036928079.db2.gz VRGROHLHDBXCAJ-UHFFFAOYSA-N 2 0 340.945 4.465 20 0 EIADRP CC(C)[NH+]1CCC([N@H+](C)CCCOc2ccc3ccccc3c2)CC1 ZINC000590058426 1036965081 /nfs/dbraw/zinc/96/50/81/1036965081.db2.gz GMLUGZPZJVQXKU-UHFFFAOYSA-N 2 0 340.511 4.413 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000271842544 1037030444 /nfs/dbraw/zinc/03/04/44/1037030444.db2.gz HCSFFYORJQOBNA-CQSZACIVSA-N 2 0 327.497 4.031 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ncc(-c3ccc(F)cc3)o2)CC1 ZINC000590787202 1037167785 /nfs/dbraw/zinc/16/77/85/1037167785.db2.gz USUHIQQQSDVTCJ-UHFFFAOYSA-N 2 0 345.462 4.033 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)[C@@H]2CCc3cc(F)ccc3C2)CC1 ZINC001168416356 1037238914 /nfs/dbraw/zinc/23/89/14/1037238914.db2.gz IMFUMACMMGSCJH-YPAWHYETSA-N 2 0 344.518 4.445 20 0 EIADRP CCOCCC1(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)CCC1 ZINC000272711313 1037274495 /nfs/dbraw/zinc/27/44/95/1037274495.db2.gz COBHMDYZFCHCLH-TZIWHRDSSA-N 2 0 344.543 4.084 20 0 EIADRP C[C@@H](c1ccccc1)[NH+]1CCC(Nc2cc[nH+]c3ccccc23)CC1 ZINC000604757453 1037529277 /nfs/dbraw/zinc/52/92/77/1037529277.db2.gz FJLXEQVKYODRRL-KRWDZBQOSA-N 2 0 331.463 4.294 20 0 EIADRP CC[NH+]1CCC(C[NH2+]Cc2ccc(N(C)c3ccccc3)cc2)CC1 ZINC000591708097 1037554472 /nfs/dbraw/zinc/55/44/72/1037554472.db2.gz KIZPYLVYODDGMW-UHFFFAOYSA-N 2 0 337.511 4.276 20 0 EIADRP c1sc(C2CCCCC2)nc1C[N@@H+]1CCC[C@H]([C@@H]2CC[NH2+]C2)C1 ZINC000573497382 1037569660 /nfs/dbraw/zinc/56/96/60/1037569660.db2.gz XJIWWWTYHJCQNP-SJORKVTESA-N 2 0 333.545 4.012 20 0 EIADRP C/C(=C/c1ccccc1)C[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000488513592 1037641154 /nfs/dbraw/zinc/64/11/54/1037641154.db2.gz KKDXFIHDCPGGLV-MNDPQUGUSA-N 2 0 338.495 4.210 20 0 EIADRP [NH3+]C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc(C(F)(F)F)cc3)s2)C1 ZINC000414652228 1037676506 /nfs/dbraw/zinc/67/65/06/1037676506.db2.gz GRXVTSFACPKPTG-LBPRGKRZSA-N 2 0 340.414 4.215 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]Cc1ccccc1OC1CCCC1 ZINC000422693565 1037807235 /nfs/dbraw/zinc/80/72/35/1037807235.db2.gz MHQJNHHBTINMFF-HNNXBMFYSA-N 2 0 339.483 4.021 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC(C)(C)c1ccc(F)cc1Cl ZINC000422732594 1037809165 /nfs/dbraw/zinc/80/91/65/1037809165.db2.gz PZKCXXSTIQXKKV-GFCCVEGCSA-N 2 0 349.881 4.270 20 0 EIADRP COc1ccc([C@@H](Cc2ccc(F)cc2)[NH2+][C@@H](C)CCCC[NH3+])cc1 ZINC000422714172 1037810532 /nfs/dbraw/zinc/81/05/32/1037810532.db2.gz KTJNLWMAMIYZGC-HRAATJIYSA-N 2 0 344.474 4.225 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422740395 1037822102 /nfs/dbraw/zinc/82/21/02/1037822102.db2.gz MQOOXSPSUHHHSO-AQWYCLHESA-N 2 0 345.487 4.191 20 0 EIADRP Cc1c2ccccc2oc1C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422748891 1037825868 /nfs/dbraw/zinc/82/58/68/1037825868.db2.gz WQCLRHGHHZHJIG-XMSQKQJNSA-N 2 0 348.446 4.087 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000422774240 1037831365 /nfs/dbraw/zinc/83/13/65/1037831365.db2.gz WFGGEMQKJCLCFW-KDOFPFPSSA-N 2 0 334.410 4.094 20 0 EIADRP CC(C)[C@H]([NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1 ZINC000422776359 1037831431 /nfs/dbraw/zinc/83/14/31/1037831431.db2.gz AJAWCECDIATSAU-BAGYTPMASA-N 2 0 336.479 4.229 20 0 EIADRP C[C@H](OCCC[NH2+][C@@H]1CCC[C@@H]1[C@@H]1CCCC[NH2+]1)c1ccccc1 ZINC000422788266 1037834511 /nfs/dbraw/zinc/83/45/11/1037834511.db2.gz QXSPUWZPVAEKIW-FYZZASKESA-N 2 0 330.516 4.055 20 0 EIADRP c1csc([C@H]([NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C2CC2)c1 ZINC000422796661 1037836646 /nfs/dbraw/zinc/83/66/46/1037836646.db2.gz KCJYFCAMMFELOX-DBVUQKKJSA-N 2 0 340.492 4.045 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)c(C)s1 ZINC000422808550 1037838009 /nfs/dbraw/zinc/83/80/09/1037838009.db2.gz OJLLKCGUGLPRQZ-BOUXLOLZSA-N 2 0 342.508 4.271 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000422814976 1037840014 /nfs/dbraw/zinc/84/00/14/1037840014.db2.gz WSFMKLDNQPTGHX-HZPDHXFCSA-N 2 0 346.478 4.323 20 0 EIADRP Cc1ccc([C@H]([NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C2CC2)cc1 ZINC000422813359 1037840240 /nfs/dbraw/zinc/84/02/40/1037840240.db2.gz RQWYTOFKZCESFC-ACIOBRDBSA-N 2 0 348.490 4.292 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC(C)(C)c1cccc(Cl)c1 ZINC000422822165 1037841797 /nfs/dbraw/zinc/84/17/97/1037841797.db2.gz JHUFPURRIJTGDW-ZDUSSCGKSA-N 2 0 331.891 4.131 20 0 EIADRP [NH3+]CC1CCC([NH2+]Cc2ccc(COCc3ccccc3)cc2)CC1 ZINC000422857084 1037846608 /nfs/dbraw/zinc/84/66/08/1037846608.db2.gz GVAJAMUCCOZSFZ-UHFFFAOYSA-N 2 0 338.495 4.011 20 0 EIADRP C[C@H](CC[NH2+][C@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccccc1 ZINC000422857703 1037847350 /nfs/dbraw/zinc/84/73/50/1037847350.db2.gz YTTZJFQTFDFTHI-AGHHOFFYSA-N 2 0 336.479 4.026 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@H](C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)C1 ZINC000422853092 1037847586 /nfs/dbraw/zinc/84/75/86/1037847586.db2.gz RVZUYMBYJUVYRR-MZBWOGCUSA-N 2 0 332.454 4.256 20 0 EIADRP [NH3+]C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1COCc1ccccc1 ZINC000422862316 1037849222 /nfs/dbraw/zinc/84/92/22/1037849222.db2.gz NMSLPLTUKOUUBW-KNQAVFIVSA-N 2 0 338.495 4.011 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CCc1ccc(C(C)(C)C)cc1 ZINC000422845859 1037850652 /nfs/dbraw/zinc/85/06/52/1037850652.db2.gz OXBJBLBVLNDXTA-OAHLLOKOSA-N 2 0 325.500 4.040 20 0 EIADRP c1[nH]c2ccccc2c1CCC[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1 ZINC000422884132 1037854282 /nfs/dbraw/zinc/85/42/82/1037854282.db2.gz DLAYZTFKSFRCIK-SESVDKBCSA-N 2 0 325.500 4.001 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CN[C@H]1C[C@H]([NH3+])c2ccccc21 ZINC000422885705 1037854714 /nfs/dbraw/zinc/85/47/14/1037854714.db2.gz UZHWUEWLEJXHDK-VSDWSMLSSA-N 2 0 349.522 4.295 20 0 EIADRP CCC[C@H]([NH2+][C@H](C)c1ccc(C[NH3+])nc1C)c1ccc(F)cc1F ZINC000422874351 1037857521 /nfs/dbraw/zinc/85/75/21/1037857521.db2.gz NLLUISLSKMXBDD-YJYMSZOUSA-N 2 0 333.426 4.319 20 0 EIADRP CCC[C@@H]([NH2+][C@H](C)c1ccc(C[NH3+])nc1C)c1ccc(F)cc1F ZINC000422874348 1037857663 /nfs/dbraw/zinc/85/76/63/1037857663.db2.gz NLLUISLSKMXBDD-BFUOFWGJSA-N 2 0 333.426 4.319 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2CN[C@H]2C[C@@H]([NH3+])c3ccccc32)C1 ZINC000422874199 1037858449 /nfs/dbraw/zinc/85/84/49/1037858449.db2.gz CGFMFZGQGORYSN-ZQMYSKGWSA-N 2 0 349.522 4.153 20 0 EIADRP C[C@H](C[C@@H]1CCCCC[NH2+]1)[NH2+]C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000422898141 1037860123 /nfs/dbraw/zinc/86/01/23/1037860123.db2.gz DJFMGKWOFATKOO-AYWYSENESA-N 2 0 330.516 4.055 20 0 EIADRP CC[C@H](C)Oc1cc(C)ccc1C[NH2+][C@H](C)c1ccc(C[NH3+])nc1C ZINC000422873366 1037860484 /nfs/dbraw/zinc/86/04/84/1037860484.db2.gz LDRJDSACROUMPI-JKSUJKDBSA-N 2 0 341.499 4.185 20 0 EIADRP COc1ccccc1Oc1ccc(C[NH2+][C@H](C)CCCC[NH3+])cc1 ZINC000422908179 1037864109 /nfs/dbraw/zinc/86/41/09/1037864109.db2.gz MCPAENBGSDAVKZ-MRXNPFEDSA-N 2 0 328.456 4.095 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)ccc1F ZINC000422921446 1037867886 /nfs/dbraw/zinc/86/78/86/1037867886.db2.gz PUVDPGSUIITNAQ-PAXLWEDBSA-N 2 0 340.442 4.041 20 0 EIADRP COc1cccc(C[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c2ccccc2)c1 ZINC000422941954 1037876133 /nfs/dbraw/zinc/87/61/33/1037876133.db2.gz OZWMWSOMPMQKST-LAUBAEHRSA-N 2 0 326.484 4.086 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCCCOc1ccc(Cl)cc1 ZINC000422942935 1037877452 /nfs/dbraw/zinc/87/74/52/1037877452.db2.gz XESSXWQFMVIWBZ-AWEZNQCLSA-N 2 0 347.890 4.012 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000422943314 1037877594 /nfs/dbraw/zinc/87/75/94/1037877594.db2.gz XXUHGGFXEGLGRK-AJSFGMTHSA-N 2 0 327.497 4.052 20 0 EIADRP CCC[C@@H]([NH2+][C@@H](CCC[NH3+])COC)c1ccc(Cl)c(Cl)c1 ZINC000422958608 1037889763 /nfs/dbraw/zinc/88/97/63/1037889763.db2.gz YKJXXQPHWFZGNB-XJKSGUPXSA-N 2 0 333.303 4.178 20 0 EIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@H](C)CCCC[NH3+])s2)cc1 ZINC000422984510 1037895654 /nfs/dbraw/zinc/89/56/54/1037895654.db2.gz YDCROLUKSJPNEH-KGLIPLIRSA-N 2 0 347.528 4.295 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]C[C@@H]1CCC(C)(C)c2ccccc21 ZINC000423010955 1037898744 /nfs/dbraw/zinc/89/87/44/1037898744.db2.gz AKOCLTYNVPBLKT-WBVHZDCISA-N 2 0 337.511 4.355 20 0 EIADRP Cc1cc([C@H]([NH2+][C@H](C)c2ccc(C[NH3+])nc2C)C2CC2)ccc1F ZINC000423015955 1037902927 /nfs/dbraw/zinc/90/29/27/1037902927.db2.gz RXHUBUWRLAXTHD-JLTOFOAXSA-N 2 0 327.447 4.098 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H]1CCCc2sc(-c3ccc(F)cc3)nc21 ZINC000423045177 1037924125 /nfs/dbraw/zinc/92/41/25/1037924125.db2.gz CLHNNTKZMYAKJK-BBRMVZONSA-N 2 0 347.503 4.434 20 0 EIADRP CC[C@H]([NH2+][C@H](C)CCCC[NH3+])c1cc(F)cc(Br)c1 ZINC000423059822 1037928483 /nfs/dbraw/zinc/92/84/83/1037928483.db2.gz GUHMCVQZXKDHRQ-ABAIWWIYSA-N 2 0 331.273 4.146 20 0 EIADRP CC[C@H]([NH2+][C@H](C)[C@@H]1CCC[NH2+]C1)c1cc(F)cc(Br)c1 ZINC000423064186 1037930620 /nfs/dbraw/zinc/93/06/20/1037930620.db2.gz QUYSIMHCKZXHCG-HSMVNMDESA-N 2 0 343.284 4.017 20 0 EIADRP c1cncc(-c2cccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)c2)c1 ZINC000423052951 1037937995 /nfs/dbraw/zinc/93/79/95/1037937995.db2.gz RNPRFTVWFAFHQR-FDFHNCONSA-N 2 0 335.495 4.149 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1cc2ccccc2s1 ZINC000423053861 1037942517 /nfs/dbraw/zinc/94/25/17/1037942517.db2.gz BDXMTFATCAZZOL-GXTWGEPZSA-N 2 0 325.481 4.475 20 0 EIADRP C[C@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]C1CC(F)(c2cccc(Cl)c2)C1 ZINC000423099383 1037957849 /nfs/dbraw/zinc/95/78/49/1037957849.db2.gz TZUQDFUIORGXTB-UYSIFVEPSA-N 2 0 346.877 4.215 20 0 EIADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@@H]1CC[C@H](c2ccccc2F)C1 ZINC000423097629 1037958501 /nfs/dbraw/zinc/95/85/01/1037958501.db2.gz QXHVHTRDELUGMF-JWVYWZTKSA-N 2 0 326.459 4.010 20 0 EIADRP C[C@H]([NH3+])C[C@H](C)[NH2+]C[C@@H](OCc1ccccc1)c1ccc(Cl)cc1 ZINC000423126483 1037971918 /nfs/dbraw/zinc/97/19/18/1037971918.db2.gz IVPJBMLHGHSKPK-TWOQFEAHSA-N 2 0 346.902 4.313 20 0 EIADRP Cc1cc(C[NH2+]CC2(C)CC[NH+](C)CC2)ccc1Oc1cccnc1 ZINC000503905579 1037978590 /nfs/dbraw/zinc/97/85/90/1037978590.db2.gz CDEQRXYIPZVCTJ-UHFFFAOYSA-N 2 0 339.483 4.004 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000423112096 1037989071 /nfs/dbraw/zinc/98/90/71/1037989071.db2.gz XBMHIUHDDQEUEK-BHUNQDJPSA-N 2 0 326.406 4.201 20 0 EIADRP C[C@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCC1)[C@@H]1CC[NH2+]C1 ZINC000423112408 1037990194 /nfs/dbraw/zinc/99/01/94/1037990194.db2.gz XNDUENAGSNDHIM-MJEQTWJJSA-N 2 0 326.406 4.134 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H]1CCCC[C@H]1CC(F)(F)F ZINC000423151873 1038004105 /nfs/dbraw/zinc/00/41/05/1038004105.db2.gz DDDOATGKNCHODG-WWGRRREGSA-N 2 0 329.410 4.011 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+]Cc2c(OC(F)F)ccc3ccccc32)CC1 ZINC000503937237 1038028710 /nfs/dbraw/zinc/02/87/10/1038028710.db2.gz QDHDTVUMGSOUMA-UHFFFAOYSA-N 2 0 348.437 4.263 20 0 EIADRP C[C@H]([NH2+]CC1([NH3+])CCCCCC1)[C@H](C)c1nc2ccccc2s1 ZINC000423200051 1038052013 /nfs/dbraw/zinc/05/20/13/1038052013.db2.gz LNUVJOQKRRCOJX-GJZGRUSLSA-N 2 0 331.529 4.430 20 0 EIADRP C[C@H]([NH3+])CC[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423224191 1038067887 /nfs/dbraw/zinc/06/78/87/1038067887.db2.gz IMNGNJROCHVBNM-FZMZJTMJSA-N 2 0 335.904 4.168 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H]2CCCCc3ccc(Br)cc32)CC1 ZINC000423229875 1038071317 /nfs/dbraw/zinc/07/13/17/1038071317.db2.gz ICAYTDVWQMXUIY-VMBOVVBDSA-N 2 0 337.305 4.076 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@@H](C)[NH2+]CC[C@H]1CCC[NH2+]C1 ZINC000423263420 1038073702 /nfs/dbraw/zinc/07/37/02/1038073702.db2.gz XFLRDWJTDSTGOA-GDBMZVCRSA-N 2 0 329.513 4.159 20 0 EIADRP Clc1ccccc1C[C@@H]([NH2+]CC[C@H]1CC[NH2+]C1)c1ccsc1 ZINC000423243883 1038076425 /nfs/dbraw/zinc/07/64/25/1038076425.db2.gz GSOKLPGHRYLRNH-RDTXWAMCSA-N 2 0 334.916 4.275 20 0 EIADRP COc1ccc([C@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2ccccc2Cl)cc1 ZINC000423250941 1038081689 /nfs/dbraw/zinc/08/16/89/1038081689.db2.gz RFVGDDFBRUHGGO-QRWLVFNGSA-N 2 0 344.886 4.027 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H]2CCCOc3ccc(Cl)cc32)cc1 ZINC000423291257 1038096296 /nfs/dbraw/zinc/09/62/96/1038096296.db2.gz HNJXBVDDVOFYND-ACJLOTCBSA-N 2 0 330.859 4.363 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)CCS2 ZINC000423291666 1038097404 /nfs/dbraw/zinc/09/74/04/1038097404.db2.gz JIERSUAHDIZLHN-ACJLOTCBSA-N 2 0 328.481 4.042 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H]2CCc3cc(Br)ccc32)cc1 ZINC000423293061 1038099386 /nfs/dbraw/zinc/09/93/86/1038099386.db2.gz POWLLTRYMFXMNI-KZULUSFZSA-N 2 0 345.284 4.246 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+][C@@H]3CCCC[C@H]3C[NH3+])cs2)cs1 ZINC000423273771 1038101117 /nfs/dbraw/zinc/10/11/17/1038101117.db2.gz JIVDAJPVLUZTRN-CORIIIEPSA-N 2 0 335.542 4.348 20 0 EIADRP C[C@H]([NH3+])c1ccc(C[NH2+][C@@H](C[C@@H]2CCOC2)c2ccc(F)cc2)cc1 ZINC000423292956 1038101635 /nfs/dbraw/zinc/10/16/35/1038101635.db2.gz PBRKOOZFGZIPKU-WJPUGNRLSA-N 2 0 342.458 4.103 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]C[C@@]1(C)CCC[NH2+]C1 ZINC000423321521 1038117658 /nfs/dbraw/zinc/11/76/58/1038117658.db2.gz GHHUJMJUCWJRSB-LIRRHRJNSA-N 2 0 329.513 4.159 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]CCC[N@H+]2CCCC[C@@H]2C)C1 ZINC000467312504 1038148221 /nfs/dbraw/zinc/14/82/21/1038148221.db2.gz FUWZWUMYNRSPNV-XUVXKRRUSA-N 2 0 329.532 4.270 20 0 EIADRP COc1ccc2cc([C@H](C)[NH2+]Cc3ccc4c(c3)C[NH2+]C4)ccc2c1 ZINC000423359383 1038170252 /nfs/dbraw/zinc/17/02/52/1038170252.db2.gz PANCSPPQFLMSGD-HNNXBMFYSA-N 2 0 332.447 4.302 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(F)c(Br)c1 ZINC000423363638 1038180493 /nfs/dbraw/zinc/18/04/93/1038180493.db2.gz USAWIJCIVIHUFP-NSHDSACASA-N 2 0 349.247 4.042 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)C1 ZINC000423366077 1038184436 /nfs/dbraw/zinc/18/44/36/1038184436.db2.gz LFPLJONJPXSVOB-TWMKSMIVSA-N 2 0 326.406 4.201 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@@H](C)[NH2+]CC[C@H]1CCC[NH2+]1 ZINC000423367938 1038185884 /nfs/dbraw/zinc/18/58/84/1038185884.db2.gz RSRLVWMUDQMKFO-TZMCWYRMSA-N 2 0 333.476 4.050 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H]1CCC[C@@H]([NH3+])C1 ZINC000423368912 1038186643 /nfs/dbraw/zinc/18/66/43/1038186643.db2.gz DMNIISVCNWNTLY-YUTCNCBUSA-N 2 0 333.476 4.178 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423368689 1038187231 /nfs/dbraw/zinc/18/72/31/1038187231.db2.gz FERGPVLGUXAWBC-JXXFODFXSA-N 2 0 342.458 4.196 20 0 EIADRP COc1ccc(-c2nc(C)c([C@H](C)[NH2+][C@@H]3CCC[C@@H]([NH3+])C3)s2)cc1 ZINC000423370194 1038189093 /nfs/dbraw/zinc/18/90/93/1038189093.db2.gz FHXMZZHHMOTRTQ-APHBMKBZSA-N 2 0 345.512 4.048 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423376909 1038189707 /nfs/dbraw/zinc/18/97/07/1038189707.db2.gz JGUMTQBSGXNWBE-ZDUSSCGKSA-N 2 0 334.385 4.029 20 0 EIADRP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423395254 1038201543 /nfs/dbraw/zinc/20/15/43/1038201543.db2.gz RWOGVIIFBTZRSX-ZDUSSCGKSA-N 2 0 334.385 4.029 20 0 EIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CCCO2 ZINC000423399738 1038205064 /nfs/dbraw/zinc/20/50/64/1038205064.db2.gz UWVDNYFTSJXMSZ-OAQYLSRUSA-N 2 0 336.479 4.417 20 0 EIADRP COCC1(C[NH2+][C@@H](C)c2ccc(-c3cccs3)cc2)CC[NH2+]CC1 ZINC000423375385 1038205872 /nfs/dbraw/zinc/20/58/72/1038205872.db2.gz AASGPMHOFMZEFK-INIZCTEOSA-N 2 0 344.524 4.082 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(Br)ccc1F ZINC000423399803 1038206306 /nfs/dbraw/zinc/20/63/06/1038206306.db2.gz VDVHKPOGYRFJBW-NSHDSACASA-N 2 0 349.247 4.042 20 0 EIADRP Clc1cc2c(c(Cl)c1)[C@@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CC2 ZINC000423401177 1038207040 /nfs/dbraw/zinc/20/70/40/1038207040.db2.gz VVUQAKPMHSSLPL-KRWDZBQOSA-N 2 0 333.262 4.374 20 0 EIADRP COCc1cc([C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@H]2C)ccc1OC ZINC000157883892 1038211490 /nfs/dbraw/zinc/21/14/90/1038211490.db2.gz JYKDDURBPKHUOP-MSOLQXFVSA-N 2 0 348.531 4.147 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccccc1OC(F)(F)F ZINC000423406138 1038215561 /nfs/dbraw/zinc/21/55/61/1038215561.db2.gz YPZNSDKWXABEIB-GFCCVEGCSA-N 2 0 336.357 4.039 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000423444691 1038223987 /nfs/dbraw/zinc/22/39/87/1038223987.db2.gz LXLOFJCCFZWHPP-XMSQKQJNSA-N 2 0 349.522 4.045 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H](c1ccc(Br)cc1Cl)C1CC1 ZINC000423455319 1038238990 /nfs/dbraw/zinc/23/89/90/1038238990.db2.gz MKKKAGIQWZEMPD-ZUZCIYMTSA-N 2 0 345.712 4.271 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+]C[C@@H]1CCC[C@@H]([NH3+])C1 ZINC000423456937 1038240724 /nfs/dbraw/zinc/24/07/24/1038240724.db2.gz HNXHYODJLZNPCH-YSVLISHTSA-N 2 0 329.513 4.287 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+][C@H](c2cccc(OC(F)(F)F)c2)C2CC2)C1 ZINC000423460919 1038241412 /nfs/dbraw/zinc/24/14/12/1038241412.db2.gz BTOOQXJYPRKEAF-VMGRFDJRSA-N 2 0 342.405 4.143 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000423465706 1038242029 /nfs/dbraw/zinc/24/20/29/1038242029.db2.gz WTQFSMFAIBIOAD-SWLSCSKDSA-N 2 0 333.476 4.044 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cccs1 ZINC000423480367 1038252338 /nfs/dbraw/zinc/25/23/38/1038252338.db2.gz VVCVEJWMHIYKMJ-CGTJXYLNSA-N 2 0 332.488 4.321 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@H](C[NH3+])C1)c1ccc2ccccc2c1OC(F)F ZINC000423487191 1038261848 /nfs/dbraw/zinc/26/18/48/1038261848.db2.gz CFFVPISSUASICE-KCQAQPDRSA-N 2 0 334.410 4.219 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+][C@H]2CC[C@@H](C[NH3+])C2)cc1OCCC ZINC000423492312 1038264426 /nfs/dbraw/zinc/26/44/26/1038264426.db2.gz MNIPSTQKDDDWIW-JZXOWHBKSA-N 2 0 334.504 4.042 20 0 EIADRP c1c2ccccc2oc1[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cccnc1 ZINC000423491000 1038265027 /nfs/dbraw/zinc/26/50/27/1038265027.db2.gz YLLOWEYSGOLUGW-GHTZIAJQSA-N 2 0 335.451 4.039 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+][C@H](CCC[NH3+])c2ccccc2)C1 ZINC000423512568 1038272302 /nfs/dbraw/zinc/27/23/02/1038272302.db2.gz OOVKAFJRJGMAPJ-QHAWAJNXSA-N 2 0 337.511 4.486 20 0 EIADRP Cc1cc(N[C@@H]2CCn3ccnc3C2)c2cc(Cl)cc(C)c2[nH+]1 ZINC000489954097 1038283252 /nfs/dbraw/zinc/28/32/52/1038283252.db2.gz PIGMIBCPWVPISM-CQSZACIVSA-N 2 0 326.831 4.128 20 0 EIADRP CC[C@H]([NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1)c1ccc2cc(OC)ccc2c1 ZINC000423537921 1038284935 /nfs/dbraw/zinc/28/49/35/1038284935.db2.gz DWZXAPZJIWBCMY-HIUFNZKISA-N 2 0 338.495 4.277 20 0 EIADRP CSC[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(C(F)(F)F)cc1 ZINC000594511092 1038355895 /nfs/dbraw/zinc/35/58/95/1038355895.db2.gz RAZLTUBTWKPHKH-MAZHCROVSA-N 2 0 346.462 4.039 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2cccc(Cl)n2)CC1 ZINC000173628481 1038429023 /nfs/dbraw/zinc/42/90/23/1038429023.db2.gz CBFZFFRKBJFRAS-UHFFFAOYSA-N 2 0 343.902 4.079 20 0 EIADRP Cc1ccoc1C[NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1 ZINC000608056524 1038529350 /nfs/dbraw/zinc/52/93/50/1038529350.db2.gz VRCTYXQIMMCGTK-UHFFFAOYSA-N 2 0 332.875 4.243 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[NH3+])cc1)c1ccc(Br)cc1 ZINC000570682879 1038604723 /nfs/dbraw/zinc/60/47/23/1038604723.db2.gz CMEJWADHGAAWSL-KRWDZBQOSA-N 2 0 333.273 4.149 20 0 EIADRP C[C@H](C[NH2+][C@@H](Cc1ccncc1)c1cccs1)C[NH+]1CCCCC1 ZINC000424274429 1038780109 /nfs/dbraw/zinc/78/01/09/1038780109.db2.gz YWRZGXKYYUYJQQ-MJGOQNOKSA-N 2 0 343.540 4.139 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000539160619 1038863427 /nfs/dbraw/zinc/86/34/27/1038863427.db2.gz QKFXDEDQGIWJGV-DYVFJYSZSA-N 2 0 326.406 4.088 20 0 EIADRP c1ccc(CCOCCC[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000480898599 1038866577 /nfs/dbraw/zinc/86/65/77/1038866577.db2.gz NDUJOSYWJUEOLD-UHFFFAOYSA-N 2 0 344.543 4.023 20 0 EIADRP C[NH+](C)C1CCC([N@H+](Cc2ccccc2)C2CCSCC2)CC1 ZINC001168328474 1038940380 /nfs/dbraw/zinc/94/03/80/1038940380.db2.gz HYDFGNDFPLXJCW-UHFFFAOYSA-N 2 0 332.557 4.257 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H](CC)c2ccc(Br)cc2)C1 ZINC000481027710 1038966806 /nfs/dbraw/zinc/96/68/06/1038966806.db2.gz WRTCKLVHDILORN-RHSMWYFYSA-N 2 0 339.321 4.222 20 0 EIADRP Cc1cccc(OC[C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000481029257 1038971924 /nfs/dbraw/zinc/97/19/24/1038971924.db2.gz ZRHMMEMZDBTHSE-SFHVURJKSA-N 2 0 330.516 4.149 20 0 EIADRP Cc1cc([C@H](C)[NH2+]CC2CCN(c3cc[nH+]cc3)CC2)c(C)s1 ZINC000089215724 1039025388 /nfs/dbraw/zinc/02/53/88/1039025388.db2.gz VPUPLLAVLDABAZ-HNNXBMFYSA-N 2 0 329.513 4.327 20 0 EIADRP C[C@@H]1CCC[C@H](C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)C1 ZINC000539377632 1039035150 /nfs/dbraw/zinc/03/51/50/1039035150.db2.gz SZXSLKAHBDHRKG-HBFSDRIKSA-N 2 0 342.527 4.391 20 0 EIADRP CC[C@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)C1CCOCC1 ZINC000552045319 1039067115 /nfs/dbraw/zinc/06/71/15/1039067115.db2.gz CYNOXBPYIUZFFU-HRTMPFAESA-N 2 0 344.543 4.224 20 0 EIADRP CC[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1ccc(OC(F)(F)F)cc1 ZINC000552046416 1039067615 /nfs/dbraw/zinc/06/76/15/1039067615.db2.gz HFUSWPSNVLMLAZ-QGZVFWFLSA-N 2 0 344.421 4.358 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1[NH2+]C[C@@H]1CCc2ccccc21 ZINC000481185242 1039086842 /nfs/dbraw/zinc/08/68/42/1039086842.db2.gz WNSHJXDLVADSTJ-RZFNWQHOSA-N 2 0 334.507 4.217 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]C[C@H]1CCc2ccccc21 ZINC000481185239 1039088525 /nfs/dbraw/zinc/08/85/25/1039088525.db2.gz WNSHJXDLVADSTJ-AAIMPIBUSA-N 2 0 334.507 4.217 20 0 EIADRP CSc1ccccc1C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000481187264 1039092394 /nfs/dbraw/zinc/09/23/94/1039092394.db2.gz ZAKFLJTZFYBXGZ-PXNSSMCTSA-N 2 0 340.536 4.409 20 0 EIADRP C[C@@H]([NH2+]CCCCNc1ccccn1)c1cccc(OC(F)F)c1 ZINC000162866247 1039194721 /nfs/dbraw/zinc/19/47/21/1039194721.db2.gz ZWEBTIVDWQPRTR-CQSZACIVSA-N 2 0 335.398 4.226 20 0 EIADRP Cc1cc(C)c([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1C ZINC000481331013 1039306080 /nfs/dbraw/zinc/30/60/80/1039306080.db2.gz HDZKDCJZAVYJQC-IBGZPJMESA-N 2 0 340.511 4.403 20 0 EIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H]3CCCC34CCCC4)cc2)CC1 ZINC000550797118 1039307647 /nfs/dbraw/zinc/30/76/47/1039307647.db2.gz LOIXDAMCSMBVAT-OAQYLSRUSA-N 2 0 342.527 4.362 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H]1CCc2c1cccc2F ZINC000513863838 1039327624 /nfs/dbraw/zinc/32/76/24/1039327624.db2.gz MSJYBGFNYCEWLY-NRFANRHFSA-N 2 0 326.459 4.443 20 0 EIADRP c1cc(-c2nc3ccccc3s2)oc1C[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000414843521 1039344447 /nfs/dbraw/zinc/34/44/47/1039344447.db2.gz QCJQJMZDSHLMBG-AWEZNQCLSA-N 2 0 341.480 4.036 20 0 EIADRP C[C@H](CC(F)(F)F)[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000552280652 1039358257 /nfs/dbraw/zinc/35/82/57/1039358257.db2.gz ORKYQNPLWOJHAU-ODIFPOPNSA-N 2 0 328.422 4.360 20 0 EIADRP C[N@@H+]1CCC[C@]2(CC[NH+](CCCOc3cccc4ccccc43)C2)C1 ZINC000555598029 1039423463 /nfs/dbraw/zinc/42/34/63/1039423463.db2.gz MTZRHORSVDBKEY-QFIPXVFZSA-N 2 0 338.495 4.026 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@H]2[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000121892967 1039526531 /nfs/dbraw/zinc/52/65/31/1039526531.db2.gz MIZZYFSLPUJHNR-OXQOHEQNSA-N 2 0 328.500 4.098 20 0 EIADRP Cc1ccnc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)c1 ZINC000514087934 1039589612 /nfs/dbraw/zinc/58/96/12/1039589612.db2.gz JHRCZCHKILILQC-MOPGFXCFSA-N 2 0 337.511 4.473 20 0 EIADRP CC[C@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1 ZINC000092856887 1039601300 /nfs/dbraw/zinc/60/13/00/1039601300.db2.gz KFLZSCURRMKWPV-FQEVSTJZSA-N 2 0 327.447 4.178 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cc3ccccc3s2)[C@@H](C)C1 ZINC000550856239 1039654572 /nfs/dbraw/zinc/65/45/72/1039654572.db2.gz ITARHSAFPBFCMO-LPHOPBHVSA-N 2 0 346.540 4.128 20 0 EIADRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc(Cl)c(Cl)c1Cl ZINC000643534419 1039714553 /nfs/dbraw/zinc/71/45/53/1039714553.db2.gz UOVYNYDQMACZFR-SKDRFNHKSA-N 2 0 333.690 4.440 20 0 EIADRP C[C@H]1C[C@H](Nc2cc[nH+]c3cc(OC(F)(F)F)ccc23)CC[N@@H+]1C ZINC000899874947 1039755191 /nfs/dbraw/zinc/75/51/91/1039755191.db2.gz QKHDSSPNTCLBMC-NWDGAFQWSA-N 2 0 339.361 4.028 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H]2CCc3c2nccc3Cl)c1 ZINC000924709682 1039857518 /nfs/dbraw/zinc/85/75/18/1039857518.db2.gz YXDDREGGXNFOAY-IBGZPJMESA-N 2 0 343.902 4.354 20 0 EIADRP CCc1ncc(C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)s1 ZINC000537659943 1039872956 /nfs/dbraw/zinc/87/29/56/1039872956.db2.gz UEOGOVRALHRFQK-INIZCTEOSA-N 2 0 335.561 4.182 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H](C)c1ccc(SCC(F)(F)F)cc1 ZINC000481959269 1039911143 /nfs/dbraw/zinc/91/11/43/1039911143.db2.gz LGFASBVGDLLKOE-OLZOCXBDSA-N 2 0 334.451 4.332 20 0 EIADRP C[C@H](Cc1ccccc1C(F)(F)F)[NH2+]C1CC([NH+]2CCCCC2)C1 ZINC000481992053 1039934927 /nfs/dbraw/zinc/93/49/27/1039934927.db2.gz NCXGELLZVLPKMP-ODIFPOPNSA-N 2 0 340.433 4.243 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](C[C@@H]2CCC(F)(F)C2)CC1 ZINC000551093867 1039977093 /nfs/dbraw/zinc/97/70/93/1039977093.db2.gz USDSVXNNNIXPEE-LJQANCHMSA-N 2 0 336.470 4.266 20 0 EIADRP CC(C)([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1C(F)(F)F ZINC001168366477 1040074389 /nfs/dbraw/zinc/07/43/89/1040074389.db2.gz UBQQAKRUXNAWPY-UHFFFAOYSA-N 2 0 340.433 4.405 20 0 EIADRP Clc1cccc(Cl)c1CCC[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000482227223 1040083293 /nfs/dbraw/zinc/08/32/93/1040083293.db2.gz CMIQXHUNSIEAQS-UHFFFAOYSA-N 2 0 341.326 4.390 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+]C1CC[NH+](C(C)(C)C)CC1 ZINC000510031681 1040124848 /nfs/dbraw/zinc/12/48/48/1040124848.db2.gz YLHRFYLIEZMGHS-SAPNQHFASA-N 2 0 330.516 4.089 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)c1 ZINC000479117829 1040151210 /nfs/dbraw/zinc/15/12/10/1040151210.db2.gz IGCXAKKVHXNFIE-HXUWFJFHSA-N 2 0 344.886 4.058 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000479406164 1040328394 /nfs/dbraw/zinc/32/83/94/1040328394.db2.gz BGQAZRGKSTTYII-OAQYLSRUSA-N 2 0 326.459 4.445 20 0 EIADRP Cc1ccccc1OCCC[NH2+]C1CC[NH+](C2CCCCC2)CC1 ZINC000482545017 1040345571 /nfs/dbraw/zinc/34/55/71/1040345571.db2.gz WJIOAVNHXGEAQF-UHFFFAOYSA-N 2 0 330.516 4.151 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)c1ccc(C2CCCCC2)cc1)N1CC[NH+](C)CC1 ZINC000482555429 1040358559 /nfs/dbraw/zinc/35/85/59/1040358559.db2.gz RCJGLSDLDBBLEY-OALUTQOASA-N 2 0 343.559 4.021 20 0 EIADRP COC1CCC(C)(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)CC1 ZINC000479447863 1040376124 /nfs/dbraw/zinc/37/61/24/1040376124.db2.gz DRMJOMMKMZWRPQ-DWOCFRCJSA-N 2 0 344.543 4.082 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000551530080 1040387656 /nfs/dbraw/zinc/38/76/56/1040387656.db2.gz NLMDRIMAVNBKAN-OBZTUIKSSA-N 2 0 332.532 4.143 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cc2c(s1)CCC2 ZINC000479467131 1040391822 /nfs/dbraw/zinc/39/18/22/1040391822.db2.gz VDPXLYFPHNQKBN-AEFFLSMTSA-N 2 0 340.536 4.410 20 0 EIADRP Oc1ccc(C2CCC([NH2+]C3CC[NH+](C4CCC4)CC3)CC2)cc1 ZINC000553663825 1040400230 /nfs/dbraw/zinc/40/02/30/1040400230.db2.gz DIVUIMKOOMOQCQ-UHFFFAOYSA-N 2 0 328.500 4.025 20 0 EIADRP CC(C)COc1ccc(C(C)(C)C[NH2+][C@@H]2CC[N@H+](C)[C@H](C)C2)cc1 ZINC000482643060 1040401841 /nfs/dbraw/zinc/40/18/41/1040401841.db2.gz ODJBWYZZBYIQOU-IEBWSBKVSA-N 2 0 332.532 4.071 20 0 EIADRP Cc1ccsc1[C@H](C)[NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000482861590 1040528981 /nfs/dbraw/zinc/52/89/81/1040528981.db2.gz CIJCILQZTJQDAN-KRWDZBQOSA-N 2 0 344.524 4.382 20 0 EIADRP C[C@H]([NH2+]CCCc1cccc(F)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000482874815 1040532905 /nfs/dbraw/zinc/53/29/05/1040532905.db2.gz PUGKDUNKZOTADZ-KRWDZBQOSA-N 2 0 344.474 4.050 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1c2ccccc2CCC[C@@H]1C ZINC000462540686 1040715320 /nfs/dbraw/zinc/71/53/20/1040715320.db2.gz UOGZTSJPLRPYJA-AOMKIAJQSA-N 2 0 346.478 4.379 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCN([C@H](C)c2cccc(Br)c2)C1 ZINC000483209514 1040769137 /nfs/dbraw/zinc/76/91/37/1040769137.db2.gz BVGDNQKOEJWQNO-CABCVRRESA-N 2 0 339.321 4.174 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(C)c(OC(F)F)c(C)c2)C[C@H]1C ZINC000539838133 1040820072 /nfs/dbraw/zinc/82/00/72/1040820072.db2.gz LAWFABGJPQUATP-NVXWUHKLSA-N 2 0 340.458 4.209 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2ccc(F)cc2C(F)(F)F)[C@@H](C)C1 ZINC000539834794 1040828915 /nfs/dbraw/zinc/82/89/15/1040828915.db2.gz FZURXILMAVCPNV-LRDDRELGSA-N 2 0 332.385 4.007 20 0 EIADRP FCCC[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000669846973 1040851389 /nfs/dbraw/zinc/85/13/89/1040851389.db2.gz UIKYOLMWUFUGSM-HKBOAZHASA-N 2 0 332.507 4.407 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CCc1ccc(Oc2ccc(F)cc2)cc1 ZINC000537938878 1040899390 /nfs/dbraw/zinc/89/93/90/1040899390.db2.gz UUEVICWWFTXIIJ-IIBYNOLFSA-N 2 0 342.458 4.090 20 0 EIADRP COc1cc(C)cc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C)c1 ZINC000537952085 1040918569 /nfs/dbraw/zinc/91/85/69/1040918569.db2.gz PJKBCEQAMVFONV-GCJKJVERSA-N 2 0 338.495 4.004 20 0 EIADRP CCN1CCC[C@H]1C[NH2+][C@@H](C)c1ccc(SCC(F)F)cc1 ZINC000480089330 1040927902 /nfs/dbraw/zinc/92/79/02/1040927902.db2.gz HFZBJLNIILNJHZ-ZFWWWQNUSA-N 2 0 328.472 4.179 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000462796985 1040951468 /nfs/dbraw/zinc/95/14/68/1040951468.db2.gz ALEGNUVKWCEITL-VLCRHTCISA-N 2 0 344.543 4.212 20 0 EIADRP FC(F)(F)C1CCC([NH2+]C[C@@H]2CCC[N@@H+]2C2CCCCC2)CC1 ZINC000436294413 1041060865 /nfs/dbraw/zinc/06/08/65/1041060865.db2.gz ORBPGJCXCTWBLN-DQPZFDDXSA-N 2 0 332.454 4.494 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+][C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)[C@@H](C)C1 ZINC000436317364 1041085840 /nfs/dbraw/zinc/08/58/40/1041085840.db2.gz UZEUBPKAFHZRKB-QXRTWZOPSA-N 2 0 340.433 4.271 20 0 EIADRP C[C@H]([NH2+][C@H](c1cccs1)C1CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000480274216 1041152246 /nfs/dbraw/zinc/15/22/46/1041152246.db2.gz MJNBBJHFPRIZTM-YWZLYKJASA-N 2 0 344.524 4.490 20 0 EIADRP C[C@H](CCc1ccco1)[NH2+]CC[C@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1 ZINC000540141003 1041155568 /nfs/dbraw/zinc/15/55/68/1041155568.db2.gz VIKRDUYHGRUDGB-DYXWJJEUSA-N 2 0 340.511 4.491 20 0 EIADRP Cc1ccccc1O[C@@H]1CCCC[C@@H]1[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000538193727 1041161596 /nfs/dbraw/zinc/16/15/96/1041161596.db2.gz CDXDNKAIVPTZQF-RBBKRZOGSA-N 2 0 342.527 4.149 20 0 EIADRP CC[C@@H]([NH2+]CC1(CC)CC[NH+](Cc2ccccc2)CC1)[C@H]1CCOC1 ZINC000540143265 1041164836 /nfs/dbraw/zinc/16/48/36/1041164836.db2.gz OEAZXJIIGDBTEB-LEWJYISDSA-N 2 0 344.543 4.084 20 0 EIADRP COc1ccc(OC)c([C@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)c1 ZINC000484293286 1041194706 /nfs/dbraw/zinc/19/47/06/1041194706.db2.gz KMLSRIRDSSVOCK-KRWDZBQOSA-N 2 0 348.531 4.113 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@H](C)c1cccc(Cl)c1Cl ZINC000484292344 1041194860 /nfs/dbraw/zinc/19/48/60/1041194860.db2.gz CVCIYOQSEOWRJX-CHWSQXEVSA-N 2 0 333.303 4.001 20 0 EIADRP COc1ccc(OC)c([C@@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)c1 ZINC000484293287 1041196264 /nfs/dbraw/zinc/19/62/64/1041196264.db2.gz KMLSRIRDSSVOCK-QGZVFWFLSA-N 2 0 348.531 4.113 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cccc(Cl)c1Cl ZINC000484292352 1041197911 /nfs/dbraw/zinc/19/79/11/1041197911.db2.gz CVCIYOQSEOWRJX-STQMWFEESA-N 2 0 333.303 4.001 20 0 EIADRP CCC[C@H](Cc1ccccc1)[NH2+]CC1(N2CCCCC2)CCOCC1 ZINC000540170078 1041212462 /nfs/dbraw/zinc/21/24/62/1041212462.db2.gz YPCJTHBRBQKVHN-OAQYLSRUSA-N 2 0 344.543 4.023 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cccc2ccccc21 ZINC000540169046 1041212787 /nfs/dbraw/zinc/21/27/87/1041212787.db2.gz JJQUMKAGIHPQNS-GUDVDZBRSA-N 2 0 340.511 4.380 20 0 EIADRP CC[NH+](CC)[C@H]1CCN(c2cc(C)[nH+]c3ccc(OC(F)F)cc32)C1 ZINC000463011706 1041218296 /nfs/dbraw/zinc/21/82/96/1041218296.db2.gz OHPDQWORGNFBBG-AWEZNQCLSA-N 2 0 349.425 4.065 20 0 EIADRP CSc1ccccc1[C@@H](C)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000194892408 1041278880 /nfs/dbraw/zinc/27/88/80/1041278880.db2.gz GPROTJUGOILSIT-CQSZACIVSA-N 2 0 332.488 4.460 20 0 EIADRP CCCOc1ccc([C@@H](C)[NH2+]CC2=CC[N@H+](C)CC2)c(OCCC)c1 ZINC000538405792 1041301924 /nfs/dbraw/zinc/30/19/24/1041301924.db2.gz FDYWVCQGDGOCJS-QGZVFWFLSA-N 2 0 346.515 4.177 20 0 EIADRP CCCOc1ccc([C@H](C)[NH2+]CC2=CC[N@H+](C)CC2)c(OCCC)c1 ZINC000538405791 1041302553 /nfs/dbraw/zinc/30/25/53/1041302553.db2.gz FDYWVCQGDGOCJS-KRWDZBQOSA-N 2 0 346.515 4.177 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2cc3cccc(OC)c3o2)CC1 ZINC000538395357 1041314414 /nfs/dbraw/zinc/31/44/14/1041314414.db2.gz LQMINTDAXAHCPZ-HNNXBMFYSA-N 2 0 330.472 4.214 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C(C)C)C1 ZINC000540261238 1041328309 /nfs/dbraw/zinc/32/83/09/1041328309.db2.gz XIANTHRQDXOUMZ-WMLDXEAASA-N 2 0 328.422 4.334 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1C[C@H]1c1ccccc1 ZINC000463162024 1041378354 /nfs/dbraw/zinc/37/83/54/1041378354.db2.gz JZSOVVDYWQIKTR-VXKWHMMOSA-N 2 0 335.495 4.176 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+]CC[C@H]2CCC[N@@H+]2C)cc1OC ZINC000540377594 1041428071 /nfs/dbraw/zinc/42/80/71/1041428071.db2.gz QHYHLNPFPKZLNH-SJLPKXTDSA-N 2 0 334.504 4.009 20 0 EIADRP CC[NH+]1CCC([NH2+]CCc2csc(-c3ccc(Cl)cc3)n2)CC1 ZINC000540399448 1041432170 /nfs/dbraw/zinc/43/21/70/1041432170.db2.gz YCZIKIWUVQQVRX-UHFFFAOYSA-N 2 0 349.931 4.080 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(F)cc1N(C)C ZINC000480634112 1041447343 /nfs/dbraw/zinc/44/73/43/1041447343.db2.gz ZMQNUJHQHXWMSA-IAGOWNOFSA-N 2 0 335.511 4.054 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1Nc1ccc2c(c1)nc(C(C)(C)C)n2C ZINC000538627236 1041458950 /nfs/dbraw/zinc/45/89/50/1041458950.db2.gz CQXJSYYYIJEEAP-IIAWOOMASA-N 2 0 328.504 4.011 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2(Cc3ccccc3)CC2)CC1 ZINC000480689175 1041473457 /nfs/dbraw/zinc/47/34/57/1041473457.db2.gz MBMGMIIJJJBMKF-WIYYLYMNSA-N 2 0 326.528 4.394 20 0 EIADRP Fc1ccc([C@H]([NH2+]CCCNc2ccccn2)c2ccccc2)cc1 ZINC000480722864 1041489155 /nfs/dbraw/zinc/48/91/55/1041489155.db2.gz KYCWXRYUQPNPBD-OAQYLSRUSA-N 2 0 335.426 4.402 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)[C@H]1CCOC1 ZINC000480732586 1041496007 /nfs/dbraw/zinc/49/60/07/1041496007.db2.gz ZFZAYCFHVHXCDI-UBBRYJJRSA-N 2 0 344.543 4.069 20 0 EIADRP CC(C)CC1(C[NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)CC1 ZINC000540493332 1041497489 /nfs/dbraw/zinc/49/74/89/1041497489.db2.gz ZONZMOLTWAITBR-IBGZPJMESA-N 2 0 342.527 4.391 20 0 EIADRP C[C@@H]([NH2+]Cc1cc2c(s1)CC[NH2+]C2)c1csc2ccccc12 ZINC000904482303 1041501943 /nfs/dbraw/zinc/50/19/43/1041501943.db2.gz AESIBNCDVXROCD-GFCCVEGCSA-N 2 0 328.506 4.459 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2c(OC)ccc3ccccc32)[C@H](C)C1 ZINC000538738761 1041513135 /nfs/dbraw/zinc/51/31/35/1041513135.db2.gz XOMNFXNLWGXCPN-UZLBHIALSA-N 2 0 326.484 4.011 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCCC1)c1nc2c(s1)CCCC2 ZINC000538985195 1041602124 /nfs/dbraw/zinc/60/21/24/1041602124.db2.gz VSPDVMAITAPJMW-MRXNPFEDSA-N 2 0 335.561 4.329 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CC1 ZINC000540708629 1041606675 /nfs/dbraw/zinc/60/66/75/1041606675.db2.gz ZMGCHYBLRFFWJO-ZWKOTPCHSA-N 2 0 338.417 4.193 20 0 EIADRP COc1ccc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c(C)c1 ZINC000540962865 1041754232 /nfs/dbraw/zinc/75/42/32/1041754232.db2.gz XRCHRDRUYPJUDB-RXVVDRJESA-N 2 0 338.495 4.004 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC[C@H]([C@H]3CCOC3)C2)c1 ZINC000464069680 1041854194 /nfs/dbraw/zinc/85/41/94/1041854194.db2.gz FGTNTOHZIQVIRM-FDFHNCONSA-N 2 0 344.543 4.212 20 0 EIADRP C[C@H](Cc1ccsc1)[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000541234373 1041859766 /nfs/dbraw/zinc/85/97/66/1041859766.db2.gz DXGODMGBKMCXES-YLJYHZDGSA-N 2 0 328.525 4.133 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2cccc(OC)c2OC)CC1 ZINC000541245680 1041867559 /nfs/dbraw/zinc/86/75/59/1041867559.db2.gz FMVAKYKBOBNWEK-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000425940901 1042017793 /nfs/dbraw/zinc/01/77/93/1042017793.db2.gz IMTSLCUOQVCUBP-CHWSQXEVSA-N 2 0 335.492 4.106 20 0 EIADRP C[C@H](Cc1cccc(C(F)(F)F)c1)[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC000467365299 1042021331 /nfs/dbraw/zinc/02/13/31/1042021331.db2.gz PDSUALYQBJGFJS-COXVUDFISA-N 2 0 328.422 4.099 20 0 EIADRP C[C@H](NCc1cccc(OC(C)(C)C)n1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000541603187 1042038263 /nfs/dbraw/zinc/03/82/63/1042038263.db2.gz ORGLHWFQCXOBAK-IRXDYDNUSA-N 2 0 345.531 4.002 20 0 EIADRP C[N@@H+](Cc1cc(Cl)cc(C(F)(F)F)c1)CC1CC[NH+](C)CC1 ZINC000438112692 1042054873 /nfs/dbraw/zinc/05/48/73/1042054873.db2.gz BWMTZYANDCSPAT-UHFFFAOYSA-N 2 0 334.813 4.132 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@@H](C)[NH2+]C[C@@H](C)C[NH+](C)C ZINC000425951438 1042067847 /nfs/dbraw/zinc/06/78/47/1042067847.db2.gz MQKMNCBRCRUQQP-HUUCEWRRSA-N 2 0 331.529 4.275 20 0 EIADRP C[C@@]1(c2ccccc2)CC[C@@H]([NH2+]C2CC[NH+](C3CCCC3)CC2)C1 ZINC000438192916 1042084301 /nfs/dbraw/zinc/08/43/01/1042084301.db2.gz RQNMERPIXNAZLH-IFMALSPDSA-N 2 0 326.528 4.493 20 0 EIADRP Cc1ccc2cc(C[NH2+]CCCCC[NH+]3CCCCC3)ccc2n1 ZINC000438195436 1042084585 /nfs/dbraw/zinc/08/45/85/1042084585.db2.gz AJNPOCCSLFGMHF-UHFFFAOYSA-N 2 0 325.500 4.289 20 0 EIADRP C[C@H](c1ccc(F)cc1)[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464832151 1042188978 /nfs/dbraw/zinc/18/89/78/1042188978.db2.gz BVJFWQIOWBYLJM-MJGOQNOKSA-N 2 0 326.459 4.341 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2c[nH]nc2C(C)(C)C)CC1 ZINC000542176720 1042328029 /nfs/dbraw/zinc/32/80/29/1042328029.db2.gz IXMLBBWYDUUVOE-UHFFFAOYSA-N 2 0 334.552 4.041 20 0 EIADRP COc1ccc(Oc2ccc(C[NH2+][C@@H]3CC[N@H+](C)[C@@H](C)C3)cc2)cc1 ZINC000542322935 1042388276 /nfs/dbraw/zinc/38/82/76/1042388276.db2.gz NGRSGYTZFYGJTN-FUHWJXTLSA-N 2 0 340.467 4.060 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]C1CC(C)(C)[NH2+]C(C)(C)C1)CC3 ZINC000491354502 1042431129 /nfs/dbraw/zinc/43/11/29/1042431129.db2.gz BXRHXOXPCPPIJS-HNNXBMFYSA-N 2 0 339.527 4.232 20 0 EIADRP COc1ccc2cc(C[NH2+]CCCC[N@@H+]3CCC[C@@H](C)C3)ccc2c1 ZINC000518268147 1042442248 /nfs/dbraw/zinc/44/22/48/1042442248.db2.gz YYNYCYQOIQAUGO-GOSISDBHSA-N 2 0 340.511 4.450 20 0 EIADRP C[C@@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CCC[C@@H]1CCC[NH2+]1 ZINC000414972326 1042443727 /nfs/dbraw/zinc/44/37/27/1042443727.db2.gz XPHCJSLIHZKEHY-WMLDXEAASA-N 2 0 328.422 4.148 20 0 EIADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]CC1CC[NH+](CCC(C)C)CC1 ZINC000491872510 1042510028 /nfs/dbraw/zinc/51/00/28/1042510028.db2.gz POJRRQJKEHLWNZ-GHTZIAJQSA-N 2 0 332.532 4.110 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000414996490 1042600164 /nfs/dbraw/zinc/60/01/64/1042600164.db2.gz GJZQXNQIYDXKJF-MGPUTAFESA-N 2 0 344.449 4.204 20 0 EIADRP C[C@H]([NH2+]CCOC1CCCCCC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492398271 1042633618 /nfs/dbraw/zinc/63/36/18/1042633618.db2.gz GVDWKSMOSKSGOY-PZJWPPBQSA-N 2 0 344.543 4.226 20 0 EIADRP C/C(=C\c1ccccc1)C[N@@H+](C)Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000426391109 1042637633 /nfs/dbraw/zinc/63/76/33/1042637633.db2.gz OCPUZOCUSHAOJD-GHRIWEEISA-N 2 0 332.451 4.111 20 0 EIADRP c1csc(C[N@H+]2CCC[C@H](CNc3cc[nH+]c4ccccc34)C2)c1 ZINC000518893856 1042742610 /nfs/dbraw/zinc/74/26/10/1042742610.db2.gz ILTDTPPHBCAOLA-MRXNPFEDSA-N 2 0 337.492 4.042 20 0 EIADRP c1ccc(OCCC[NH+]2CCC(C[NH+]3CCCCCC3)CC2)cc1 ZINC000058470799 1042799039 /nfs/dbraw/zinc/79/90/39/1042799039.db2.gz YQHCPVHSYCRSSF-UHFFFAOYSA-N 2 0 330.516 4.044 20 0 EIADRP C[C@H](C[NH2+][C@H]1CCN(C2CC2)[C@@H](c2ccccc2)C1)c1nccs1 ZINC000639046975 1042819607 /nfs/dbraw/zinc/81/96/07/1042819607.db2.gz YNXSJFAYBXCQKZ-HHXXYDBFSA-N 2 0 341.524 4.204 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(F)c1 ZINC000310099002 1042828005 /nfs/dbraw/zinc/82/80/05/1042828005.db2.gz WRNMJHGYJZREEX-RXVVDRJESA-N 2 0 326.459 4.389 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@H](C)c2cccc(OC)c2)c1 ZINC000177227908 1042831471 /nfs/dbraw/zinc/83/14/71/1042831471.db2.gz VWZYQCLMBDPHOP-QGZVFWFLSA-N 2 0 326.484 4.388 20 0 EIADRP COc1cccc([C@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c1 ZINC000177270919 1042832873 /nfs/dbraw/zinc/83/28/73/1042832873.db2.gz CIUAOUBLCLUEOP-INIZCTEOSA-N 2 0 344.524 4.320 20 0 EIADRP Cc1cc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1F ZINC000310522232 1042839353 /nfs/dbraw/zinc/83/93/53/1042839353.db2.gz NVJWGIYVOVMALP-YLJYHZDGSA-N 2 0 326.459 4.134 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)[C@@H](C)C2 ZINC000493206338 1042843413 /nfs/dbraw/zinc/84/34/13/1042843413.db2.gz QIQZHFIGICTPRM-BTYIYWSLSA-N 2 0 326.459 4.219 20 0 EIADRP FC1(F)CCC[C@H](C[NH2+][C@@H]2CC[C@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)C1 ZINC000311007381 1042849890 /nfs/dbraw/zinc/84/98/90/1042849890.db2.gz WOYAWOMPCPZDHJ-LWYYNNOASA-N 2 0 348.481 4.312 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2cc[nH]c21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311064202 1042852223 /nfs/dbraw/zinc/85/22/23/1042852223.db2.gz JCQRFOBBWYZVPE-UTKZUKDTSA-N 2 0 333.479 4.168 20 0 EIADRP C[C@@H]([NH2+]Cc1coc2ccccc12)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311129922 1042853904 /nfs/dbraw/zinc/85/39/04/1042853904.db2.gz WJBKMGOAOKRSBJ-IEBWSBKVSA-N 2 0 334.463 4.433 20 0 EIADRP CCCOc1cccc(C[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000311221587 1042855383 /nfs/dbraw/zinc/85/53/83/1042855383.db2.gz VGIXUEVRUDCTMN-NRFANRHFSA-N 2 0 338.495 4.087 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc2ccccc2n1 ZINC000178106401 1042858750 /nfs/dbraw/zinc/85/87/50/1042858750.db2.gz SLOIYUYIWWYOOE-GOSISDBHSA-N 2 0 325.500 4.398 20 0 EIADRP c1cc(C[NH+]2CCCCC2)ccc1C[N@@H+]1CCC[C@H]1[C@@H]1CCCOC1 ZINC000520575621 1042899425 /nfs/dbraw/zinc/89/94/25/1042899425.db2.gz WNIPTQWPYKYQRX-YADHBBJMSA-N 2 0 342.527 4.064 20 0 EIADRP CC(C)[NH2+]C1CCN([C@@H](C)c2ccc(OC(F)(F)F)cc2)CC1 ZINC000170986838 1042910616 /nfs/dbraw/zinc/91/06/16/1042910616.db2.gz NLAVZDPWLUCMPR-ZDUSSCGKSA-N 2 0 330.394 4.109 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCOc2ccccc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168005136 1042954734 /nfs/dbraw/zinc/95/47/34/1042954734.db2.gz GPFVXYLRLKNPMK-CEQLMSFQSA-N 2 0 338.495 4.097 20 0 EIADRP CC[C@@H]1C[C@H](C[NH+]2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)CCO1 ZINC000507791857 1042974262 /nfs/dbraw/zinc/97/42/62/1042974262.db2.gz DEELGINHOSLZLF-HMXCVIKNSA-N 2 0 336.564 4.168 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)[C@@H](OC)c2ccccc2)c1 ZINC000493905182 1042974606 /nfs/dbraw/zinc/97/46/06/1042974606.db2.gz HBVMIRPPKPMYKF-LAUBAEHRSA-N 2 0 326.484 4.004 20 0 EIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000493937911 1042987928 /nfs/dbraw/zinc/98/79/28/1042987928.db2.gz UNDHOMVZOSWUOA-GCJKJVERSA-N 2 0 338.495 4.148 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C2Cc3ccccc3C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168006363 1043000095 /nfs/dbraw/zinc/00/00/95/1043000095.db2.gz NONMJRSHUDZXQQ-OPMZPASUSA-N 2 0 334.507 4.185 20 0 EIADRP CC[NH+]1CCC(CC2CC[NH+](Cc3ccccc3OC)CC2)CC1 ZINC001203438549 1043017703 /nfs/dbraw/zinc/01/77/03/1043017703.db2.gz JUVHXSOGTYNVGB-UHFFFAOYSA-N 2 0 330.516 4.029 20 0 EIADRP Cc1nc2ccc(C[NH2+]C[C@@H]3CCC[N@@H+](CC(C)C)C3)cc2s1 ZINC000494170650 1043025623 /nfs/dbraw/zinc/02/56/23/1043025623.db2.gz FITQWQQODNXEGF-KRWDZBQOSA-N 2 0 331.529 4.062 20 0 EIADRP CC[C@@H]1C[C@H](C[N@H+](C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)CCO1 ZINC000507813142 1043056840 /nfs/dbraw/zinc/05/68/40/1043056840.db2.gz JDTJNAOBNBVIIP-BDKRGJGYSA-N 2 0 344.543 4.177 20 0 EIADRP CC[C@@H]1C[C@H](C[N@H+](C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)CCO1 ZINC000507813147 1043057473 /nfs/dbraw/zinc/05/74/73/1043057473.db2.gz JDTJNAOBNBVIIP-ZHHKINOHSA-N 2 0 344.543 4.177 20 0 EIADRP Cc1cncc([C@@H](C)[NH2+]Cc2ccccc2C[NH+]2CCC(C)CC2)c1 ZINC000184280278 1043086246 /nfs/dbraw/zinc/08/62/46/1043086246.db2.gz JWXLXLQZJULKQX-LJQANCHMSA-N 2 0 337.511 4.473 20 0 EIADRP C[C@@H]1CC([NH2+]Cc2ccc(F)cc2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168008874 1043087630 /nfs/dbraw/zinc/08/76/30/1043087630.db2.gz YFHVVSLUQIPRRO-IAGOWNOFSA-N 2 0 326.459 4.357 20 0 EIADRP CC(C)Oc1ccc(CC[C@@H](C)[NH2+][C@@H](C)C2CC[NH+](C)CC2)cc1 ZINC000166012200 1043267835 /nfs/dbraw/zinc/26/78/35/1043267835.db2.gz RKZXZLUUSNSDPO-MSOLQXFVSA-N 2 0 332.532 4.115 20 0 EIADRP c1c[nH]c([C@H]2CCC[NH+]2CCCCC[N@@H+]2CCC[C@@H]2c2ccc[nH]2)c1 ZINC000077266677 1043272461 /nfs/dbraw/zinc/27/24/61/1043272461.db2.gz GYDGRFNBCFSBRP-NHCUHLMSSA-N 2 0 340.515 4.487 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](CCc2cccs2)CC1 ZINC000727759006 1043284483 /nfs/dbraw/zinc/28/44/83/1043284483.db2.gz LZRNUVXORPRGSV-UHFFFAOYSA-N 2 0 328.525 4.135 20 0 EIADRP CC[NH+](CC)CCC[NH+]1CCC(c2c[nH]c3ccc(OC)cc32)CC1 ZINC000508178382 1043303269 /nfs/dbraw/zinc/30/32/69/1043303269.db2.gz GDUKGROJKNMROR-UHFFFAOYSA-N 2 0 343.515 4.088 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(-c2nc3ccccc3[nH]2)cc1)C1CC[NH+](C)CC1 ZINC000167576499 1043365706 /nfs/dbraw/zinc/36/57/06/1043365706.db2.gz GCSYPGZJZGSLLQ-INIZCTEOSA-N 2 0 348.494 4.050 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+][C@@H]2CCc3cc(N)ccc32)CC1 ZINC000665270988 1043458624 /nfs/dbraw/zinc/45/86/24/1043458624.db2.gz DVDQJNOFZCGRAK-YDPRHXJPSA-N 2 0 349.522 4.289 20 0 EIADRP [NH3+]CC1CCC([NH2+]C(CCC(F)(F)F)CCC(F)(F)F)CC1 ZINC000665272813 1043495126 /nfs/dbraw/zinc/49/51/26/1043495126.db2.gz LUCWIHZYZGZCRB-UHFFFAOYSA-N 2 0 334.348 4.147 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccnn1-c1ccccc1 ZINC000467363820 1043577636 /nfs/dbraw/zinc/57/76/36/1043577636.db2.gz GBQFDCAWLNURDZ-RTBURBONSA-N 2 0 340.515 4.035 20 0 EIADRP c1ccc([C@@H](CC2CC2)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658067766 1043731859 /nfs/dbraw/zinc/73/18/59/1043731859.db2.gz QGWCYRVYHFCAFN-JOCHJYFZSA-N 2 0 342.527 4.008 20 0 EIADRP COCCCCC[NH2+][C@@H]1CCCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000521477541 1043786923 /nfs/dbraw/zinc/78/69/23/1043786923.db2.gz RLFSCTLNDBHCCU-YPAWHYETSA-N 2 0 344.543 4.084 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CCc2ccccc21 ZINC000682076071 1043803219 /nfs/dbraw/zinc/80/32/19/1043803219.db2.gz JPVHBZXIFBBPNS-QFIPXVFZSA-N 2 0 335.495 4.307 20 0 EIADRP Cc1c([C@H](C)[NH2+]CCCCC[NH+]2CCCCC2)cnn1C(C)(C)C ZINC000191285736 1043804813 /nfs/dbraw/zinc/80/48/13/1043804813.db2.gz VIXJCXYODMEWHJ-KRWDZBQOSA-N 2 0 334.552 4.253 20 0 EIADRP CC(C)(C[NH2+][C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000191550227 1043825895 /nfs/dbraw/zinc/82/58/95/1043825895.db2.gz VFIVEOUOCMHTAC-IAGOWNOFSA-N 2 0 340.433 4.199 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2Cc3[nH]c4ccccc4c3C2)c1 ZINC000442773801 1043830894 /nfs/dbraw/zinc/83/08/94/1043830894.db2.gz DBJRVCXUTIOIOU-LJQANCHMSA-N 2 0 347.506 4.265 20 0 EIADRP CO[C@@H](c1ccccc1)[C@H](C)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000494592882 1043835550 /nfs/dbraw/zinc/83/55/50/1043835550.db2.gz VGOIGLAGBKSVCT-FTWXPCQCSA-N 2 0 344.543 4.395 20 0 EIADRP CS[C@H](C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)C(C)(C)C ZINC000542497581 1044145561 /nfs/dbraw/zinc/14/55/61/1044145561.db2.gz ABGZKNPAUDAPOY-MAUKXSAKSA-N 2 0 338.561 4.055 20 0 EIADRP CS[C@H](C[NH2+][C@H](C)c1cccc(OCC[NH+](C)C)c1)C(C)(C)C ZINC000542497576 1044145910 /nfs/dbraw/zinc/14/59/10/1044145910.db2.gz ABGZKNPAUDAPOY-CRAIPNDOSA-N 2 0 338.561 4.055 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cc(Cl)ccc1O ZINC000186518100 1044165006 /nfs/dbraw/zinc/16/50/06/1044165006.db2.gz IGAVCYDGDUFXDE-SOUVJXGZSA-N 2 0 336.907 4.349 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH+]1CCC(CC[NH+](C)C)CC1 ZINC000443414264 1044264703 /nfs/dbraw/zinc/26/47/03/1044264703.db2.gz BXVIZVVXUBRJDY-UHFFFAOYSA-N 2 0 328.422 4.178 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCCC[C@@H]1[C@H]1CCOC1 ZINC000474046373 1044284879 /nfs/dbraw/zinc/28/48/79/1044284879.db2.gz NDVFJQFHLMFXCK-BHDDXSALSA-N 2 0 344.543 4.213 20 0 EIADRP C[C@H]1CC([NH2+]CC2(c3ccccn3)CC2)C[C@H](C)[NH+]1Cc1ccccc1 ZINC001168017572 1044310506 /nfs/dbraw/zinc/31/05/06/1044310506.db2.gz BDQWSGDSSPVRDP-OALUTQOASA-N 2 0 349.522 4.144 20 0 EIADRP Clc1cccc2c1C[C@@H]([NH2+]C1CC[NH+](C[C@@H]3CC=CCC3)CC1)C2 ZINC001168719142 1044410254 /nfs/dbraw/zinc/41/02/54/1044410254.db2.gz UYAWVCYYPGIPQX-APWZRJJASA-N 2 0 344.930 4.218 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@H]2CCSc3c(F)cccc32)c1 ZINC000177733522 1044450909 /nfs/dbraw/zinc/45/09/09/1044450909.db2.gz CLCKJWIABXLRHZ-SFHVURJKSA-N 2 0 330.472 4.214 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2CCCc3c4ccccc4[nH]c32)C1 ZINC000675728295 1044460344 /nfs/dbraw/zinc/46/03/44/1044460344.db2.gz FVLGTTIIQYEYGU-UZLBHIALSA-N 2 0 325.500 4.255 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](CCCc3ccc(C(F)(F)F)cc3)CC[C@H]21 ZINC000675897597 1044542994 /nfs/dbraw/zinc/54/29/94/1044542994.db2.gz HEQAPAHQZUHIOA-FUHWJXTLSA-N 2 0 340.433 4.054 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CC[C@H](c2cc(C)cc(C)c2)C1 ZINC000543412782 1044555990 /nfs/dbraw/zinc/55/59/90/1044555990.db2.gz OAVUYJDJTGYWTG-IBGZPJMESA-N 2 0 346.478 4.182 20 0 EIADRP C[C@@H](CC[NH2+][C@@H](C)c1ccc(OC(F)F)cc1)[NH+]1CCCCC1 ZINC000543417862 1044560756 /nfs/dbraw/zinc/56/07/56/1044560756.db2.gz FZHYGVRDAUYLEX-GJZGRUSLSA-N 2 0 326.431 4.203 20 0 EIADRP c1ccc(C[C@@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)C2CCCCC2)cc1 ZINC000480753802 1044582381 /nfs/dbraw/zinc/58/23/81/1044582381.db2.gz BUMSKTPRWUPYRM-SIKLNZKXSA-N 2 0 326.528 4.252 20 0 EIADRP CCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccc(C(F)(F)F)cc2C)C1 ZINC000443644183 1044598725 /nfs/dbraw/zinc/59/87/25/1044598725.db2.gz UGHNSSSAVHEWRQ-HNNXBMFYSA-N 2 0 328.422 4.178 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2C)C[C@H]1C ZINC000443650241 1044622333 /nfs/dbraw/zinc/62/23/33/1044622333.db2.gz CNRDIWCSZUYYLO-PBHICJAKSA-N 2 0 328.422 4.318 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2C)[C@@H](C)C1 ZINC000443658961 1044648196 /nfs/dbraw/zinc/64/81/96/1044648196.db2.gz OMWAELMAUFEAQA-WMLDXEAASA-N 2 0 328.422 4.176 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCCCCCCCO)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168025232 1044654525 /nfs/dbraw/zinc/65/45/25/1044654525.db2.gz JDLUSJOKYAPGPY-VTYHHJSWSA-N 2 0 346.559 4.351 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@H]1CCc2ccc(C(C)C)cc21 ZINC000495145249 1044720944 /nfs/dbraw/zinc/72/09/44/1044720944.db2.gz FHMFFUPJDIMIMF-QFIPXVFZSA-N 2 0 346.478 4.476 20 0 EIADRP C/C(=C/c1cccc(C(F)(F)F)c1)C[NH2+]CCCCn1ccnc1 ZINC000673600664 1044860117 /nfs/dbraw/zinc/86/01/17/1044860117.db2.gz GAFMGZSUFQACPA-PTNGSMBKSA-N 2 0 337.389 4.375 20 0 EIADRP FC1(F)CCC[NH+](CCCCC[N@H+]2CCCC(F)(F)CC2)CC1 ZINC000625769167 1044867227 /nfs/dbraw/zinc/86/72/27/1044867227.db2.gz DDSCLBWNQNSESE-UHFFFAOYSA-N 2 0 338.433 4.399 20 0 EIADRP CCC1(C[NH2+]C2C[C@@H](C)[NH+](Cc3ccccc3)[C@H](C)C2)CCOCC1 ZINC001168033994 1044910067 /nfs/dbraw/zinc/91/00/67/1044910067.db2.gz NWDXGNVTQIETQG-RTBURBONSA-N 2 0 344.543 4.224 20 0 EIADRP Fc1ccccc1C[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccccc1 ZINC000191693382 1044915934 /nfs/dbraw/zinc/91/59/34/1044915934.db2.gz QZVQIMHCSYXDAF-JTSKRJEESA-N 2 0 338.470 4.183 20 0 EIADRP C[NH+]1CCC(C2CC[NH+](Cc3coc4ccc(F)cc34)CC2)CC1 ZINC001141853012 1044975798 /nfs/dbraw/zinc/97/57/98/1044975798.db2.gz ZEHDCUURFRZWHE-UHFFFAOYSA-N 2 0 330.447 4.126 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2cnc(-c3ccccc3)s2)CC1 ZINC000922846707 1044994724 /nfs/dbraw/zinc/99/47/24/1044994724.db2.gz GJRFCJODAGMFIP-UHFFFAOYSA-N 2 0 341.524 4.307 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cn2ccc(-c3ccsc3)n2)CC1 ZINC000738067225 1045033754 /nfs/dbraw/zinc/03/37/54/1045033754.db2.gz IIFGKFNWMPYSLJ-UHFFFAOYSA-N 2 0 346.544 4.013 20 0 EIADRP Cc1ncc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000179136490 1045044497 /nfs/dbraw/zinc/04/44/97/1045044497.db2.gz XWYFLCDQEMRICG-HNNXBMFYSA-N 2 0 329.513 4.014 20 0 EIADRP COC1(C[C@H](C)[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)CCC1 ZINC000429402541 1045082986 /nfs/dbraw/zinc/08/29/86/1045082986.db2.gz IZBZQAHCIDPFQL-QRVBRYPASA-N 2 0 344.543 4.080 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@H]2CCCNc3ccccc32)C1 ZINC000347919704 1045098974 /nfs/dbraw/zinc/09/89/74/1045098974.db2.gz KIPXHLLYKJFQPS-OPYAIIAOSA-N 2 0 329.532 4.281 20 0 EIADRP Cc1nc([C@H](C)[N@@H+]2CC[C@H](C[NH3+])[C@H](C)C2)oc1-c1ccc(Cl)cc1 ZINC000923494883 1045134934 /nfs/dbraw/zinc/13/49/34/1045134934.db2.gz PYRMSXMOXSPFOQ-IVMMDQJWSA-N 2 0 347.890 4.281 20 0 EIADRP CC[N@@H+]1CC[C@H](N[C@H]2CCOc3c(Cl)c(Cl)ccc32)[C@@H](C)C1 ZINC000766259413 1045250783 /nfs/dbraw/zinc/25/07/83/1045250783.db2.gz YLSAAUYOGXAUSR-CQDKDKBSSA-N 2 0 343.298 4.137 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccc(F)cc1 ZINC000495764237 1045329292 /nfs/dbraw/zinc/32/92/92/1045329292.db2.gz IGFLBRSSKAMLMC-OAHLLOKOSA-N 2 0 332.488 4.450 20 0 EIADRP Cc1cc(F)ccc1-c1ccc(C[NH2+]CCC2CC[NH+](C)CC2)o1 ZINC000237158029 1045377035 /nfs/dbraw/zinc/37/70/35/1045377035.db2.gz PBWCWKKVDJENTA-UHFFFAOYSA-N 2 0 330.447 4.216 20 0 EIADRP CCCCCCOc1ccc(C[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000915681646 1045446566 /nfs/dbraw/zinc/44/65/66/1045446566.db2.gz FMOHFPITTWQQBT-WOJBJXKFSA-N 2 0 330.516 4.362 20 0 EIADRP C[C@H](Cc1cccc(F)c1)[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001168498141 1045454801 /nfs/dbraw/zinc/45/48/01/1045454801.db2.gz QTXMWMNPGDULOT-NQIIRXRSSA-N 2 0 340.486 4.211 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccc2c(c1)CCCO2 ZINC000768101095 1045715447 /nfs/dbraw/zinc/71/54/47/1045715447.db2.gz HISCZRPDWNOOSY-FXAWDEMLSA-N 2 0 330.516 4.173 20 0 EIADRP COc1ccc(Cl)cc1C[N@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC000768207020 1045743055 /nfs/dbraw/zinc/74/30/55/1045743055.db2.gz NZDNYJHZSPJBJJ-UHFFFAOYSA-N 2 0 332.875 4.042 20 0 EIADRP CC[C@@H]1C[C@@H]([N@H+](Cc2ccccc2C)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170188950 1045920847 /nfs/dbraw/zinc/92/08/47/1045920847.db2.gz ABUPYMWCKAGVFT-XSDIEEQYSA-N 2 0 330.516 4.025 20 0 EIADRP FC1(F)CCCC[C@@H]1C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC001170206010 1045926641 /nfs/dbraw/zinc/92/66/41/1045926641.db2.gz QGMUZIFQPJXYFS-UXHICEINSA-N 2 0 348.481 4.410 20 0 EIADRP C[C@H](Cc1ccccc1Cl)[NH2+]CC1CC[NH+](CC2CCC2)CC1 ZINC001170261277 1045959072 /nfs/dbraw/zinc/95/90/72/1045959072.db2.gz PHXXRTZSACJRIP-MRXNPFEDSA-N 2 0 334.935 4.373 20 0 EIADRP c1cc2c[nH+]cc(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)c2[nH]1 ZINC001170333249 1046005059 /nfs/dbraw/zinc/00/50/59/1046005059.db2.gz LMTYKCVBFPBEQS-LDLYASANSA-N 2 0 332.451 4.170 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cccnc2Cl)CC1)CC1CC1 ZINC000770597240 1046234212 /nfs/dbraw/zinc/23/42/12/1046234212.db2.gz MCDJIFZXIAVQLT-UHFFFAOYSA-N 2 0 335.923 4.069 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc3c(c2)COC3)CC1)CC1CC1 ZINC000770597875 1046234696 /nfs/dbraw/zinc/23/46/96/1046234696.db2.gz QVFKXMNCPWAVKU-UHFFFAOYSA-N 2 0 342.527 4.051 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)cc1 ZINC000125513519 1046313560 /nfs/dbraw/zinc/31/35/60/1046313560.db2.gz KMRNHPQZTFRNGT-MRXNPFEDSA-N 2 0 344.524 4.320 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000126170810 1046451251 /nfs/dbraw/zinc/45/12/51/1046451251.db2.gz VBFUMFRYGITKND-CYBMUJFWSA-N 2 0 347.503 4.250 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]CC2CC[NH+](C)CC2)cc1 ZINC000126229832 1046464869 /nfs/dbraw/zinc/46/48/69/1046464869.db2.gz JTZIJUSKPKPODS-QGZVFWFLSA-N 2 0 338.495 4.355 20 0 EIADRP CC[C@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc2cc(OC)ccc2c1 ZINC000126265182 1046466632 /nfs/dbraw/zinc/46/66/32/1046466632.db2.gz BLQOJAFISSZVSE-NRFANRHFSA-N 2 0 326.484 4.231 20 0 EIADRP Cc1[nH+]ccc(NC[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1Cl ZINC000497251759 1046518054 /nfs/dbraw/zinc/51/80/54/1046518054.db2.gz ZWHMYUZBWDUWEV-SUMWQHHRSA-N 2 0 335.904 4.022 20 0 EIADRP CC[C@H](Cc1ccc(Cl)cc1)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459405243 1046604506 /nfs/dbraw/zinc/60/45/06/1046604506.db2.gz DZHIBMYLHAJYAG-GOSISDBHSA-N 2 0 343.902 4.315 20 0 EIADRP CCCCOc1cc(C[N@H+](C)[C@H]2CC[NH+](CC)C[C@H]2C)ccc1OC ZINC000536658860 1046624220 /nfs/dbraw/zinc/62/42/20/1046624220.db2.gz PPTKFBNCRVCPAE-MJGOQNOKSA-N 2 0 348.531 4.036 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2cc(C)c(OC(F)F)c(C)c2)[C@H](C)C1 ZINC000536660001 1046626039 /nfs/dbraw/zinc/62/60/39/1046626039.db2.gz SASDIZZBPCSPCK-NVXWUHKLSA-N 2 0 340.458 4.067 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cc(C)c(C)cc2OC(F)F)C[C@H]1C ZINC000536662081 1046631009 /nfs/dbraw/zinc/63/10/09/1046631009.db2.gz NSCXMZUIAFZNCO-NVXWUHKLSA-N 2 0 340.458 4.209 20 0 EIADRP CC[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)C(C)(C)c1ccccc1 ZINC000459434483 1046669235 /nfs/dbraw/zinc/66/92/35/1046669235.db2.gz OVDXWTJAPSLPFH-NRFANRHFSA-N 2 0 337.511 4.396 20 0 EIADRP c1ccc(C[C@H](C[NH2+]C2CCN(C3CC3)CC2)c2ccccc2)cc1 ZINC000459435876 1046669439 /nfs/dbraw/zinc/66/94/39/1046669439.db2.gz XNZWQLMXCXHEID-OAQYLSRUSA-N 2 0 334.507 4.229 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc3cc(OC)ccc3c2)[C@H](C)C1 ZINC000536682261 1046684569 /nfs/dbraw/zinc/68/45/69/1046684569.db2.gz BJCDJJXDORATLU-IERDGZPVSA-N 2 0 326.484 4.011 20 0 EIADRP CC[NH+](CC)C[C@@H]1CC[N@H+](Cc2c(OC)ccc3ccccc32)C1 ZINC000536697293 1046694572 /nfs/dbraw/zinc/69/45/72/1046694572.db2.gz OLWWFHGSSIAAOT-KRWDZBQOSA-N 2 0 326.484 4.012 20 0 EIADRP c1ccc([C@H]2CCC[C@H]2C[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459558662 1046777395 /nfs/dbraw/zinc/77/73/95/1046777395.db2.gz AOLSMXBAXHNCLO-SIKLNZKXSA-N 2 0 335.495 4.224 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc2ccccc2c1 ZINC000536859341 1046826798 /nfs/dbraw/zinc/82/67/98/1046826798.db2.gz RZNWUVUMFNCUKQ-GUDVDZBRSA-N 2 0 340.511 4.380 20 0 EIADRP c1ccc(C[NH2+]C2CC[NH+](CC[C@H]3CCc4ccccc43)CC2)cc1 ZINC001170470053 1046827264 /nfs/dbraw/zinc/82/72/64/1046827264.db2.gz UKWRITUMELONBZ-OAQYLSRUSA-N 2 0 334.507 4.361 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+]CCCO[C@@H]2CCCc3ccccc32)CC1 ZINC000536871353 1046835071 /nfs/dbraw/zinc/83/50/71/1046835071.db2.gz QYVPPLZUCULGGR-OAQYLSRUSA-N 2 0 344.543 4.323 20 0 EIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]C3CCC(C(F)F)CC3)CC2)C1 ZINC000459713203 1046868809 /nfs/dbraw/zinc/86/88/09/1046868809.db2.gz NZJYVQDSHMUDJQ-MMIPBJDJSA-N 2 0 328.491 4.443 20 0 EIADRP CO[C@H](c1ccccc1)[C@H](C)[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000786834610 1046872308 /nfs/dbraw/zinc/87/23/08/1046872308.db2.gz GMYFXYMKGWSAFS-RLHVNXBHSA-N 2 0 330.516 4.149 20 0 EIADRP COc1ccc([C@@H]([NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)C2CC2)cc1 ZINC000536947129 1046877390 /nfs/dbraw/zinc/87/73/90/1046877390.db2.gz KCKJLLIOMZRTIG-UWJYYQICSA-N 2 0 330.516 4.391 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCC[NH2+][C@H](C)c2ccc(OC)cc2)cc1 ZINC000537027501 1046902619 /nfs/dbraw/zinc/90/26/19/1046902619.db2.gz AENGEHHHMVFVJX-IAGOWNOFSA-N 2 0 342.483 4.095 20 0 EIADRP COc1ccc(CC2([NH3+])CC[NH+]([C@H](C)CCCC(C)C)CC2)cc1 ZINC001170070461 1046941471 /nfs/dbraw/zinc/94/14/71/1046941471.db2.gz FKYXRTASGNFOQD-GOSISDBHSA-N 2 0 332.532 4.246 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+][C@H]2CCc3nc(Cl)ccc32)C1 ZINC000806131616 1047126025 /nfs/dbraw/zinc/12/60/25/1047126025.db2.gz LFQHFACZTQITPY-INMHGKMJSA-N 2 0 335.923 4.070 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H]1CCc2nc(Cl)ccc21 ZINC000806131037 1047155757 /nfs/dbraw/zinc/15/57/57/1047155757.db2.gz FPYYJZKDYWFBBI-SFHVURJKSA-N 2 0 343.902 4.352 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1cc[nH]c(=O)c1 ZINC000788574446 1047236405 /nfs/dbraw/zinc/23/64/05/1047236405.db2.gz UGBKGWBNTAYRIV-KRWDZBQOSA-N 2 0 339.483 4.014 20 0 EIADRP C=Cc1cccc(-n2cc(CC[NH+]3CCC([NH3+])CC3)c3ccccc32)c1 ZINC001170528192 1047470049 /nfs/dbraw/zinc/47/00/49/1047470049.db2.gz KKCOCASYOLMDDF-UHFFFAOYSA-N 2 0 345.490 4.239 20 0 EIADRP CSC1(C[NH2+][C@H](C)c2ccc(F)c3ccccc32)CC[NH+](C)CC1 ZINC000556194100 1047553089 /nfs/dbraw/zinc/55/30/89/1047553089.db2.gz VIWIKMDKDLZKIK-OAHLLOKOSA-N 2 0 346.515 4.457 20 0 EIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@@H]3C[C@H]3c3ccccc3)CC2)C1 ZINC000556240182 1047603667 /nfs/dbraw/zinc/60/36/67/1047603667.db2.gz HEPGOVRULGYWMY-BZNRXQDOSA-N 2 0 326.528 4.423 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)CC3 ZINC000556231887 1047608745 /nfs/dbraw/zinc/60/87/45/1047608745.db2.gz XYJYSHHKMTYCHW-SFHVURJKSA-N 2 0 339.527 4.189 20 0 EIADRP C[NH+](C)C1CCC([NH2+]CCc2ccc(Oc3ccccc3)cc2)CC1 ZINC001168294681 1047664586 /nfs/dbraw/zinc/66/45/86/1047664586.db2.gz BFDDAUBNKSORPZ-UHFFFAOYSA-N 2 0 338.495 4.484 20 0 EIADRP c1cn(Cc2cccc(C[NH2+][C@@H]3CC[C@H](c4ccccc4)C3)c2)cn1 ZINC000130454345 1047710586 /nfs/dbraw/zinc/71/05/86/1047710586.db2.gz ZDNLAJMFMULPFZ-FCHUYYIVSA-N 2 0 331.463 4.357 20 0 EIADRP c1cn(Cc2cccc(C[NH2+][C@H]3CC[C@@H](c4ccccc4)C3)c2)cn1 ZINC000130453713 1047711181 /nfs/dbraw/zinc/71/11/81/1047711181.db2.gz ZDNLAJMFMULPFZ-YADHBBJMSA-N 2 0 331.463 4.357 20 0 EIADRP CC(C)C[C@@H]([NH3+])c1nc2ccccc2n1C1CCC([NH+](C)C)CC1 ZINC001168304303 1047742781 /nfs/dbraw/zinc/74/27/81/1047742781.db2.gz USHPYNNRQXJHQC-OFLPRAFFSA-N 2 0 328.504 4.128 20 0 EIADRP CC1CC[NH+](Cc2ccccc2C[NH2+]Cc2ccc3[nH]cnc3c2)CC1 ZINC000550620039 1047763626 /nfs/dbraw/zinc/76/36/26/1047763626.db2.gz SVDQBPKJEFYNBU-UHFFFAOYSA-N 2 0 348.494 4.085 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H](CC2CCOCC2)c2cccc(F)c2)CC1 ZINC001168305735 1047771634 /nfs/dbraw/zinc/77/16/34/1047771634.db2.gz LYARQVNDAFZTRJ-XVAXZDLZSA-N 2 0 348.506 4.146 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000556589895 1047835022 /nfs/dbraw/zinc/83/50/22/1047835022.db2.gz QPMLMMWPJMIJCC-ZCLUNYJNSA-N 2 0 330.516 4.041 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000131270805 1047851788 /nfs/dbraw/zinc/85/17/88/1047851788.db2.gz ZGFFCWDEUZLLAV-CVEARBPZSA-N 2 0 345.531 4.077 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1)[C@H](O)c1ccccc1 ZINC000824401103 1047865329 /nfs/dbraw/zinc/86/53/29/1047865329.db2.gz BPJSDBSBRXMNOE-XLIONFOSSA-N 2 0 346.559 4.377 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+]([C@H]1CCc3c(Cl)cccc3C1)CC2 ZINC001171057498 1047873821 /nfs/dbraw/zinc/87/38/21/1047873821.db2.gz YWNFNZCHJPDZBN-KRWDZBQOSA-N 2 0 332.919 4.005 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cccc(-n3cccn3)c2)c1 ZINC000131350193 1047881425 /nfs/dbraw/zinc/88/14/25/1047881425.db2.gz LEVCQIJJXCYRRO-UHFFFAOYSA-N 2 0 348.494 4.002 20 0 EIADRP CC1(C)[C@@H]2C[C@H]([NH+]3CCC([NH3+])(Cc4ccccc4Cl)CC3)C[C@@H]21 ZINC001170740183 1047954264 /nfs/dbraw/zinc/95/42/64/1047954264.db2.gz VGDSYHAFEBHYAQ-BJWYYQGGSA-N 2 0 332.919 4.110 20 0 EIADRP CC1(C)[C@@H]2C[C@@H]([N@H+](Cc3ccccc3F)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170741016 1047960317 /nfs/dbraw/zinc/96/03/17/1047960317.db2.gz XCQZCKOUSVONKL-LMZXCBKASA-N 2 0 330.491 4.332 20 0 EIADRP Cc1ccc2c(C[N@@H+](C)Cc3ccc(-n4ccnc4)cc3)c[nH]c2c1 ZINC001136975243 1048006119 /nfs/dbraw/zinc/00/61/19/1048006119.db2.gz BTAANORTCAAEFP-UHFFFAOYSA-N 2 0 330.435 4.294 20 0 EIADRP CC1(C)[C@@H]2C[C@H]([NH+]3CCC4(CC[N@H+](Cc5ccoc5)C4)CC3)C[C@@H]21 ZINC001170749441 1048038199 /nfs/dbraw/zinc/03/81/99/1048038199.db2.gz FCGIZISTRNXDQF-REPLKXPHSA-N 2 0 328.500 4.002 20 0 EIADRP C[N@@H+](Cc1ccc(C(F)(F)F)c(Cl)c1)CC1CC[NH+](C)CC1 ZINC001143807613 1048201962 /nfs/dbraw/zinc/20/19/62/1048201962.db2.gz FVILTNBBHLTCKI-UHFFFAOYSA-N 2 0 334.813 4.132 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171112481 1048235240 /nfs/dbraw/zinc/23/52/40/1048235240.db2.gz LMEZNVGDTGRZGV-UFYCRDLUSA-N 2 0 334.935 4.440 20 0 EIADRP Cc1cccc(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499149814 1048357333 /nfs/dbraw/zinc/35/73/33/1048357333.db2.gz UOESPUQAFULPBK-WBDAEOGXSA-N 2 0 334.507 4.323 20 0 EIADRP Oc1cccc2c1CC[C@H]2[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000499153569 1048361875 /nfs/dbraw/zinc/36/18/75/1048361875.db2.gz RVFXRCBDDJZJFB-VQQMMKBISA-N 2 0 348.490 4.165 20 0 EIADRP CN(C)c1cccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499154461 1048362976 /nfs/dbraw/zinc/36/29/76/1048362976.db2.gz UOSYCBJDBFUDCR-MUSUJDOFSA-N 2 0 349.522 4.038 20 0 EIADRP [NH3+]Cc1ccccc1C[NH2+][C@H]1CCc2cc(Cl)c(Cl)cc2C1 ZINC001171149566 1048485776 /nfs/dbraw/zinc/48/57/76/1048485776.db2.gz YMIFAKAYEQQALB-INIZCTEOSA-N 2 0 335.278 4.099 20 0 EIADRP C[NH+](C)[C@H]1CC[C@@H]([NH2+][C@@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171150766 1048500256 /nfs/dbraw/zinc/50/02/56/1048500256.db2.gz SZLKRACOFTVNKC-OAGGEKHMSA-N 2 0 341.326 4.313 20 0 EIADRP c1ccc([C@@H]([NH2+]CCCCC[NH+]2CCCC2)C2CCOCC2)cc1 ZINC000815646792 1048569965 /nfs/dbraw/zinc/56/99/65/1048569965.db2.gz SCTRXDNGNAPXFR-OAQYLSRUSA-N 2 0 330.516 4.010 20 0 EIADRP CC(C)OCc1ccccc1C[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000925479370 1048643628 /nfs/dbraw/zinc/64/36/28/1048643628.db2.gz GQHZQDJNVYCDGY-OAQYLSRUSA-N 2 0 326.484 4.181 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CC[C@]3(C)C[C@@]3(F)Cl)CC2)C1 ZINC000846032150 1048800356 /nfs/dbraw/zinc/80/03/56/1048800356.db2.gz KEGOXONDNBXCAY-SPUZQDLCSA-N 2 0 330.919 4.324 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](Cc2c[nH]nc2-c2cccs2)CC1 ZINC000134155801 1048888531 /nfs/dbraw/zinc/88/85/31/1048888531.db2.gz ZLEXLAPNQAVHKY-UHFFFAOYSA-N 2 0 346.544 4.082 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+][C@@H]2CCC[C@H]([NH+](C)C)C2)cc1 ZINC000237343616 1048929234 /nfs/dbraw/zinc/92/92/34/1048929234.db2.gz WPLBOJYJHBQVJJ-UXHICEINSA-N 2 0 338.495 4.325 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCCc2sccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000134971027 1049048304 /nfs/dbraw/zinc/04/83/04/1049048304.db2.gz LVMVZDGGLLXSBL-HNAYVOBHSA-N 2 0 344.524 4.417 20 0 EIADRP C[C@H]([NH2+][C@@H]1C[C@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc2c(c1)CCC2 ZINC000817907249 1049055407 /nfs/dbraw/zinc/05/54/07/1049055407.db2.gz SVICRDOEFWQJBA-YTJPUZGESA-N 2 0 348.490 4.082 20 0 EIADRP C[C@@H]([NH3+])C[C@H](C)[NH2+]CCCN1c2ccccc2Sc2ccccc21 ZINC000817913011 1049058471 /nfs/dbraw/zinc/05/84/71/1049058471.db2.gz TYPAKHZJVZHTOH-CVEARBPZSA-N 2 0 341.524 4.395 20 0 EIADRP CCOc1ccc(Cl)cc1[C@H](C)[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000817949955 1049066495 /nfs/dbraw/zinc/06/64/95/1049066495.db2.gz UWNABXLBWLPZRY-AWEZNQCLSA-N 2 0 332.875 4.091 20 0 EIADRP COc1cc([C@H](C)[NH2+]CC[C@H]2CCC[NH2+]C2)ccc1SC(F)F ZINC000817957710 1049066603 /nfs/dbraw/zinc/06/66/03/1049066603.db2.gz OLHJUNIMQRUFIG-QWHCGFSZSA-N 2 0 344.471 4.050 20 0 EIADRP FC(F)Sc1ccc2c(c1)CCC[C@H]2[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000817967843 1049071244 /nfs/dbraw/zinc/07/12/44/1049071244.db2.gz CSNFXXATLNUJKQ-CZUORRHYSA-N 2 0 326.456 4.110 20 0 EIADRP COc1c(C)cc([C@@H](C)[NH2+]Cc2ccc3c(c2)C[NH2+]C3)cc1Cl ZINC000817967774 1049071470 /nfs/dbraw/zinc/07/14/70/1049071470.db2.gz BPXLIPONTLTOSM-CYBMUJFWSA-N 2 0 330.859 4.111 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[NH2+]C[C@H]2C1)c1ccc(SC(F)F)cc1 ZINC000817985448 1049080071 /nfs/dbraw/zinc/08/00/71/1049080071.db2.gz KDIUJHJTAHNEJQ-ZGKBOVNRSA-N 2 0 326.456 4.040 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CC2)[C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170911504 1049197408 /nfs/dbraw/zinc/19/74/08/1049197408.db2.gz XXXKVWWTYHVKKL-KZNAEPCWSA-N 2 0 332.919 4.179 20 0 EIADRP C[NH+](C)CC[C@@H]([NH2+][C@@H]1CCc2cc(F)cc(F)c2C1)c1ccccc1 ZINC001170657879 1049342648 /nfs/dbraw/zinc/34/26/48/1049342648.db2.gz HICFQHHXLDIOAL-WIYYLYMNSA-N 2 0 344.449 4.105 20 0 EIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000136688071 1049500846 /nfs/dbraw/zinc/50/08/46/1049500846.db2.gz OIDHOQDDCPKWOA-HXUWFJFHSA-N 2 0 344.543 4.226 20 0 EIADRP Cc1cnccc1O[C@H]1CC[N@@H+]([C@H]2CCc3cccc(Cl)c3C2)C1 ZINC001170948041 1049514454 /nfs/dbraw/zinc/51/44/54/1049514454.db2.gz ZWBPCKOXDXKJEE-IRXDYDNUSA-N 2 0 342.870 4.054 20 0 EIADRP Cc1cc(C[NH+](C)C)cc(N[C@H]2CC[N@H+](Cc3ccccc3)[C@H]2C)c1 ZINC000820836049 1049564884 /nfs/dbraw/zinc/56/48/84/1049564884.db2.gz IZFYUQIMOOCFGF-AVRDEDQJSA-N 2 0 337.511 4.132 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@H]([NH2+][C@H]2CCc3cc(F)cc(F)c3C2)CC1 ZINC001170685408 1049566686 /nfs/dbraw/zinc/56/66/86/1049566686.db2.gz MHHDJKQCWLNUMR-BZSNNMDCSA-N 2 0 336.470 4.065 20 0 EIADRP CC(C)(C)C[N@H+]([C@H]1CC[C@H]([NH3+])CC1)[C@@H]1CCc2c(F)cccc2C1 ZINC001171414304 1049647586 /nfs/dbraw/zinc/64/75/86/1049647586.db2.gz PRYURWAFNMPKPZ-KZNAEPCWSA-N 2 0 332.507 4.301 20 0 EIADRP CC(C)(C)C[NH+]1CCC(C[NH2+][C@H]2CCc3cccc(F)c3C2)CC1 ZINC001170969433 1049671295 /nfs/dbraw/zinc/67/12/95/1049671295.db2.gz IARSHQPBAUWPJW-SFHVURJKSA-N 2 0 332.507 4.031 20 0 EIADRP CSCCCCC[NH2+][C@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2 ZINC000716641417 1049700198 /nfs/dbraw/zinc/70/01/98/1049700198.db2.gz ZVBLVQHJQDBAAB-UFYCRDLUSA-N 2 0 332.557 4.162 20 0 EIADRP CC1(C[NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)CC(F)(F)C1 ZINC000716691666 1049700423 /nfs/dbraw/zinc/70/04/23/1049700423.db2.gz JICNGSHUMMIDBZ-BZSNNMDCSA-N 2 0 334.454 4.065 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)c1cccc(O)c1 ZINC000716693174 1049700702 /nfs/dbraw/zinc/70/07/02/1049700702.db2.gz OGBURNTVXIMOMX-PLWAMTLXSA-N 2 0 336.479 4.096 20 0 EIADRP C[C@H](C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)CC(F)(F)F ZINC000716680016 1049702405 /nfs/dbraw/zinc/70/24/05/1049702405.db2.gz PKASZECXGJWRAE-OWLYRPNTSA-N 2 0 340.433 4.218 20 0 EIADRP Fc1cc2c(cc1F)C[C@H]([N@@H+]1CCCC[C@H]1CC[NH+]1CCCC1)CC2 ZINC001171486352 1049715611 /nfs/dbraw/zinc/71/56/11/1049715611.db2.gz BPLIABWPBCWRNO-RBUKOAKNSA-N 2 0 348.481 4.163 20 0 EIADRP CCCC[NH+]1CCC([N@H+](C)[C@H]2CCc3cc(F)c(F)cc3C2)CC1 ZINC001171496520 1049722817 /nfs/dbraw/zinc/72/28/17/1049722817.db2.gz CWNPFIVRHUUGST-SFHVURJKSA-N 2 0 336.470 4.018 20 0 EIADRP Fc1cccc2c1C[C@H]([NH2+]C1CC[NH+](C[C@@H]3CC=CCC3)CC1)CC2 ZINC001170978750 1049737074 /nfs/dbraw/zinc/73/70/74/1049737074.db2.gz ZSNGQTJUJGMKNR-YLJYHZDGSA-N 2 0 342.502 4.093 20 0 EIADRP Cc1cccc2c1CC[C@H]([N@H+](C1CCCC1)[C@H]1CC[C@H]([NH3+])CC1)C2 ZINC001171557457 1049755188 /nfs/dbraw/zinc/75/51/88/1049755188.db2.gz CEDMNRXDUBVDAG-JBACZVJFSA-N 2 0 326.528 4.367 20 0 EIADRP Cc1cccc2c1CC[C@H]([NH+]1CCCC[C@H]1C[C@@H]1CCC[N@H+]1C)C2 ZINC001171573110 1049758255 /nfs/dbraw/zinc/75/82/55/1049758255.db2.gz GNFQTFOEDBDFRO-ACRUOGEOSA-N 2 0 326.528 4.191 20 0 EIADRP COc1cccc(CC2(C[NH2+]C3CC(C)(C)[NH+](C)C(C)(C)C3)CC2)c1 ZINC001171631044 1049762589 /nfs/dbraw/zinc/76/25/89/1049762589.db2.gz VELLPQAYGMHVHT-UHFFFAOYSA-N 2 0 344.543 4.259 20 0 EIADRP CCN(CC[NH2+]C1CC(C)(C)[NH+](C)C(C)(C)C1)c1cccc(C)c1 ZINC001171617213 1049766146 /nfs/dbraw/zinc/76/61/46/1049766146.db2.gz IDBSFEDSTSDVNG-UHFFFAOYSA-N 2 0 331.548 4.062 20 0 EIADRP COc1ccc([C@H]([NH2+]C2CC(C)(C)[NH+](C)C(C)(C)C2)C2CC2)cc1 ZINC001171622870 1049767906 /nfs/dbraw/zinc/76/79/06/1049767906.db2.gz AUDRITFUUCMPNR-LJQANCHMSA-N 2 0 330.516 4.387 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CCc2ccc3ccccc3n2)CC1(C)C ZINC001171625665 1049767979 /nfs/dbraw/zinc/76/79/79/1049767979.db2.gz MPCSBFCWKHYPEC-UHFFFAOYSA-N 2 0 325.500 4.018 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CC2CC[NH+](CC3CCCC3)CC2)CC1(C)C ZINC001171627022 1049769130 /nfs/dbraw/zinc/76/91/30/1049769130.db2.gz JAIPEJNIPAHZOH-UHFFFAOYSA-N 3 0 349.607 4.130 20 0 EIADRP Cc1ccc(CC[C@@H](C)[NH+]2CCC([NH3+])(c3ccc(F)cc3)CC2)cc1 ZINC001171666004 1049772792 /nfs/dbraw/zinc/77/27/92/1049772792.db2.gz KRYZFMIUICYYFD-GOSISDBHSA-N 2 0 340.486 4.405 20 0 EIADRP C[C@H](Cc1c(Cl)cccc1Cl)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000245550267 1049776663 /nfs/dbraw/zinc/77/66/63/1049776663.db2.gz OOAHYCYVKPMSAQ-RDBSUJKOSA-N 2 0 327.299 4.141 20 0 EIADRP C[NH+]1C(C)(C)CC([NH+]2CCC3(Cc4ccccc4O3)CC2)CC1(C)C ZINC001171642468 1049779170 /nfs/dbraw/zinc/77/91/70/1049779170.db2.gz KFURQYKKZDCSQQ-UHFFFAOYSA-N 2 0 342.527 4.108 20 0 EIADRP COc1ccc([C@H]2CC[N@@H+](C3CC(C)(C)[NH+](C)C(C)(C)C3)C2)cc1 ZINC001171643384 1049781285 /nfs/dbraw/zinc/78/12/85/1049781285.db2.gz SFDQMQLJFYMXEY-KRWDZBQOSA-N 2 0 330.516 4.136 20 0 EIADRP C[NH2+]Cc1ccc2c(ccn2[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC001171744478 1049789588 /nfs/dbraw/zinc/78/95/88/1049789588.db2.gz HARYVHNJWSHJRN-DYESRHJHSA-N 2 0 333.479 4.196 20 0 EIADRP C[C@H]1C[C@H](n2c3ccccc3c3c2CC[NH2+]C3)C[N@@H+]1Cc1ccccc1 ZINC001171758559 1049789998 /nfs/dbraw/zinc/78/99/98/1049789998.db2.gz YFEPCTJRVFZIBL-HKUYNNGSSA-N 2 0 345.490 4.123 20 0 EIADRP C[NH2+]CCc1cn([C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c2ccccc12 ZINC001171760333 1049791285 /nfs/dbraw/zinc/79/12/85/1049791285.db2.gz UDOQZCXTVGNIOX-GHTZIAJQSA-N 2 0 347.506 4.239 20 0 EIADRP CN1CCC([N@H+](C2CCCC2)[C@@H]2CCc3cccc(F)c3C2)CC1 ZINC001171010078 1049828876 /nfs/dbraw/zinc/82/88/76/1049828876.db2.gz KOKSVYVXQGWFKN-LJQANCHMSA-N 2 0 330.491 4.022 20 0 EIADRP CCCC[C@H](COC)[NH2+]C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000813881966 1049831294 /nfs/dbraw/zinc/83/12/94/1049831294.db2.gz YEELAEXDSUOMAY-XCSKNGGISA-N 2 0 344.543 4.367 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CCCCCCCCO)CC[N@@H+]1Cc1ccccc1 ZINC001171974586 1049836130 /nfs/dbraw/zinc/83/61/30/1049836130.db2.gz IAQCLUDBHGWDBE-NRFANRHFSA-N 2 0 346.559 4.352 20 0 EIADRP CC1(C)C[C@H](n2cc3ccc(C[NH3+])cc3n2)CC[N@@H+]1Cc1ccccc1 ZINC001171976342 1049837930 /nfs/dbraw/zinc/83/79/30/1049837930.db2.gz RJPKADPWNVBUEV-HXUWFJFHSA-N 2 0 348.494 4.111 20 0 EIADRP CC1(C)C[C@H]([NH+]2CC[C@@H](c3ccncc3)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171983727 1049838776 /nfs/dbraw/zinc/83/87/76/1049838776.db2.gz GNPYKHHGKJIARF-FGZHOGPDSA-N 2 0 349.522 4.314 20 0 EIADRP CC1(C)C[C@@H](C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CCO1 ZINC001171978672 1049838996 /nfs/dbraw/zinc/83/89/96/1049838996.db2.gz IJPMVEBTECYQFG-PMACEKPBSA-N 2 0 344.543 4.224 20 0 EIADRP CC1(C)C[C@H]([NH+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)CC[N@@H+]1Cc1ccccc1 ZINC001171982375 1049839414 /nfs/dbraw/zinc/83/94/14/1049839414.db2.gz RHRIFDWWVCSZOK-CEXWTWQISA-N 2 0 348.481 4.407 20 0 EIADRP CCOCC1CC[NH+]([C@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CC1 ZINC001171986313 1049840793 /nfs/dbraw/zinc/84/07/93/1049840793.db2.gz HEXJOEJKONIIOQ-NRFANRHFSA-N 2 0 344.543 4.178 20 0 EIADRP CC1(C)C[C@H]([NH+]2CC[C@H](C(F)(F)F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171987845 1049841017 /nfs/dbraw/zinc/84/10/17/1049841017.db2.gz KOOYREGVYRUNKH-DLBZAZTESA-N 2 0 340.433 4.314 20 0 EIADRP CCCN(CCC[NH+](C)C)[C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987394 1049841191 /nfs/dbraw/zinc/84/11/91/1049841191.db2.gz USAPMTIVLRHNHE-NRFANRHFSA-N 2 0 345.575 4.093 20 0 EIADRP C[N@H+](CCc1cccnc1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2Cc1ccccc1 ZINC001172076444 1049845198 /nfs/dbraw/zinc/84/51/98/1049845198.db2.gz YQBUQILZRJSANY-JKHIJQBDSA-N 2 0 349.522 4.142 20 0 EIADRP F[C@@H]1CCC[C@@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172066832 1049851899 /nfs/dbraw/zinc/85/18/99/1049851899.db2.gz KJYDCJVWQXLQOM-SSSFQFABSA-N 2 0 330.491 4.442 20 0 EIADRP CC(C)(C)OCCC[NH2+][C@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172067894 1049852084 /nfs/dbraw/zinc/85/20/84/1049852084.db2.gz HPBDIYFXNXGZDA-WKCHPHFGSA-N 2 0 344.543 4.367 20 0 EIADRP Cc1cnccc1C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172070014 1049853563 /nfs/dbraw/zinc/85/35/63/1049853563.db2.gz ZUMUFTZUQGHSCJ-DKUWSORSSA-N 2 0 335.495 4.065 20 0 EIADRP c1csc(CC[NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172069548 1049853622 /nfs/dbraw/zinc/85/36/22/1049853622.db2.gz UYNVJCYPUOYOKZ-OWZKRDHZSA-N 2 0 340.536 4.466 20 0 EIADRP C[C@@H]1OC2(CC[NH+]([C@@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4C)CC2)c2ccccc21 ZINC001172133960 1049855004 /nfs/dbraw/zinc/85/50/04/1049855004.db2.gz UUGCNAIWIKHFIE-OKYOBFRVSA-N 2 0 340.511 4.084 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+]C3C[C@@H]4C=C[C@H](C3)O4)[C@@H](C)C2)CC[C@H]1[NH3+] ZINC001172235311 1049870155 /nfs/dbraw/zinc/87/01/55/1049870155.db2.gz XPPFTCOFIOIPJD-XDZWNRBWSA-N 2 0 346.559 4.020 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+]C3C[C@@H]4C=C[C@H](C3)O4)[C@@H](C)C2)CC[C@@H]1[NH3+] ZINC001172235310 1049870731 /nfs/dbraw/zinc/87/07/31/1049870731.db2.gz XPPFTCOFIOIPJD-REPHXLRBSA-N 2 0 346.559 4.020 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CC[C@@H]2CCCCO2)ccc1OC ZINC000180259693 1049873126 /nfs/dbraw/zinc/87/31/26/1049873126.db2.gz WHGGJTYQMFRZNY-XLIONFOSSA-N 2 0 348.531 4.147 20 0 EIADRP CC[C@@H](C)OCC[C@H](C)[N@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172355843 1049894582 /nfs/dbraw/zinc/89/45/82/1049894582.db2.gz WQAJDXWGMKZMFR-VQTJNVASSA-N 2 0 346.559 4.424 20 0 EIADRP COc1ccc(CN2CCC([NH2+][C@@H]3CC[C@H](C)[C@@H](C)C3)CC2)cc1 ZINC001172359537 1049895229 /nfs/dbraw/zinc/89/52/29/1049895229.db2.gz KCLAXRZSLYCSBC-ABSDTBQOSA-N 2 0 330.516 4.074 20 0 EIADRP CC(C)[NH+]1CCC(C[N@H+](C)[C@H]2CCc3c(Cl)cccc3C2)CC1 ZINC001171045970 1049898286 /nfs/dbraw/zinc/89/82/86/1049898286.db2.gz VXTDYPZLYUSGGW-SFHVURJKSA-N 2 0 334.935 4.250 20 0 EIADRP CC(C)COCC[C@H](C)[N@H+](C)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001172475348 1049908371 /nfs/dbraw/zinc/90/83/71/1049908371.db2.gz IMVNEBDQPIPAAC-FQEVSTJZSA-N 2 0 346.559 4.282 20 0 EIADRP c1ccc(-c2cccc(C[N@@H+]3CC[C@@H]4[C@@H](CCC[NH+]4C4CC4)C3)c2)nc1 ZINC000246098455 1049908422 /nfs/dbraw/zinc/90/84/22/1049908422.db2.gz JCHQEAJKRRBCGZ-NZQKXSOJSA-N 2 0 347.506 4.197 20 0 EIADRP c1ccc([C@@H]2CC[C@H]([NH2+]CC3CC[NH+](CC4CCC4)CC3)C2)cc1 ZINC001172555097 1049930998 /nfs/dbraw/zinc/93/09/98/1049930998.db2.gz FUYQOCMRBZOKFH-YADHBBJMSA-N 2 0 326.528 4.424 20 0 EIADRP c1ccc([C@@H]2CC[C@@H]([NH2+]CC3CC[NH+](CC4CCC4)CC3)C2)cc1 ZINC001172555096 1049931268 /nfs/dbraw/zinc/93/12/68/1049931268.db2.gz FUYQOCMRBZOKFH-FGZHOGPDSA-N 2 0 326.528 4.424 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CCC[NH+]1CCCC1 ZINC001172564560 1049935294 /nfs/dbraw/zinc/93/52/94/1049935294.db2.gz IYNPPGYPQVTRDS-CYBMUJFWSA-N 2 0 330.850 4.015 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC(C)(C)C[NH+](C)C ZINC001172566413 1049935576 /nfs/dbraw/zinc/93/55/76/1049935576.db2.gz DNTAUVSRVYSHGF-GFCCVEGCSA-N 2 0 332.866 4.117 20 0 EIADRP CCN1CCC[C@H]1C[NH2+][C@@H](C)CCc1c(F)cc(Cl)cc1F ZINC001172566242 1049935985 /nfs/dbraw/zinc/93/59/85/1049935985.db2.gz UVHAFHWYQIFJMM-JSGCOSHPSA-N 2 0 330.850 4.013 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001172566477 1049936761 /nfs/dbraw/zinc/93/67/61/1049936761.db2.gz FWEXDQYZQQJVLE-REBRKWNGSA-N 2 0 342.861 4.154 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+][C@H]1CC[C@H]([NH+](C)C)CC1 ZINC001172570633 1049939179 /nfs/dbraw/zinc/93/91/79/1049939179.db2.gz HHNQRBFTWKGRRX-BPLDGKMQSA-N 2 0 344.877 4.402 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CCCCCCC[NH3+] ZINC001172579547 1049951632 /nfs/dbraw/zinc/95/16/32/1049951632.db2.gz XNBXQJQJUAQZRX-ZDUSSCGKSA-N 2 0 332.866 4.438 20 0 EIADRP CC1(C)CC([NH2+]CC2CC[NH+](C3CCCCC3)CC2)CC(C)(C)O1 ZINC001172647720 1049956382 /nfs/dbraw/zinc/95/63/82/1049956382.db2.gz MVXKWKGLXNEMSI-UHFFFAOYSA-N 2 0 336.564 4.357 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1Cc2ccc(Cl)cc2C1 ZINC001172721646 1049965185 /nfs/dbraw/zinc/96/51/85/1049965185.db2.gz IIPPCFCULXSBKH-UFYCRDLUSA-N 2 0 332.919 4.146 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@H](C)c2cccc(OC(F)F)c2)C1 ZINC000247119581 1050015378 /nfs/dbraw/zinc/01/53/78/1050015378.db2.gz UOBHUIYPOZZHSX-CABCVRRESA-N 2 0 326.431 4.059 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@H](CC)c2ccccc2OC(F)F)C1 ZINC000247239836 1050018866 /nfs/dbraw/zinc/01/88/66/1050018866.db2.gz YVJHJHZGSCRUKS-GOEBONIOSA-N 2 0 326.431 4.061 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1)c1ccncc1 ZINC000247396958 1050023525 /nfs/dbraw/zinc/02/35/25/1050023525.db2.gz HHOBQLUNJLYZFJ-GUDVDZBRSA-N 2 0 337.511 4.410 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1N(C)C ZINC000248408756 1050055544 /nfs/dbraw/zinc/05/55/44/1050055544.db2.gz VVPWURMSYYSBGE-BZSNNMDCSA-N 2 0 329.532 4.056 20 0 EIADRP CC(C)(C[NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccc(C(F)(F)F)cc1 ZINC000248728261 1050075355 /nfs/dbraw/zinc/07/53/55/1050075355.db2.gz VFIVEOUOCMHTAC-SJORKVTESA-N 2 0 340.433 4.199 20 0 EIADRP Cc1c([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cnn1C(C)(C)C ZINC000248738789 1050076581 /nfs/dbraw/zinc/07/65/81/1050076581.db2.gz XVXXDQCIOXZNSA-SJORKVTESA-N 2 0 334.552 4.109 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1[NH2+]CCc1nc(C2CCCCC2)cs1 ZINC000090046554 1050152487 /nfs/dbraw/zinc/15/24/87/1050152487.db2.gz MALQIVZUPVOWJJ-HLLBOEOZSA-N 2 0 335.561 4.052 20 0 EIADRP CCC(CC)[C@@H](C[NH2+]C[C@H]1CCOc2ccccc21)[NH+]1CCCC1 ZINC001177198916 1050159299 /nfs/dbraw/zinc/15/92/99/1050159299.db2.gz ANHYAAVMBPREMG-UYAOXDASSA-N 2 0 330.516 4.043 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)CCO1 ZINC001177213746 1050163234 /nfs/dbraw/zinc/16/32/34/1050163234.db2.gz HBLWHYUJLPDJPY-DYESRHJHSA-N 2 0 338.495 4.072 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([NH2+]C1CC[NH+](C3CCCCC3)CC1)CC2 ZINC001172827624 1050166912 /nfs/dbraw/zinc/16/69/12/1050166912.db2.gz DDIMFTCZBGSXOM-NRFANRHFSA-N 2 0 326.528 4.239 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ccc3ncccc3c2)C1 ZINC001177290924 1050176939 /nfs/dbraw/zinc/17/69/39/1050176939.db2.gz ZNMWOQZJKSCOQE-QZTJIDSGSA-N 2 0 325.500 4.083 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2ccc(F)c3cccnc23)C1 ZINC001177289269 1050177720 /nfs/dbraw/zinc/17/77/20/1050177720.db2.gz BZVNKCWKQZBBJQ-CALCHBBNSA-N 2 0 343.490 4.222 20 0 EIADRP COc1ccc(C[NH2+]CCC[N@H+]2C[C@H](C)C[C@H](C)C2)c2ccccc12 ZINC001177293858 1050178263 /nfs/dbraw/zinc/17/82/63/1050178263.db2.gz AHEPMIMUVXBDGW-HDICACEKSA-N 2 0 340.511 4.306 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2cc(F)cc(F)c2)C1 ZINC001177261384 1050183529 /nfs/dbraw/zinc/18/35/29/1050183529.db2.gz CFBITXDBCVKORT-MRXNPFEDSA-N 2 0 344.449 4.487 20 0 EIADRP CC(C)C(C[NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)C(C)C ZINC001177328003 1050192222 /nfs/dbraw/zinc/19/22/22/1050192222.db2.gz AWXVKLIXAZCWHW-UHFFFAOYSA-N 2 0 345.575 4.107 20 0 EIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CCc1c(F)cccc1F ZINC001177328025 1050192399 /nfs/dbraw/zinc/19/23/99/1050192399.db2.gz CDKITBIQWDDHOS-UHFFFAOYSA-N 2 0 346.465 4.255 20 0 EIADRP C[C@@H](C[NH2+][C@H](C)Cc1ccc(F)cc1Cl)CC(C)(C)CC[NH3+] ZINC001172861384 1050198196 /nfs/dbraw/zinc/19/81/96/1050198196.db2.gz QSKGALJWIZZNAB-ZIAGYGMSSA-N 2 0 328.903 4.401 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH2+]C1CCC(CC[NH3+])CC1 ZINC001172879475 1050218752 /nfs/dbraw/zinc/21/87/52/1050218752.db2.gz MXWDXTUTRYCJRQ-VQCLRJIVSA-N 2 0 326.937 4.318 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1CC[C@H]([NH+](C)C)CC1 ZINC001172879507 1050220934 /nfs/dbraw/zinc/22/09/34/1050220934.db2.gz NOFHXXCMFZSXDX-FVQBIDKESA-N 2 0 326.937 4.283 20 0 EIADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2cc(C(F)(F)F)ccc2Cl)CC1 ZINC001206303579 1050223830 /nfs/dbraw/zinc/22/38/30/1050223830.db2.gz CYKPHKCOEPBEQW-HNNXBMFYSA-N 2 0 334.813 4.310 20 0 EIADRP C[N@@H+]1CC[C@H]([NH2+]CC2(c3ccc(F)cc3)CCCCC2)CC1(C)C ZINC001177487787 1050225627 /nfs/dbraw/zinc/22/56/27/1050225627.db2.gz PNCUNPNPNPMMTB-IBGZPJMESA-N 2 0 332.507 4.490 20 0 EIADRP COc1ccccc1[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C1CCCC1 ZINC000091284473 1050247056 /nfs/dbraw/zinc/24/70/56/1050247056.db2.gz BSYNNMADZKSCCJ-HRAATJIYSA-N 2 0 328.500 4.000 20 0 EIADRP COc1ccccc1[C@@H]([NH2+]C[C@H]1CC[N@@H+](C2CC2)C1)C1CCCC1 ZINC000091284476 1050247652 /nfs/dbraw/zinc/24/76/52/1050247652.db2.gz BSYNNMADZKSCCJ-IERDGZPVSA-N 2 0 328.500 4.000 20 0 EIADRP CC(C)[C@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccccc1 ZINC000091287605 1050250689 /nfs/dbraw/zinc/25/06/89/1050250689.db2.gz CUGFTJAYGVNKEN-NRFANRHFSA-N 2 0 326.484 4.114 20 0 EIADRP C[C@@]12CC3([NH3+])CC([NH2+]C4CCC5(CCOCC5)CC4)(C1)C[C@](C)(C3)C2 ZINC001173041694 1050268200 /nfs/dbraw/zinc/26/82/00/1050268200.db2.gz DYLBBLMQDINAQT-IVCWUUCSSA-N 2 0 346.559 4.146 20 0 EIADRP CC[C@@H](C[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1 ZINC001177668759 1050274223 /nfs/dbraw/zinc/27/42/23/1050274223.db2.gz CNHNQGRCNOUQAM-YADHBBJMSA-N 2 0 336.523 4.334 20 0 EIADRP C(CC[NH2+][C@H]1CCC[C@H](C2CCOCC2)C1)CC[NH+]1CCCCC1 ZINC001177678996 1050276612 /nfs/dbraw/zinc/27/66/12/1050276612.db2.gz HYNOZCVLSHWUSY-SFTDATJTSA-N 2 0 336.564 4.218 20 0 EIADRP CCCOC1CCC([NH2+]Cc2ccc(C[NH+]3CCCC3)cc2)CC1 ZINC001173085786 1050300156 /nfs/dbraw/zinc/30/01/56/1050300156.db2.gz NQKPQPMWEJGEOS-UHFFFAOYSA-N 2 0 330.516 4.110 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@H](C)c2ccc(OC)c(OC)c2)CC1 ZINC001173101928 1050303225 /nfs/dbraw/zinc/30/32/25/1050303225.db2.gz POSRPNUQFMCKHL-FAEJEUNOSA-N 2 0 334.504 4.007 20 0 EIADRP CC[NH+](CC)C1CCC(n2cc(CC[NH3+])c3cc(C)ccc32)CC1 ZINC001173104720 1050304375 /nfs/dbraw/zinc/30/43/75/1050304375.db2.gz LZLVUSJJIBVTNF-UHFFFAOYSA-N 2 0 327.516 4.276 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCc2ccc(OC(C)C)cc2)CC1 ZINC001173104235 1050305174 /nfs/dbraw/zinc/30/51/74/1050305174.db2.gz LOUSVCJKUFBVOT-UHFFFAOYSA-N 2 0 332.532 4.259 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2CC[NH+](CC3CCCCC3)CC2)CC1 ZINC001173107612 1050307007 /nfs/dbraw/zinc/30/70/07/1050307007.db2.gz YYVQFOQSBBPBSW-UHFFFAOYSA-N 2 0 349.607 4.274 20 0 EIADRP CC[NH+](CC)C1CCC(Nc2ccc(C[NH3+])cc2C(F)(F)F)CC1 ZINC001173107740 1050307369 /nfs/dbraw/zinc/30/73/69/1050307369.db2.gz KSTXIYMRCCGULS-UHFFFAOYSA-N 2 0 343.437 4.229 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C2(c3cccc(OC)c3)CCC2)CC1 ZINC001173107266 1050308062 /nfs/dbraw/zinc/30/80/62/1050308062.db2.gz MHGUZGPACLDMNY-UHFFFAOYSA-N 2 0 330.516 4.317 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCSC[C@@H]2c2ccccc2)CC1 ZINC001173114541 1050309182 /nfs/dbraw/zinc/30/91/82/1050309182.db2.gz OGVIAEUERPWKGO-SOAGJPPSSA-N 2 0 332.557 4.430 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](c2ncccc2Cl)C2CC2)CC1 ZINC001173110656 1050309759 /nfs/dbraw/zinc/30/97/59/1050309759.db2.gz QPJTYESHANKMBO-LEOMRAHMSA-N 2 0 335.923 4.429 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCN(c3cccc(Cl)c3)CC2)CC1 ZINC001173112028 1050310501 /nfs/dbraw/zinc/31/05/01/1050310501.db2.gz UPZLPVXGNBVOCA-UHFFFAOYSA-N 2 0 349.950 4.115 20 0 EIADRP C[C@@]1(C[NH3+])CCC[N@H+](Cc2ccc(Cl)c(Br)c2)CC1 ZINC001206317557 1050385190 /nfs/dbraw/zinc/38/51/90/1050385190.db2.gz HGAJZGHKHAZGKE-OAHLLOKOSA-N 2 0 345.712 4.053 20 0 EIADRP CCc1ccc(C[C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC001173237245 1050394902 /nfs/dbraw/zinc/39/49/02/1050394902.db2.gz GPIMETLQGHZWRZ-CVDCTZTESA-N 2 0 336.523 4.292 20 0 EIADRP CCc1sc(C[N@@H+]2CCC[C@@](C)(C[NH3+])CC2)cc1Br ZINC001206317878 1050395771 /nfs/dbraw/zinc/39/57/71/1050395771.db2.gz KETJQLPRCNZLEE-OAHLLOKOSA-N 2 0 345.350 4.024 20 0 EIADRP CCc1ccc(C[C@H](C)[NH2+]C2CC[NH+](CC3CCCC3)CC2)cc1 ZINC001173241982 1050397186 /nfs/dbraw/zinc/39/71/86/1050397186.db2.gz RKUATEABQQHWAA-SFHVURJKSA-N 2 0 328.544 4.424 20 0 EIADRP CCSC[C@H](C)[NH+]1CCC2(CC[C@H]2[N@H+](C)Cc2ccco2)CC1 ZINC001173299049 1050401503 /nfs/dbraw/zinc/40/15/03/1050401503.db2.gz AIIGQEFRPFWKIF-FUHWJXTLSA-N 2 0 336.545 4.098 20 0 EIADRP C[C@H]1C[C@H](CC[NH2+]Cc2ccc(F)cc2F)C[N@@H+]1Cc1ccccc1 ZINC001178207954 1050403380 /nfs/dbraw/zinc/40/33/80/1050403380.db2.gz JKLCUJDGELSWEZ-WMZOPIPTSA-N 2 0 344.449 4.355 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+][C@H]2CC[C@@H](C)SC2)C[N@@H+]1Cc1ccccc1 ZINC001178207161 1050403861 /nfs/dbraw/zinc/40/38/61/1050403861.db2.gz APOXJDJCPXDXKK-LFGUQSLTSA-N 2 0 332.557 4.161 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccnc(Cl)c2)CC1)CC(C)C ZINC000773737353 1050429080 /nfs/dbraw/zinc/42/90/80/1050429080.db2.gz ZUNGEQKBVGMNGF-UHFFFAOYSA-N 2 0 337.939 4.315 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc2ccoc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001178330265 1050437208 /nfs/dbraw/zinc/43/72/08/1050437208.db2.gz ALMSVPXXIXCOGO-UTKZUKDTSA-N 2 0 334.463 4.433 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@H]2C[C@@]2(C[NH+](C)C)C1 ZINC001173549692 1050485002 /nfs/dbraw/zinc/48/50/02/1050485002.db2.gz IFRAEYXVJVMOGN-DDUZABMNSA-N 2 0 341.326 4.198 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ccccc2)ccc1OC ZINC000182196971 1050540263 /nfs/dbraw/zinc/54/02/63/1050540263.db2.gz UARFZBPMPFHTKU-QGZVFWFLSA-N 2 0 326.484 4.388 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ccccc2)ccc1OC ZINC000182196992 1050540549 /nfs/dbraw/zinc/54/05/49/1050540549.db2.gz UARFZBPMPFHTKU-KRWDZBQOSA-N 2 0 326.484 4.388 20 0 EIADRP C[NH+]1CCN(c2cccc(Cl)c2C[NH2+]CC(C)(C)C2CCC2)CC1 ZINC001178737610 1050540622 /nfs/dbraw/zinc/54/06/22/1050540622.db2.gz WEAPRVHCXMXVAF-UHFFFAOYSA-N 2 0 349.950 4.008 20 0 EIADRP C[N@H+](CCCC[NH2+]Cc1ccc(Br)cc1Cl)C1CC1 ZINC001178873640 1050577976 /nfs/dbraw/zinc/57/79/76/1050577976.db2.gz WMGGNWYOXLKIRQ-UHFFFAOYSA-N 2 0 345.712 4.067 20 0 EIADRP CCCCOc1ccc(C[NH2+]C2CCC(C)([NH+](C)C)CC2)cc1OC ZINC001179390938 1050688581 /nfs/dbraw/zinc/68/85/81/1050688581.db2.gz NKZHVGBLRCYGGG-UHFFFAOYSA-N 2 0 348.531 4.227 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(Cl)cc1)c1cccc(OCC[NH+](C)C)c1 ZINC000152911053 1050883237 /nfs/dbraw/zinc/88/32/37/1050883237.db2.gz GCMDDNNLNVUADW-HNNXBMFYSA-N 2 0 332.875 4.131 20 0 EIADRP CCC[NH+]1CCC([N@H+](C)Cc2ccc(OC)c(C(C)(C)C)c2)CC1 ZINC001180161579 1050904901 /nfs/dbraw/zinc/90/49/01/1050904901.db2.gz ICXCIHXOUGDBLX-UHFFFAOYSA-N 2 0 332.532 4.299 20 0 EIADRP C[C@@H](C[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC001180267120 1050941126 /nfs/dbraw/zinc/94/11/26/1050941126.db2.gz OSNQAAMBLHLISM-ICSRJNTNSA-N 2 0 340.486 4.383 20 0 EIADRP C[C@H](C[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1)c1ccc(F)cc1 ZINC001180267121 1050943090 /nfs/dbraw/zinc/94/30/90/1050943090.db2.gz OSNQAAMBLHLISM-QUCCMNQESA-N 2 0 340.486 4.383 20 0 EIADRP Cc1cc(C)cc(CC[N@@H+](C)C[C@@H]2CC[NH+](Cc3ccccc3)C2)c1 ZINC001180267397 1050943165 /nfs/dbraw/zinc/94/31/65/1050943165.db2.gz VMXUOQCPDWMLPG-QHCPKHFHSA-N 2 0 336.523 4.300 20 0 EIADRP CC[NH+]1CCC(C[NH+]2CCC(CCc3ccc(C)cc3)CC2)CC1 ZINC001180369005 1050983172 /nfs/dbraw/zinc/98/31/72/1050983172.db2.gz YXUGDRMMOPUXRG-UHFFFAOYSA-N 2 0 328.544 4.372 20 0 EIADRP Cc1ccc(-c2ccc(C[NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)s2)cc1 ZINC000620109486 1051025559 /nfs/dbraw/zinc/02/55/59/1051025559.db2.gz JLZQDFKRUGVFEU-MSOLQXFVSA-N 2 0 326.509 4.440 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CCc2ccc(C)o2)ccc1OC ZINC000775373245 1051160848 /nfs/dbraw/zinc/16/08/48/1051160848.db2.gz PVZPTFOGVSWLIH-QGZVFWFLSA-N 2 0 344.499 4.332 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)C1 ZINC000775388778 1051186994 /nfs/dbraw/zinc/18/69/94/1051186994.db2.gz TVIZAXSSTPSNNB-SUMWQHHRSA-N 2 0 340.483 4.310 20 0 EIADRP C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1F)c1ccc(OCC[NH+](C)C)cc1 ZINC000153535282 1051191111 /nfs/dbraw/zinc/19/11/11/1051191111.db2.gz SJKMZIWNLFBRTP-GJZGRUSLSA-N 2 0 348.437 4.317 20 0 EIADRP C[C@H](C[NH2+]C[C@@H]1CCC[N@@H+]1C1CCCCC1)c1cc(F)cc(F)c1 ZINC001181276061 1051196385 /nfs/dbraw/zinc/19/63/85/1051196385.db2.gz IKTYXRWDARYOQY-QRWLVFNGSA-N 2 0 336.470 4.455 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@H]2CCCS2)cc1C[NH+]1CCCCC1 ZINC000775395825 1051210906 /nfs/dbraw/zinc/21/09/06/1051210906.db2.gz MKFJRVKWBZSWRZ-VQIMIIECSA-N 2 0 348.556 4.227 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCC(F)(F)F)cc1C[NH+]1CCCCC1 ZINC000775397727 1051215153 /nfs/dbraw/zinc/21/51/53/1051215153.db2.gz VQMQRPXPEBHITQ-AWEZNQCLSA-N 2 0 344.421 4.284 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc(SCC(F)(F)F)cc2)C1 ZINC000163221561 1051253200 /nfs/dbraw/zinc/25/32/00/1051253200.db2.gz QVDKKCRJVVTASO-UONOGXRCSA-N 2 0 346.462 4.333 20 0 EIADRP c1ccc([C@@H]([NH2+]CCCCC[NH+]2CCCCC2)C2CCOCC2)cc1 ZINC000775443202 1051379819 /nfs/dbraw/zinc/37/98/19/1051379819.db2.gz XPPWYKXVNRPMHU-JOCHJYFZSA-N 2 0 344.543 4.400 20 0 EIADRP C[N@@H+]1C[C@@H](C[NH2+][C@H]2CC[C@@](C)(c3ccccc3)C2)[C@H](c2ccccc2)C1 ZINC001182542185 1051636026 /nfs/dbraw/zinc/63/60/26/1051636026.db2.gz CKLFNZKYPJBNHJ-AYVPJYCDSA-N 2 0 348.534 4.432 20 0 EIADRP CC(C)C[N@@H+](Cc1ccc(Cl)c(F)c1)CC1CC[NH+](C)CC1 ZINC001175601727 1051667645 /nfs/dbraw/zinc/66/76/45/1051667645.db2.gz RURLQIBIKLNXTI-UHFFFAOYSA-N 2 0 326.887 4.279 20 0 EIADRP CCc1ccccc1C[NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000157940567 1051686863 /nfs/dbraw/zinc/68/68/63/1051686863.db2.gz CJEGJBNBHHSJRS-KRWDZBQOSA-N 2 0 326.484 4.040 20 0 EIADRP CCCC[C@H]1CCC[C@H]1[NH2+]CC1CC[NH+](Cc2ccncc2)CC1 ZINC001182783848 1051712309 /nfs/dbraw/zinc/71/23/09/1051712309.db2.gz YNGAHHOHLUMWKK-LEWJYISDSA-N 2 0 329.532 4.242 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000158103529 1051713312 /nfs/dbraw/zinc/71/33/12/1051713312.db2.gz VWGONZGOKZVIMA-KBPBESRZSA-N 2 0 346.462 4.333 20 0 EIADRP CC[C@@H](CC1CCCCC1)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC001182843366 1051714658 /nfs/dbraw/zinc/71/46/58/1051714658.db2.gz CRBIPLUDKHRENG-FQEVSTJZSA-N 2 0 336.564 4.216 20 0 EIADRP CCC1([NH+]2CCCCC2)CC[NH+](CCCOCc2ccccc2)CC1 ZINC001175757606 1051771720 /nfs/dbraw/zinc/77/17/20/1051771720.db2.gz FDGDJJNWVDULGF-UHFFFAOYSA-N 2 0 344.543 4.324 20 0 EIADRP Cc1ccc(C[C@H](C)[NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)cc1 ZINC001183281084 1051813095 /nfs/dbraw/zinc/81/30/95/1051813095.db2.gz LQUNGGYLYYEMQN-ZRCGQRJVSA-N 2 0 336.523 4.284 20 0 EIADRP C[C@@H]1CC[N@H+](Cc2ccc(SC(F)(F)F)cc2)CC[C@@H]1C[NH3+] ZINC001205618045 1051845113 /nfs/dbraw/zinc/84/51/13/1051845113.db2.gz QWIXBGCGQDSBAQ-TZMCWYRMSA-N 2 0 332.435 4.105 20 0 EIADRP C[C@@H]1CC[N@H+](Cc2ccc(SC(F)(F)F)cc2)CC[C@H]1C[NH3+] ZINC001205618044 1051845714 /nfs/dbraw/zinc/84/57/14/1051845714.db2.gz QWIXBGCGQDSBAQ-OCCSQVGLSA-N 2 0 332.435 4.105 20 0 EIADRP CC(C)(C)OC[C@H]1CCC[N@@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001176007763 1051871755 /nfs/dbraw/zinc/87/17/55/1051871755.db2.gz AQBCARMUXZKQAD-OAQYLSRUSA-N 2 0 344.543 4.452 20 0 EIADRP Cc1nc(-c2ccc(CC[NH2+][C@@H]3C[C@H](C)[N@@H+](C)C[C@@H]3C)s2)cs1 ZINC000164469619 1052032036 /nfs/dbraw/zinc/03/20/36/1052032036.db2.gz WFPMFNCRTBEFOW-HEHGZKQESA-N 2 0 349.569 4.041 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cc(Cl)sc1Cl ZINC000165983800 1052081943 /nfs/dbraw/zinc/08/19/43/1052081943.db2.gz LIEQRJFOGNGPEY-WDEREUQCSA-N 2 0 339.332 4.062 20 0 EIADRP CC1CC[NH+](CCCC[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)CC1 ZINC000166174047 1052086617 /nfs/dbraw/zinc/08/66/17/1052086617.db2.gz SLEGEPRBBNLSNZ-IRLDBZIGSA-N 2 0 344.543 4.256 20 0 EIADRP C[C@H](CCc1ccco1)[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000379903732 1052565055 /nfs/dbraw/zinc/56/50/55/1052565055.db2.gz IIFFGIZEADSVOW-GGPKGHCWSA-N 2 0 326.484 4.101 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC1 ZINC000671298591 1052590881 /nfs/dbraw/zinc/59/08/81/1052590881.db2.gz RNQHKZKSIOUJQD-MSOLQXFVSA-N 2 0 338.417 4.193 20 0 EIADRP CC1CC[NH+](Cc2ccccc2C[NH2+]Cc2cccc3n[nH]cc32)CC1 ZINC000623358267 1052630897 /nfs/dbraw/zinc/63/08/97/1052630897.db2.gz WFSMHQUQSRPWJH-UHFFFAOYSA-N 2 0 348.494 4.085 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]Cc2cccc3n[nH]cc32)C1 ZINC000623357956 1052631377 /nfs/dbraw/zinc/63/13/77/1052631377.db2.gz IXFVMUTVALEXQW-KRWDZBQOSA-N 2 0 348.494 4.085 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccc(CN[C@@H]2CC[NH+](C)C(C)(C)C2)cc1 ZINC000623357196 1052634529 /nfs/dbraw/zinc/63/45/29/1052634529.db2.gz BZJDZANHKHMQGR-WIYYLYMNSA-N 3 0 343.559 4.023 20 0 EIADRP CC(C)Oc1ccc(CC[C@H](C)[NH2+][C@@H]2CC[N@H+](C)C(C)(C)C2)cc1 ZINC000623363358 1052635677 /nfs/dbraw/zinc/63/56/77/1052635677.db2.gz PTOYWPKJNXCLKN-PKOBYXMFSA-N 2 0 332.532 4.257 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(Cl)s1)c1cccc(OCC[NH+](C)C)c1 ZINC000177861122 1052692693 /nfs/dbraw/zinc/69/26/93/1052692693.db2.gz GRBLIHIMUHVPKG-ZDUSSCGKSA-N 2 0 338.904 4.193 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCc3cc(F)ccc32)c1 ZINC000177976572 1052695454 /nfs/dbraw/zinc/69/54/54/1052695454.db2.gz TVCWEEAWNAOCIK-OAQYLSRUSA-N 2 0 326.459 4.443 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cc1 ZINC000177979578 1052695782 /nfs/dbraw/zinc/69/57/82/1052695782.db2.gz GNMBLPKJDXSOGW-KRWDZBQOSA-N 2 0 326.484 4.386 20 0 EIADRP C[C@H]([NH2+]Cc1cccc(Cl)c1)c1ccc(OCC[NH+](C)C)cc1 ZINC000178042542 1052696847 /nfs/dbraw/zinc/69/68/47/1052696847.db2.gz DXYPIHIIHDKVLZ-HNNXBMFYSA-N 2 0 332.875 4.131 20 0 EIADRP C[C@H]([NH2+][C@H](c1ccccc1)C1CC1)c1ccc(OCC[NH+](C)C)cc1 ZINC000178493860 1052706949 /nfs/dbraw/zinc/70/69/49/1052706949.db2.gz MBQUIRYGOZXBLS-HTAPYJJXSA-N 2 0 338.495 4.429 20 0 EIADRP C[C@H]1C[C@H](NC(c2ccc(F)cc2)c2ccc(F)cc2)CC[N@@H+]1C ZINC000178606548 1052709722 /nfs/dbraw/zinc/70/97/22/1052709722.db2.gz BVCFPAQWUIFOCA-IFXJQAMLSA-N 2 0 330.422 4.127 20 0 EIADRP C[C@@H]([NH2+]CCCC[NH+]1CCN(c2ccccc2)CC1)c1cccs1 ZINC000178698539 1052711627 /nfs/dbraw/zinc/71/16/27/1052711627.db2.gz PGDGIGPXNNMYNO-GOSISDBHSA-N 2 0 343.540 4.001 20 0 EIADRP CC(C)OCCCC[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC000180463455 1052800630 /nfs/dbraw/zinc/80/06/30/1052800630.db2.gz UREQFCINUUQEPT-FDFHNCONSA-N 2 0 344.543 4.082 20 0 EIADRP Clc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000623861234 1052824427 /nfs/dbraw/zinc/82/44/27/1052824427.db2.gz SJGQZRZFOOYSFG-DJJJIMSYSA-N 2 0 343.902 4.273 20 0 EIADRP c1csc(C[NH+]2CCC(C[NH2+][C@H]3CCCc4scnc43)CC2)c1 ZINC000623880524 1052829364 /nfs/dbraw/zinc/82/93/64/1052829364.db2.gz LCAQAUCOZDFZPO-INIZCTEOSA-N 2 0 347.553 4.084 20 0 EIADRP Clc1ccc2[nH]c3c(c2c1)CCC[C@H]3[NH2+][C@H]1CCc2nc[nH]c2C1 ZINC000623985994 1052844529 /nfs/dbraw/zinc/84/45/29/1052844529.db2.gz IFNFDZVLIMEYDW-YVEFUNNKSA-N 2 0 340.858 4.069 20 0 EIADRP CCOc1cccc2cc([C@H](C)[NH2+]CCC3CC[NH+](C)CC3)oc21 ZINC000181698801 1052893786 /nfs/dbraw/zinc/89/37/86/1052893786.db2.gz IIBKIMMEGCFDGU-HNNXBMFYSA-N 2 0 330.472 4.214 20 0 EIADRP Fc1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1Cl ZINC000380899479 1053047597 /nfs/dbraw/zinc/04/75/97/1053047597.db2.gz FIQRJAWLZHIJBK-QGZVFWFLSA-N 2 0 332.850 4.091 20 0 EIADRP c1c2ccncc2sc1C[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000850178440 1053081720 /nfs/dbraw/zinc/08/17/20/1053081720.db2.gz ABQNMSCADSQDRT-UHFFFAOYSA-N 2 0 329.513 4.183 20 0 EIADRP c1ccc(CC2CC[NH+](CCC[N@@H+]3CCC[C@@H](C4CC4)C3)CC2)cc1 ZINC001194806911 1053107365 /nfs/dbraw/zinc/10/73/65/1053107365.db2.gz NWYZQTHOQDFEJR-HSZRJFAPSA-N 2 0 340.555 4.453 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCCO2)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000850457046 1053233782 /nfs/dbraw/zinc/23/37/82/1053233782.db2.gz FPPOJNVWOYMCJC-QKLQHJQFSA-N 2 0 342.527 4.315 20 0 EIADRP Cc1c([C@H](C)NCCC[N@@H+]2CCCC[C@H]2C)cnn1-c1ccccc1 ZINC000764627577 1053237756 /nfs/dbraw/zinc/23/77/56/1053237756.db2.gz JKQFUUUMTAZEOM-MSOLQXFVSA-N 2 0 340.515 4.096 20 0 EIADRP FC(F)(F)c1ccccc1C[NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000385614824 1053535496 /nfs/dbraw/zinc/53/54/96/1053535496.db2.gz OOKWEDXLBCRIRO-QGZVFWFLSA-N 2 0 348.412 4.317 20 0 EIADRP CC(CC[NH2+][C@H](C)c1cscn1)CC[NH2+][C@H](C)c1cscn1 ZINC000852417844 1053576100 /nfs/dbraw/zinc/57/61/00/1053576100.db2.gz XYRKLVKXRQHMAI-ZIAGYGMSSA-N 2 0 338.546 4.017 20 0 EIADRP Fc1ccccc1C[C@H]([NH2+][C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1ccccc1 ZINC000429509931 1053619111 /nfs/dbraw/zinc/61/91/11/1053619111.db2.gz GSPVDARRPKWYRD-URVUXULASA-N 2 0 338.470 4.326 20 0 EIADRP C[C@H](CCc1cncc2ccccc21)[NH2+]C1CC[NH+](CC2CC2)CC1 ZINC000866236649 1053657856 /nfs/dbraw/zinc/65/78/56/1053657856.db2.gz BGHYAIOISUOXMT-QGZVFWFLSA-N 2 0 337.511 4.020 20 0 EIADRP CC(C)[N@@H+](C)Cc1ccccc1C[NH2+][C@H](C)CCc1cccnc1 ZINC000866233187 1053658529 /nfs/dbraw/zinc/65/85/29/1053658529.db2.gz SGRDREPNVNFFFO-GOSISDBHSA-N 2 0 325.500 4.033 20 0 EIADRP C[C@H](CCc1cncc2ccccc21)[NH2+]CCCC[N@H+](C)C1CC1 ZINC000866368858 1053706470 /nfs/dbraw/zinc/70/64/70/1053706470.db2.gz FEQKURPPEVUXQO-QGZVFWFLSA-N 2 0 325.500 4.020 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H](CCc2ccccc2)c2ccccn2)CC1 ZINC000866376911 1053709067 /nfs/dbraw/zinc/70/90/67/1053709067.db2.gz AYSILXXJGWIZHT-AOMIVXANSA-N 2 0 337.511 4.218 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+][C@H](c2ccccc2)c2ccccn2)CC1 ZINC000866467847 1053741441 /nfs/dbraw/zinc/74/14/41/1053741441.db2.gz RUTSIVSOIHKBIB-JOCHJYFZSA-N 2 0 337.511 4.271 20 0 EIADRP C[C@H](Cc1cccs1)[NH2+]C[C@@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000690007591 1053742026 /nfs/dbraw/zinc/74/20/26/1053742026.db2.gz SPBAGCJURPZFBJ-YLJYHZDGSA-N 2 0 328.525 4.181 20 0 EIADRP C[NH+](C)C1(C)CCC([NH2+][C@H](C[C@H]2CCOC2)c2ccc(F)cc2)CC1 ZINC000866518419 1053764879 /nfs/dbraw/zinc/76/48/79/1053764879.db2.gz ZLERTOVTBGAHBK-GXVGGZGZSA-N 2 0 348.506 4.146 20 0 EIADRP COc1ccc(C)cc1C[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386612532 1053802667 /nfs/dbraw/zinc/80/26/67/1053802667.db2.gz KQHGRCAASPCOBQ-ICSRJNTNSA-N 2 0 338.495 4.004 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](Cc2ccccc2F)c2ccccc2)C1 ZINC000429515150 1053852970 /nfs/dbraw/zinc/85/29/70/1053852970.db2.gz AYHXBRLUSRFHAI-UWJYYQICSA-N 2 0 326.459 4.041 20 0 EIADRP CSCC(C)(C)[NH2+]CCC[NH+]1CCC(Cc2ccccc2)CC1 ZINC001198468479 1054155155 /nfs/dbraw/zinc/15/51/55/1054155155.db2.gz WXMAJGAVEGNOKZ-UHFFFAOYSA-N 2 0 334.573 4.062 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+]Cc2ccccc2CC(F)(F)F)CC1 ZINC000624307481 1054167855 /nfs/dbraw/zinc/16/78/55/1054167855.db2.gz LPWGQGCGEYZTDX-UHFFFAOYSA-N 2 0 328.422 4.001 20 0 EIADRP Cc1nccn1C[C@H](C)C[NH2+][C@H]1CCC[C@H]1c1ccccc1Cl ZINC000542667113 1054180103 /nfs/dbraw/zinc/18/01/03/1054180103.db2.gz WYFZVZWIYUGQNX-LJHODMEESA-N 2 0 331.891 4.407 20 0 EIADRP CCC[N@H+](CC1CC(F)(F)C1)C1CCN(Cc2ccccc2)CC1 ZINC001198640488 1054215313 /nfs/dbraw/zinc/21/53/13/1054215313.db2.gz DEAOZNKHKKAKCH-UHFFFAOYSA-N 2 0 336.470 4.408 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1c(Cl)ccc2cccnc21 ZINC001198952203 1054311007 /nfs/dbraw/zinc/31/10/07/1054311007.db2.gz BYVDLPHUWAJOIW-HNNXBMFYSA-N 2 0 333.907 4.488 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@H]2CCOC3(CCCC3)C2)cc1 ZINC000872018151 1054331485 /nfs/dbraw/zinc/33/14/85/1054331485.db2.gz JCBARSOWVLHNAX-FQEVSTJZSA-N 2 0 330.516 4.110 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000872018298 1054332229 /nfs/dbraw/zinc/33/22/29/1054332229.db2.gz KBHLKIFEXKXWTI-HXUWFJFHSA-N 2 0 330.516 4.110 20 0 EIADRP CC[C@H](CCC(F)(F)F)[NH2+]CC1CCN(c2cc[nH+]cc2)CC1 ZINC000872046266 1054360384 /nfs/dbraw/zinc/36/03/84/1054360384.db2.gz GEXKVHOXGGCYMQ-OAHLLOKOSA-N 2 0 329.410 4.009 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCO[C@H](C(C)(C)C)C3)CC2)CC1 ZINC000872050702 1054362883 /nfs/dbraw/zinc/36/28/83/1054362883.db2.gz CEGGSSKSQAENAS-PCODVIEZSA-N 2 0 336.564 4.213 20 0 EIADRP CC[C@H](CCC(F)(F)F)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000872066301 1054374018 /nfs/dbraw/zinc/37/40/18/1054374018.db2.gz GWMCKXHFCUYFPH-DLBZAZTESA-N 2 0 328.422 4.219 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@@H]1CCOC(C)(C)C1 ZINC001199267675 1054375653 /nfs/dbraw/zinc/37/56/53/1054375653.db2.gz QJGWWHLOXFOBHG-FXAWDEMLSA-N 2 0 330.516 4.108 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+][C@H]1CCOC(C)(C)C1 ZINC001199267679 1054377772 /nfs/dbraw/zinc/37/77/72/1054377772.db2.gz QJGWWHLOXFOBHG-XLIONFOSSA-N 2 0 330.516 4.108 20 0 EIADRP CC(C)Cc1ncc(C[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)s1 ZINC001199319962 1054391109 /nfs/dbraw/zinc/39/11/09/1054391109.db2.gz GIRMPLDZZQFKRL-IAGOWNOFSA-N 2 0 337.577 4.189 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc(OC(F)F)c(F)c1 ZINC001199336160 1054394237 /nfs/dbraw/zinc/39/42/37/1054394237.db2.gz IDTFXUFRASPOAM-CQSZACIVSA-N 2 0 344.421 4.171 20 0 EIADRP [NH3+][C@@H](C[C@H]1CCC[N@H+](Cc2csc(C3CC3)n2)C1)C1CCCC1 ZINC000872156696 1054412947 /nfs/dbraw/zinc/41/29/47/1054412947.db2.gz LFYVEBYXQZGNLJ-KDOFPFPSSA-N 2 0 333.545 4.140 20 0 EIADRP c1cc2cc(C[NH2+]CC3CC[NH+](Cc4ccccc4)CC3)ccc2o1 ZINC001199679508 1054442910 /nfs/dbraw/zinc/44/29/10/1054442910.db2.gz YFEHVTWMBZJKAH-UHFFFAOYSA-N 2 0 334.463 4.435 20 0 EIADRP C[C@]1(CN[C@H]2CCCc3scnc32)CC[N@H+](Cc2ccccc2)C1 ZINC000858414664 1054484716 /nfs/dbraw/zinc/48/47/16/1054484716.db2.gz FWWSCRMYXDMFKV-FXAWDEMLSA-N 2 0 341.524 4.022 20 0 EIADRP Fc1cccc(/C=C\C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c1 ZINC001199883568 1054491318 /nfs/dbraw/zinc/49/13/18/1054491318.db2.gz KIFZVSBFFZIEFS-DJWKRKHSSA-N 2 0 344.499 4.402 20 0 EIADRP C[C@@H]1CCCC[C@@H]1C[NH2+]Cc1ccccc1N(C)C1CC[NH+](C)CC1 ZINC001199926916 1054498252 /nfs/dbraw/zinc/49/82/52/1054498252.db2.gz ZOVYVFJPLNGBSK-RTBURBONSA-N 2 0 343.559 4.133 20 0 EIADRP [NH3+][C@H]1C[C@H](C[NH2+][C@H]2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000873254819 1054514834 /nfs/dbraw/zinc/51/48/34/1054514834.db2.gz BFYDZOASPCSQLG-YYQUZTFQSA-N 2 0 326.406 4.059 20 0 EIADRP [NH3+][C@H]1C[C@@H](C[NH2+][C@@H](c2ccccc2Cl)c2cc(F)ccc2F)C1 ZINC000873249647 1054515113 /nfs/dbraw/zinc/51/51/13/1054515113.db2.gz BXABBKLAKAQCFZ-SRBZOADZSA-N 2 0 336.813 4.035 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]C[C@H]1C[C@H]([NH3+])C1 ZINC000873255441 1054516463 /nfs/dbraw/zinc/51/64/63/1054516463.db2.gz GXVSPYBEHLZRHW-WBIUFABUSA-N 2 0 335.904 4.160 20 0 EIADRP [NH3+][C@H]1C[C@H](C[NH2+]C2CCC(c3cccc(C(F)(F)F)c3)CC2)C1 ZINC000873259133 1054517579 /nfs/dbraw/zinc/51/75/79/1054517579.db2.gz ZVHUMDKXGIZONE-NRHLSMGISA-N 2 0 326.406 4.059 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@@H](C)C1CC[NH2+]CC1 ZINC000873271701 1054520278 /nfs/dbraw/zinc/52/02/78/1054520278.db2.gz JSWVWRXKMOMEAI-KBPBESRZSA-N 2 0 329.513 4.157 20 0 EIADRP CCNc1ccccc1C[NH2+]CC[C@@H](C)[N@H+](C)Cc1ccccc1 ZINC001200941773 1054596513 /nfs/dbraw/zinc/59/65/13/1054596513.db2.gz JMUKRTWXLCCPLB-GOSISDBHSA-N 2 0 325.500 4.119 20 0 EIADRP CC(C)CC1(C[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)CCCC1 ZINC001201035353 1054644160 /nfs/dbraw/zinc/64/41/60/1054644160.db2.gz FQEDHXBKVKTLHP-UHFFFAOYSA-N 2 0 332.532 4.323 20 0 EIADRP C[NH+](C)[C@@H]1CCC[N@H+](CCCOc2ccc3ccccc3c2)CC1 ZINC000429546259 1054723521 /nfs/dbraw/zinc/72/35/21/1054723521.db2.gz BRLIKWSJCHJCAW-HXUWFJFHSA-N 2 0 326.484 4.025 20 0 EIADRP C[C@@H]1C[C@H](CC[NH2+]Cc2cc(F)ccc2F)C[N@@H+]1Cc1ccccc1 ZINC001201492023 1054818302 /nfs/dbraw/zinc/81/83/02/1054818302.db2.gz PANQHTNAIMUPLH-AEFFLSMTSA-N 2 0 344.449 4.355 20 0 EIADRP C[NH+](C)Cc1cccc(NC2=C[C@H]3CC[C@@H](C2)[N@@H+]3Cc2ccccc2)c1 ZINC001201474612 1054827964 /nfs/dbraw/zinc/82/79/64/1054827964.db2.gz HEXACQTXISVTPF-PKTZIBPZSA-N 2 0 347.506 4.481 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+]Cc2ccc(-c3ccc(Cl)cc3)o2)CC1 ZINC001201617934 1054865553 /nfs/dbraw/zinc/86/55/53/1054865553.db2.gz JXZXASWQXKUESM-UHFFFAOYSA-N 2 0 332.875 4.422 20 0 EIADRP Cc1cc(N2CC[NH+](CCCc3ccccc3)CC2)c2ccccc2[nH+]1 ZINC001201653183 1054877547 /nfs/dbraw/zinc/87/75/47/1054877547.db2.gz XOSGFIOAQBYWSS-UHFFFAOYSA-N 2 0 345.490 4.298 20 0 EIADRP c1ccc(CCC[NH+]2CCC3(CC[N@H+](Cc4cccnc4)C3)CC2)cc1 ZINC001201662089 1054879742 /nfs/dbraw/zinc/87/97/42/1054879742.db2.gz FLNQCWJMVQWXDO-UHFFFAOYSA-N 2 0 349.522 4.002 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(C)c(F)c1 ZINC001201761781 1054899287 /nfs/dbraw/zinc/89/92/87/1054899287.db2.gz UQNQSYGWLBYXEV-NRFANRHFSA-N 2 0 344.474 4.315 20 0 EIADRP COC1CC[NH+](C2CC[NH+](CC[C@@H](C)CCC=C(C)C)CC2)CC1 ZINC001201981249 1054956637 /nfs/dbraw/zinc/95/66/37/1054956637.db2.gz LDJSSYIPQBPVMY-IBGZPJMESA-N 2 0 336.564 4.334 20 0 EIADRP Clc1ccc2sc(C[NH2+]C3CC[NH+](C4CCC4)CC3)cc2n1 ZINC000876973041 1054991405 /nfs/dbraw/zinc/99/14/05/1054991405.db2.gz VXVMZMIPMPXPLR-UHFFFAOYSA-N 2 0 335.904 4.056 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)Cc1ccc2cc[nH]c2c1 ZINC000862324736 1055049267 /nfs/dbraw/zinc/04/92/67/1055049267.db2.gz UGDNLLLVSHYCAG-UHFFFAOYSA-N 2 0 348.494 4.301 20 0 EIADRP Cc1cc([NH+]2CCCCCC2)ccc1N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000671766318 1055072052 /nfs/dbraw/zinc/07/20/52/1055072052.db2.gz CWVSLAHOOGJBMC-RTBURBONSA-N 2 0 327.516 4.414 20 0 EIADRP COc1ccc2cc(C[NH2+]CC(C)(C)C[NH+]3CCCC3)ccc2c1 ZINC001202233693 1055109823 /nfs/dbraw/zinc/10/98/23/1055109823.db2.gz OAEHECBQICYFIQ-UHFFFAOYSA-N 2 0 326.484 4.060 20 0 EIADRP C[N@H+](Cc1cccs1)[C@@H]1CCC[C@@H]2C[NH+](CCC(F)(F)F)C[C@H]21 ZINC001202328549 1055142266 /nfs/dbraw/zinc/14/22/66/1055142266.db2.gz HNJRBGOQNWHGLN-FVQBIDKESA-N 2 0 346.462 4.233 20 0 EIADRP C[N@H+](CCCC(F)(F)F)CC1CC[NH+](Cc2ccccc2)CC1 ZINC001202433326 1055183832 /nfs/dbraw/zinc/18/38/32/1055183832.db2.gz MPFSEVYUWYGEMC-UHFFFAOYSA-N 2 0 328.422 4.173 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1cn(C(F)F)c2ccccc12 ZINC000863546106 1055227212 /nfs/dbraw/zinc/22/72/12/1055227212.db2.gz JKIZTMMDQIPBSC-GFCCVEGCSA-N 2 0 344.409 4.049 20 0 EIADRP C/C(=C\c1cccc(C(F)(F)F)c1)C[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655825138 1055680169 /nfs/dbraw/zinc/68/01/69/1055680169.db2.gz YEZKUDMCLTXVNU-WXQBEPBSSA-N 2 0 326.406 4.039 20 0 EIADRP Cc1nc(C)c([C@H](C)[NH2+]C[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)s1 ZINC000379737955 1060259989 /nfs/dbraw/zinc/25/99/89/1060259989.db2.gz CRMVDNLARQSITM-MGPUTAFESA-N 2 0 343.540 4.323 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2cnccc2c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000388982831 1060280186 /nfs/dbraw/zinc/28/01/86/1060280186.db2.gz RCJPPVGROIXVEJ-WZONZLPQSA-N 2 0 345.490 4.235 20 0 EIADRP c1ccc(C[C@@H]([NH2+]C2CCC([NH+]3CCCCC3)CC2)C2CC2)cc1 ZINC000766510299 1060424234 /nfs/dbraw/zinc/42/42/34/1060424234.db2.gz GKRTZWDUMPGKGR-LZBANZJXSA-N 2 0 326.528 4.394 20 0 EIADRP C[C@H]1CCCC[C@H]1C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC001168825266 1060431413 /nfs/dbraw/zinc/43/14/13/1060431413.db2.gz HRUOHJMONODKKW-ICSRJNTNSA-N 2 0 329.532 4.446 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1ccc2c(c1)COC2 ZINC000766513035 1060482331 /nfs/dbraw/zinc/48/23/31/1060482331.db2.gz OJGMIJQJLCSGAW-ATIQYGATSA-N 2 0 328.500 4.165 20 0 EIADRP COc1ccc(CC[C@H](C)[NH2+]C2CCC([NH+]3CCCCC3)CC2)cc1 ZINC000766512517 1060488349 /nfs/dbraw/zinc/48/83/49/1060488349.db2.gz LQNJRLXOMRLJMU-PELRDEGISA-N 2 0 344.543 4.403 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CCc1ccc(CCc3ccccc3)cc1)C2 ZINC001169124002 1060649620 /nfs/dbraw/zinc/64/96/20/1060649620.db2.gz OZRFIQSMOIIFSG-BKFWDETESA-N 2 0 348.534 4.229 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CC[C@H](c3ccc(Cl)c(Cl)c3)C1)C2 ZINC001169147033 1060666248 /nfs/dbraw/zinc/66/62/48/1060666248.db2.gz RMUHRKPLVPREKM-JONQDZQNSA-N 2 0 339.310 4.408 20 0 EIADRP C[N@@H+]1CC[C@H](c2ccc(N[C@@H]3CC(C)(C)C[C@](C)(C[NH3+])C3)cc2)C1 ZINC001169148770 1060668080 /nfs/dbraw/zinc/66/80/80/1060668080.db2.gz ZYHNFNMFNAQZES-FBBABVLZSA-N 2 0 329.532 4.061 20 0 EIADRP CC[NH+]1CCC([NH2+]CC2(Cc3cccc(C(F)(F)F)c3)CC2)CC1 ZINC001169240538 1060713927 /nfs/dbraw/zinc/71/39/27/1060713927.db2.gz KZXSOKMDTWZJTA-UHFFFAOYSA-N 2 0 340.433 4.102 20 0 EIADRP CC[NH+]1CCC([NH2+]CC(C)(C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC001169241859 1060716791 /nfs/dbraw/zinc/71/67/91/1060716791.db2.gz QKRKQQJLTUFWNR-UHFFFAOYSA-N 2 0 342.449 4.348 20 0 EIADRP C[C@@H]1C[N@H+](Cc2cc(Cl)cc(Cl)c2Cl)CCC[C@H]1C[NH3+] ZINC001206013210 1060863418 /nfs/dbraw/zinc/86/34/18/1060863418.db2.gz QIVIPSVBQFYZPO-MNOVXSKESA-N 2 0 335.706 4.454 20 0 EIADRP Cc1nc(C[N@H+]2CCCC3(CC[NH+](C)CC3)C2)sc1C(C)(C)C ZINC001169782253 1060964491 /nfs/dbraw/zinc/96/44/91/1060964491.db2.gz YBVJQCCJKUTNMG-UHFFFAOYSA-N 2 0 335.561 4.057 20 0 EIADRP CCC[C@]1(COC)CCC[N@@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001169780628 1060965692 /nfs/dbraw/zinc/96/56/92/1060965692.db2.gz OKHLTRJELCJOND-JOCHJYFZSA-N 2 0 344.543 4.454 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2cc3ccccc3nc2Cl)CC1 ZINC000766993543 1061071619 /nfs/dbraw/zinc/07/16/19/1061071619.db2.gz YIPGOBUOFVBEBW-UHFFFAOYSA-N 2 0 345.918 4.442 20 0 EIADRP C[NH+](C)CCOc1cccc(C[NH2+][C@H]2CCc3c2cccc3Cl)c1 ZINC000532211060 1032092295 /nfs/dbraw/zinc/09/22/95/1032092295.db2.gz JTGSBLUXXDKJFN-FQEVSTJZSA-N 2 0 344.886 4.058 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000509668912 1032270069 /nfs/dbraw/zinc/27/00/69/1032270069.db2.gz FGTXXFXLUJCMRI-AQTBWJFISA-N 2 0 338.495 4.088 20 0 EIADRP C[C@H](Cc1ccc(Cl)cc1)[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC001168152287 1032405585 /nfs/dbraw/zinc/40/55/85/1032405585.db2.gz OCRXZNDDFAKPPJ-MRXNPFEDSA-N 2 0 346.902 4.001 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)cc1 ZINC000120743448 1032413202 /nfs/dbraw/zinc/41/32/02/1032413202.db2.gz NETRYIDIIARNPJ-IFMALSPDSA-N 2 0 338.495 4.006 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)CC1(C)C)C1CC(F)(F)C1 ZINC000529556102 1032451690 /nfs/dbraw/zinc/45/16/90/1032451690.db2.gz JTQAXXBMAOOBNC-MAUKXSAKSA-N 2 0 336.470 4.311 20 0 EIADRP C[C@@H]1C[N@@H+](CCCC[NH2+]Cc2ccc(C(C)(C)C)s2)C[C@H](C)O1 ZINC000533200164 1032543790 /nfs/dbraw/zinc/54/37/90/1032543790.db2.gz MSLORNNIHLLARD-IYBDPMFKSA-N 2 0 338.561 4.025 20 0 EIADRP CCC1(C[NH2+]CC[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CCOCC1 ZINC000512396970 1032664681 /nfs/dbraw/zinc/66/46/81/1032664681.db2.gz XVRRFJOWCCLKSY-CTNGQTDRSA-N 2 0 344.543 4.084 20 0 EIADRP CCCCOc1ccc([C@@H](C)[NH2+][C@H]2CC[NH2+]C3(CCC3)C2)cc1OC ZINC000643545864 1018893326 /nfs/dbraw/zinc/89/33/26/1018893326.db2.gz DRYHUKFHIAWWPC-AEFFLSMTSA-N 2 0 346.515 4.199 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H]1CC[NH2+]C2(CCC2)C1 ZINC000643545979 1018896179 /nfs/dbraw/zinc/89/61/79/1018896179.db2.gz GPYFHMGWGNZZQJ-YOEHRIQHSA-N 2 0 341.524 4.444 20 0 EIADRP C[N@H+](Cc1cc(-n2ccnc2)cs1)Cc1ccc(F)c(Cl)c1 ZINC000432793261 1032811585 /nfs/dbraw/zinc/81/15/85/1032811585.db2.gz OFOZRGZRTYBXTA-UHFFFAOYSA-N 2 0 335.835 4.358 20 0 EIADRP Fc1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cc1 ZINC000180104981 1020059155 /nfs/dbraw/zinc/05/91/55/1020059155.db2.gz LGIYGHUIYIOZNV-FRIKZZABSA-N 2 0 338.470 4.153 20 0 EIADRP C[NH+]1CCC2(CC1)CC[NH+](Cc1ccc(Cl)cc1Cl)CC2 ZINC001203392956 1020674255 /nfs/dbraw/zinc/67/42/55/1020674255.db2.gz PBDWRPLNVPDDGZ-UHFFFAOYSA-N 2 0 327.299 4.301 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)CC3 ZINC000180825822 1020692321 /nfs/dbraw/zinc/69/23/21/1020692321.db2.gz VPAQQQQWXGDEKB-QGZVFWFLSA-N 2 0 339.527 4.186 20 0 EIADRP CC[C@H](CC(F)(F)F)[NH2+][C@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547830238 1020774780 /nfs/dbraw/zinc/77/47/80/1020774780.db2.gz KLSCIUISJUWKSL-DJIMGWMZSA-N 2 0 328.422 4.218 20 0 EIADRP C[NH+]1CCC(CC[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)CC1 ZINC000538098142 1020877922 /nfs/dbraw/zinc/87/79/22/1020877922.db2.gz CZCNYDPTXOYGEY-SFHVURJKSA-N 2 0 340.433 4.478 20 0 EIADRP C[C@H]1CC[C@H]([NH2+]Cc2ccccc2C[N@H+](C)Cc2ccco2)CS1 ZINC000655714692 1020911991 /nfs/dbraw/zinc/91/19/91/1020911991.db2.gz AMQNEZATMXAVIC-LPHOPBHVSA-N 2 0 344.524 4.285 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000655803929 1020976628 /nfs/dbraw/zinc/97/66/28/1020976628.db2.gz IPBJWNJOXCJSIO-WCZJQEMASA-N 2 0 340.433 4.271 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@@H]2CCCc3ccc(O)cc32)C1 ZINC000340471530 1021079392 /nfs/dbraw/zinc/07/93/92/1021079392.db2.gz XWTNGHHCUSWIKV-LLGFUMIMSA-N 2 0 330.516 4.117 20 0 EIADRP Fc1cccc(Cl)c1CCC[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000683707487 1021131820 /nfs/dbraw/zinc/13/18/20/1021131820.db2.gz OWBWXWAXAXFEGD-UHFFFAOYSA-N 2 0 338.898 4.408 20 0 EIADRP C[C@@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)c1ccncc1F ZINC000340529766 1021201593 /nfs/dbraw/zinc/20/15/93/1021201593.db2.gz CYUAWLWYHWAPDO-IPJUCJBFSA-N 2 0 341.474 4.315 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1ccc2cnccc2c1 ZINC000683765483 1021381407 /nfs/dbraw/zinc/38/14/07/1021381407.db2.gz QOIIGBZGNSVNCH-UHFFFAOYSA-N 2 0 333.479 4.365 20 0 EIADRP CC[N@H+](C)Cc1cccc(CNC2CC[NH+](C3CCCCC3)CC2)c1 ZINC000123888493 1021553306 /nfs/dbraw/zinc/55/33/06/1021553306.db2.gz HZYJQOFNGHMIIM-UHFFFAOYSA-N 2 0 343.559 4.025 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@@H](c1cccc(F)c1)C(C)(C)C ZINC000422841878 1021649832 /nfs/dbraw/zinc/64/98/32/1021649832.db2.gz XAHGTZMFMGYEHR-LIRRHRJNSA-N 2 0 329.463 4.426 20 0 EIADRP Cc1cc(C[NH+]2CCC(CC[NH+](C)C)CC2)c(OC(F)F)cc1C ZINC000511477436 1021861236 /nfs/dbraw/zinc/86/12/36/1021861236.db2.gz KVZGIYAXUKGKEV-UHFFFAOYSA-N 2 0 340.458 4.069 20 0 EIADRP COc1ccc2cc(C[NH+]3CCC(CC[NH+](C)C)CC3)ccc2c1 ZINC000511489802 1021890255 /nfs/dbraw/zinc/89/02/55/1021890255.db2.gz ABIIDJGHINLPEX-UHFFFAOYSA-N 2 0 326.484 4.012 20 0 EIADRP CC[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccc(OC(F)F)cc1 ZINC000414168508 1022014816 /nfs/dbraw/zinc/01/48/16/1022014816.db2.gz AFEPZGYBROJFMW-YOEHRIQHSA-N 2 0 326.431 4.061 20 0 EIADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1csc(-c2ccccc2)n1 ZINC000414169529 1022018579 /nfs/dbraw/zinc/01/85/79/1022018579.db2.gz BGFOFIAVLFHPPW-HZPDHXFCSA-N 2 0 329.513 4.193 20 0 EIADRP COc1ccc2cc([C@@H](C)[NH2+]CC[C@@H]3CCC[N@H+](C)C3)ccc2c1 ZINC000414171313 1022024125 /nfs/dbraw/zinc/02/41/25/1022024125.db2.gz DFFQWXZJZKMYHY-SJORKVTESA-N 2 0 326.484 4.231 20 0 EIADRP CC[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccccc1OC(F)F ZINC000414172932 1022029361 /nfs/dbraw/zinc/02/93/61/1022029361.db2.gz FUCDELJDGFKITB-HOCLYGCPSA-N 2 0 326.431 4.061 20 0 EIADRP COc1ccc([C@@H]([NH2+]CC[C@H]2CCC[N@H+](C)C2)c2ccccc2)cc1 ZINC000414199431 1022105931 /nfs/dbraw/zinc/10/59/31/1022105931.db2.gz XAUHQFMPDFKMPA-GCJKJVERSA-N 2 0 338.495 4.106 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1)c1cncs1 ZINC000155768508 1022139767 /nfs/dbraw/zinc/13/97/67/1022139767.db2.gz DWCCRZDBAOPXLF-HOTGVXAUSA-N 2 0 329.513 4.226 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)cnc1F ZINC000892572157 1022234939 /nfs/dbraw/zinc/23/49/39/1022234939.db2.gz UKLKAIVBOOMIFV-QGZVFWFLSA-N 2 0 341.474 4.193 20 0 EIADRP Cc1cc(F)ncc1C[NH2+]Cc1ccccc1C[N@H+]1CCCC[C@H]1C ZINC000892580270 1022313571 /nfs/dbraw/zinc/31/35/71/1022313571.db2.gz ILYADIVFSWCELC-QGZVFWFLSA-N 2 0 341.474 4.193 20 0 EIADRP CCC[N@@H+]1CC[C@H](CNCc2ccc(-c3ccccc3Cl)o2)C1 ZINC000236810962 1022491155 /nfs/dbraw/zinc/49/11/55/1022491155.db2.gz LDAIZSBXTCCVEG-OAHLLOKOSA-N 2 0 332.875 4.422 20 0 EIADRP COc1cccc([C@@H]2C[C@H]2C[NH2+]C2CC[NH+](C3CCCCC3)CC2)c1 ZINC000414335689 1022606132 /nfs/dbraw/zinc/60/61/32/1022606132.db2.gz HPTHYBXMCISFOW-AVRDEDQJSA-N 2 0 342.527 4.185 20 0 EIADRP Cc1ccc(CC[NH2+]C2CCN([C@H](C)c3ccncc3)CC2)cc1C ZINC000893201409 1022669699 /nfs/dbraw/zinc/66/96/99/1022669699.db2.gz UYFDQOYFUWOXFH-LJQANCHMSA-N 2 0 337.511 4.056 20 0 EIADRP FC(F)(F)CCC[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000374437439 1022760807 /nfs/dbraw/zinc/76/08/07/1022760807.db2.gz PQRJFVMVEGQDFJ-ALOPSCKCSA-N 2 0 326.406 4.114 20 0 EIADRP COc1ccccc1[C@@H](C)[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000311058171 1022819865 /nfs/dbraw/zinc/81/98/65/1022819865.db2.gz WIHIIKPSQURYFO-QUCCMNQESA-N 2 0 338.495 4.258 20 0 EIADRP C[C@@H]1CCC[N@@H+]1C1CC[NH+](CC2CCC(C(F)(F)F)CC2)CC1 ZINC000376499000 1022846483 /nfs/dbraw/zinc/84/64/83/1022846483.db2.gz CIRUGPXFRVZHJM-QQFBHYJXSA-N 2 0 332.454 4.304 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+][C@@H](C)c2cnn(C3CCC3)c2)cc1 ZINC000924585744 1022964547 /nfs/dbraw/zinc/96/45/47/1022964547.db2.gz QUIROTRPSLSECX-KRWDZBQOSA-N 2 0 340.515 4.301 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CC2(OC)CCC(c3ccccc3)CC2)[C@@H](C)C1 ZINC000581292420 1022969532 /nfs/dbraw/zinc/96/95/32/1022969532.db2.gz HVJXTFYSGNRFTE-YOLZPYMBSA-N 2 0 344.543 4.049 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]CC2(OC)CCC(c3ccccc3)CC2)[C@@H](C)C1 ZINC000581292419 1022971690 /nfs/dbraw/zinc/97/16/90/1022971690.db2.gz HVJXTFYSGNRFTE-PMJAUZGISA-N 2 0 344.543 4.049 20 0 EIADRP Cn1ccnc1C[C@@H]([NH2+]CCc1cccc(Cl)c1)c1ccccc1 ZINC000656503603 1023075171 /nfs/dbraw/zinc/07/51/71/1023075171.db2.gz OZAPBAXWLHWTEX-LJQANCHMSA-N 2 0 339.870 4.190 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1cncs1 ZINC000156186549 1023115837 /nfs/dbraw/zinc/11/58/37/1023115837.db2.gz SFOQRWXVGBYLHK-CVEARBPZSA-N 2 0 329.513 4.368 20 0 EIADRP Cc1nccn1-c1ccc([C@H](C)[NH2+][C@@H]2CCN(c3ccccc3)C2)cc1 ZINC000153856877 1023347641 /nfs/dbraw/zinc/34/76/41/1023347641.db2.gz AURFVGHRHOUMBD-FXAWDEMLSA-N 2 0 346.478 4.110 20 0 EIADRP Cc1ccc(-c2ncc(C[N@@H+]3CCCC[C@H]3[C@@H]3CC[NH2+]C3)s2)cc1 ZINC000415038597 1023403478 /nfs/dbraw/zinc/40/34/78/1023403478.db2.gz IABAIWHEXITKRM-MJGOQNOKSA-N 2 0 341.524 4.083 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 ZINC000415040643 1023405306 /nfs/dbraw/zinc/40/53/06/1023405306.db2.gz PAUSTLLBVYWYPS-ZCPGHIKRSA-N 2 0 326.406 4.059 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1cc(C(F)(F)F)ccc1F)c1ccccc1 ZINC000415046651 1023407660 /nfs/dbraw/zinc/40/76/60/1023407660.db2.gz CYWNWLYAMSGPAQ-KRWDZBQOSA-N 2 0 340.364 4.414 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1ccc(C(F)(F)F)s1)c1ccccc1 ZINC000415049965 1023408737 /nfs/dbraw/zinc/40/87/37/1023408737.db2.gz HYUUPUUAQRPHTG-CQSZACIVSA-N 2 0 328.403 4.337 20 0 EIADRP Cc1ccc(-c2ncc(C[NH2+][C@H](CCC[NH3+])c3ccccc3)s2)o1 ZINC000415044762 1023409240 /nfs/dbraw/zinc/40/92/40/1023409240.db2.gz BCMPDNRTZDOLJV-QGZVFWFLSA-N 2 0 341.480 4.281 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cccc(Br)c1)c1ccccc1 ZINC000415069670 1023420745 /nfs/dbraw/zinc/42/07/45/1023420745.db2.gz SZQKCPBDKOBMLI-QGZVFWFLSA-N 2 0 333.273 4.019 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc2c(c1)CCC2 ZINC000656683463 1023430326 /nfs/dbraw/zinc/43/03/26/1023430326.db2.gz LVJUVNMRJUBZAW-GOSISDBHSA-N 2 0 349.522 4.133 20 0 EIADRP [NH3+]C1CCC([NH2+]C[C@H]2CC3c4ccccc4C2c2ccccc23)CC1 ZINC000415111535 1023446779 /nfs/dbraw/zinc/44/67/79/1023446779.db2.gz RBWVMQGJRBLIFH-IEFFEPDGSA-N 2 0 332.491 4.143 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2n[nH]cc2c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000570946462 1023486532 /nfs/dbraw/zinc/48/65/32/1023486532.db2.gz VMCYSDRZIPSCBG-SQGPQFPESA-N 2 0 348.494 4.124 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+]Cc2ccccc2N2CCCCC2)c1 ZINC000893330100 1023488977 /nfs/dbraw/zinc/48/89/77/1023488977.db2.gz HADZCAYRFUBSHE-UHFFFAOYSA-N 2 0 337.511 4.028 20 0 EIADRP [NH3+]C1(C[NH2+][C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CCCC1 ZINC000656789501 1023537139 /nfs/dbraw/zinc/53/71/39/1023537139.db2.gz OYNDRTFMDQLHBX-JKSUJKDBSA-N 2 0 326.406 4.203 20 0 EIADRP COc1ccsc1[C@H](C)[NH2+]C[C@@H]1CC[N@H+](C)[C@@H]1c1ccccc1 ZINC000364312265 1023605255 /nfs/dbraw/zinc/60/52/55/1023605255.db2.gz BTBQEGLLVHVWBE-QILLFSRXSA-N 2 0 330.497 4.100 20 0 EIADRP CC[NH+](CC)Cc1cc(OC)ccc1NCCC[N@@H+]1CCCC[C@H]1C ZINC001167753919 1023634049 /nfs/dbraw/zinc/63/40/49/1023634049.db2.gz MNUVOSBNUYFTQS-GOSISDBHSA-N 2 0 347.547 4.213 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCNc1ccc(SC2CC[NH2+]CC2)cc1 ZINC001167755032 1023640480 /nfs/dbraw/zinc/64/04/80/1023640480.db2.gz YZGHKSBOAQRRKD-KRWDZBQOSA-N 2 0 347.572 4.207 20 0 EIADRP C[C@@H](N[C@H]1CC[N@H+](Cc2ccccc2)CC1(C)C)c1ccc(F)cn1 ZINC000390564571 1023681620 /nfs/dbraw/zinc/68/16/20/1023681620.db2.gz ALDANMRGYVSNQA-UZLBHIALSA-N 2 0 341.474 4.172 20 0 EIADRP Cc1cc(F)ccc1-c1ccc(CN[C@@H]2CC[N@@H+]3CCC[C@H]3C2)o1 ZINC000377750838 1023741832 /nfs/dbraw/zinc/74/18/32/1023741832.db2.gz WTCJWEDELPJKBG-SJORKVTESA-N 2 0 328.431 4.111 20 0 EIADRP c1ccc(C[N@H+]2CC[C@H](C[NH2+][C@@H]3CCC[C@@H](c4cccnc4)C3)C2)cc1 ZINC000500382547 1023770188 /nfs/dbraw/zinc/77/01/88/1023770188.db2.gz HQVZFYDPXTVPIL-MQSCRBSSSA-N 2 0 349.522 4.220 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[NH+]1CCCCCC1)c1cnn(C)c1 ZINC000164176375 1023776278 /nfs/dbraw/zinc/77/62/78/1023776278.db2.gz HLDNETSCVZPAGE-NRFANRHFSA-N 2 0 340.515 4.037 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CCCOc2ccc(Cl)cc2Cl)[C@H](C)C1 ZINC000468851336 1023995323 /nfs/dbraw/zinc/99/53/23/1023995323.db2.gz FOXFAKNTJGTJHV-CJNGLKHVSA-N 2 0 345.314 4.082 20 0 EIADRP FC1(F)CC[C@H](C[NH2+][C@@H]2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@H]32)C1 ZINC000430750924 1024007507 /nfs/dbraw/zinc/00/75/07/1024007507.db2.gz QOJRTGZZCGJBAI-MTQWCTHYSA-N 2 0 348.481 4.312 20 0 EIADRP Cc1c([C@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)cnn1C(C)(C)C ZINC000468889567 1024211673 /nfs/dbraw/zinc/21/16/73/1024211673.db2.gz JXMHIHBFPKQUGA-KRWDZBQOSA-N 2 0 348.579 4.355 20 0 EIADRP c1c2cnccc2oc1C[NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000651692106 1024219805 /nfs/dbraw/zinc/21/98/05/1024219805.db2.gz SWZQDHSOZXILKP-UHFFFAOYSA-N 2 0 349.478 4.494 20 0 EIADRP C[C@@H](CCc1c(F)cccc1F)[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000510750059 1024392201 /nfs/dbraw/zinc/39/22/01/1024392201.db2.gz LBFUXINEVUZRLL-HNNXBMFYSA-N 2 0 336.470 4.283 20 0 EIADRP CCc1cnccc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000548481305 1024825210 /nfs/dbraw/zinc/82/52/10/1024825210.db2.gz MWFKQSDJOWAXQU-BBTUJRGHSA-N 2 0 337.511 4.205 20 0 EIADRP CC(C)(CC[NH+]1CCCCCC1)[NH2+]Cc1ccnc2ccccc12 ZINC000548484248 1024831441 /nfs/dbraw/zinc/83/14/41/1024831441.db2.gz NPKKETBGMCKXQT-UHFFFAOYSA-N 2 0 325.500 4.369 20 0 EIADRP Fc1cccc(Cl)c1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000063551919 1024937568 /nfs/dbraw/zinc/93/75/68/1024937568.db2.gz LQTUJMWYEFHOGI-UHFFFAOYSA-N 2 0 346.877 4.481 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cccc(-c3cccnc3)c2)CC1 ZINC000535813089 1024959809 /nfs/dbraw/zinc/95/98/09/1024959809.db2.gz BAHSKKUKSPTLIE-UHFFFAOYSA-N 2 0 337.511 4.301 20 0 EIADRP Clc1ccc([C@H]([NH2+]Cc2cccc3c2CC[NH2+]C3)C2CC2)cc1 ZINC000662281995 1025029037 /nfs/dbraw/zinc/02/90/37/1025029037.db2.gz NFWMTIJDWRIWBQ-HXUWFJFHSA-N 2 0 326.871 4.227 20 0 EIADRP CC[C@H]([NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1)C(C)C ZINC000342005166 1025032614 /nfs/dbraw/zinc/03/26/14/1025032614.db2.gz QDEVZFCPGCDDPA-NRFANRHFSA-N 2 0 332.532 4.082 20 0 EIADRP C[C@@H](c1ccc(OC(F)F)cc1)[NH+]1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000662294959 1025043414 /nfs/dbraw/zinc/04/34/14/1025043414.db2.gz XKNDRCZHXSRYSK-WMLDXEAASA-N 2 0 338.442 4.061 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H](C)c2ccccc2C(C)(C)C)CC1 ZINC000535838444 1025103368 /nfs/dbraw/zinc/10/33/68/1025103368.db2.gz RWOXDENBKJNLGX-KRWDZBQOSA-N 2 0 332.532 4.136 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(F)cc1F ZINC000162568579 1025156927 /nfs/dbraw/zinc/15/69/27/1025156927.db2.gz GNBGVCFYDYEQLT-HXUWFJFHSA-N 2 0 348.437 4.146 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1ccc(F)cc1 ZINC000162585988 1025160182 /nfs/dbraw/zinc/16/01/82/1025160182.db2.gz QVBLUBKEUBGELE-HXUWFJFHSA-N 2 0 330.447 4.007 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)CC(F)(F)F)c1cccc(OCC[NH+](C)C)c1 ZINC000663477750 1025454384 /nfs/dbraw/zinc/45/43/84/1025454384.db2.gz HUTZRGXVEGWCQU-AWEZNQCLSA-N 2 0 346.437 4.256 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@H]1c1ccc(OC)c(OC)c1 ZINC001167825459 1025602486 /nfs/dbraw/zinc/60/24/86/1025602486.db2.gz JHQOVICCIUBRFH-HKUYNNGSSA-N 2 0 348.531 4.351 20 0 EIADRP Cc1ccc2[nH]c(C[NH2+]C3CC[NH+](C4CCCC4)CC3)cc2c1C ZINC000472073341 1025645347 /nfs/dbraw/zinc/64/53/47/1025645347.db2.gz LWCXMKOVHMWOEL-UHFFFAOYSA-N 2 0 325.500 4.281 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](N[C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)C1 ZINC000643524153 1025677484 /nfs/dbraw/zinc/67/74/84/1025677484.db2.gz QLGZEWXEDHDCHO-RZUBCFFCSA-N 2 0 349.453 4.323 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000415010699 1025827369 /nfs/dbraw/zinc/82/73/69/1025827369.db2.gz GPEIWXWSJJBFFU-XYPHTWIQSA-N 2 0 328.422 4.449 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccccc1 ZINC000415011384 1025846364 /nfs/dbraw/zinc/84/63/64/1025846364.db2.gz HQNQGUKPGUHBOB-SFHVURJKSA-N 2 0 348.494 4.146 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1ccc(OC(F)(F)F)cc1)c1ccccc1 ZINC000415059607 1025863349 /nfs/dbraw/zinc/86/33/49/1025863349.db2.gz VBYXOXRQVGSMSS-KRWDZBQOSA-N 2 0 338.373 4.155 20 0 EIADRP C[C@H]([NH2+]CCC[N@@H+]1CCCO[C@H](C)C1)c1ccc(OC(C)(C)C)cc1 ZINC000432409158 1025878533 /nfs/dbraw/zinc/87/85/33/1025878533.db2.gz FGQFWCAWVCEDBS-MSOLQXFVSA-N 2 0 348.531 4.015 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[N@@H+]1CCC[C@H](Cc2cccc(OC)c2)C1 ZINC001167841622 1025885926 /nfs/dbraw/zinc/88/59/26/1025885926.db2.gz NEKYNVCMKZZVFX-PZJWPPBQSA-N 2 0 346.559 4.460 20 0 EIADRP COc1cccc([C@@H]2C[C@@H](C)C[N@@H+]2CCCCn2ccnc2C)c1 ZINC000344034482 1025889777 /nfs/dbraw/zinc/88/97/77/1025889777.db2.gz FASLQLGNNBFDKQ-UZLBHIALSA-N 2 0 327.472 4.063 20 0 EIADRP CC(C)(C)OC1CC(CC[NH2+]C2CC[NH+](C3CCCCC3)CC2)C1 ZINC000432420386 1025897610 /nfs/dbraw/zinc/89/76/10/1025897610.db2.gz KLKXEFUZGUYULA-UHFFFAOYSA-N 2 0 336.564 4.357 20 0 EIADRP C[C@@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1ccc(OC(F)F)cc1 ZINC000319789733 1025965131 /nfs/dbraw/zinc/96/51/31/1025965131.db2.gz HRIUYHHKZPACEA-OAHLLOKOSA-N 2 0 326.431 4.061 20 0 EIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@H](c2ccc(F)cc2)C2CCCC2)CCCO1 ZINC000432433116 1025972575 /nfs/dbraw/zinc/97/25/75/1025972575.db2.gz ZORANQBABCGQMQ-UTKZUKDTSA-N 2 0 348.506 4.148 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]Cc1ccnn1-c1ccccc1 ZINC000279123746 1026113189 /nfs/dbraw/zinc/11/31/89/1026113189.db2.gz LYCNKMOEPJWYOI-UHFFFAOYSA-N 2 0 348.494 4.002 20 0 EIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(Oc2cccnc2)cc1 ZINC000894521698 1026122712 /nfs/dbraw/zinc/12/27/12/1026122712.db2.gz ZYQGRPBNQJSYJC-BPIHKTFHSA-N 2 0 337.467 4.150 20 0 EIADRP c1c2ccncc2sc1C[NH2+]C1CC[NH+](CC2CCCC2)CC1 ZINC000657336636 1026156528 /nfs/dbraw/zinc/15/65/28/1026156528.db2.gz WAALNQFOACAJIX-UHFFFAOYSA-N 2 0 329.513 4.041 20 0 EIADRP C[N@@H+](Cc1ccccc1)CC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000072097767 1026217774 /nfs/dbraw/zinc/21/77/74/1026217774.db2.gz SBFHMOFUFYYPSU-UHFFFAOYSA-N 2 0 326.459 4.170 20 0 EIADRP Cc1cccc2[nH]c(C[NH2+]C3CC[NH+](C4CCCCC4)CC3)cc21 ZINC000657382896 1026395263 /nfs/dbraw/zinc/39/52/63/1026395263.db2.gz FXCDKSLOZKDXAC-UHFFFAOYSA-N 2 0 325.500 4.363 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cnc(-c3ccsc3)s2)CC1 ZINC000506863587 1026482176 /nfs/dbraw/zinc/48/21/76/1026482176.db2.gz XKHINJDGVCZISI-UHFFFAOYSA-N 2 0 349.569 4.425 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cc(Br)cs2)CC1 ZINC000506881701 1026485077 /nfs/dbraw/zinc/48/50/77/1026485077.db2.gz QOGANQPPCFOTHO-UHFFFAOYSA-N 2 0 345.350 4.064 20 0 EIADRP c1ccc2sc(CC[NH2+]C3CC[NH+](C4CCCCC4)CC3)nc2c1 ZINC000582387909 1026550988 /nfs/dbraw/zinc/55/09/88/1026550988.db2.gz RFGICODPZONIRR-UHFFFAOYSA-N 2 0 343.540 4.226 20 0 EIADRP CCC[C@H]1CC[C@H](c2ccc(NC(=[NH2+])NCCCC[NH3+])cc2)CC1 ZINC001167879078 1026551026 /nfs/dbraw/zinc/55/10/26/1026551026.db2.gz RVFPCJZVOWHIQX-QAQDUYKDSA-N 2 0 330.520 4.436 20 0 EIADRP CC1CCC([NH2+]CCCOC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC000344711880 1026555373 /nfs/dbraw/zinc/55/53/73/1026555373.db2.gz OOBQIUICUKSUQR-UHFFFAOYSA-N 2 0 344.543 4.226 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCC2)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000512318485 1026687622 /nfs/dbraw/zinc/68/76/22/1026687622.db2.gz PSCVPWZULWJPBL-CSODHUTKSA-N 2 0 326.528 4.479 20 0 EIADRP Fc1ccccc1CN(Cc1ccsc1)[C@@H]1CC12CC[NH2+]CC2 ZINC000432664768 1026689796 /nfs/dbraw/zinc/68/97/96/1026689796.db2.gz OJFKBVJKTJCGAA-GOSISDBHSA-N 2 0 330.472 4.032 20 0 EIADRP COCc1ccc([C@H]2CCC[N@@H+]2Cc2cc(-n3ccnc3)cs2)o1 ZINC000344898921 1026700447 /nfs/dbraw/zinc/70/04/47/1026700447.db2.gz VPUWFVKTQFFFOT-QGZVFWFLSA-N 2 0 343.452 4.010 20 0 EIADRP CC(C)n1cc([C@H](C)[NH2+]Cc2cccc(C[NH+]3CCCCC3)c2)cn1 ZINC000663807716 1026767137 /nfs/dbraw/zinc/76/71/37/1026767137.db2.gz QTOCGXWAEQYVSV-SFHVURJKSA-N 2 0 340.515 4.301 20 0 EIADRP C[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)c1ccc(OCC(F)(F)F)cc1 ZINC000507400935 1026786160 /nfs/dbraw/zinc/78/61/60/1026786160.db2.gz KJOIHCYTFCGKCN-AWEZNQCLSA-N 2 0 344.421 4.010 20 0 EIADRP c1ccc(C[N@@H+]2C[C@@H]3CC[C@H]([NH2+][C@H](c4cccnc4)C4CC4)[C@H]3C2)cc1 ZINC000507463488 1026804568 /nfs/dbraw/zinc/80/45/68/1026804568.db2.gz UCGSBTBJCOGUAY-MLCQCVOFSA-N 2 0 347.506 4.033 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+][C@@H](c2cc3ccccc3o2)c2cccnc2)CC1 ZINC000507483403 1026812671 /nfs/dbraw/zinc/81/26/71/1026812671.db2.gz RKZJLCLIGPTBCA-OAQYLSRUSA-N 2 0 349.478 4.239 20 0 EIADRP Cc1nccn1CCCCS[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000582666647 1026921456 /nfs/dbraw/zinc/92/14/56/1026921456.db2.gz XMZHRKWKBNMEPR-FQEVSTJZSA-N 2 0 343.540 4.370 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2cc(F)ccc2F)CC1 ZINC000519846786 1027017320 /nfs/dbraw/zinc/01/73/20/1027017320.db2.gz VXFVZCGLBMYZKV-UHFFFAOYSA-N 2 0 344.449 4.498 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCOC(C)(C)C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168036134 1027138063 /nfs/dbraw/zinc/13/80/63/1027138063.db2.gz UBGWQLGWIYNOKQ-YHELAOLJSA-N 2 0 344.543 4.223 20 0 EIADRP C[C@@H]1CC([NH2+]C[C@H]2CCOC(C)(C)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168036122 1027142995 /nfs/dbraw/zinc/14/29/95/1027142995.db2.gz UBGWQLGWIYNOKQ-GGPKGHCWSA-N 2 0 344.543 4.223 20 0 EIADRP Cc1cc(NC[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)c(F)c2)cc[nH+]1 ZINC000302504976 1027322033 /nfs/dbraw/zinc/32/20/33/1027322033.db2.gz WBRVNHILBAMCQG-KBXCAEBGSA-N 2 0 333.838 4.287 20 0 EIADRP CCOC[C@@H]1CCC[C@H]1[NH2+]C1CCN([C@@H](C)c2ccccc2)CC1 ZINC000474724646 1027440903 /nfs/dbraw/zinc/44/09/03/1027440903.db2.gz CLKJQMIZHQUYAM-HFSMHLIXSA-N 2 0 330.516 4.007 20 0 EIADRP CCO[P@@](C)(=O)CC[C@@H](C)[NH2+]C1CCC(C)([NH+]2CCCC2)CC1 ZINC000896387990 1027447888 /nfs/dbraw/zinc/44/78/88/1027447888.db2.gz PFPJYOXPWZBTQZ-HXPZTIBPSA-N 2 0 344.480 4.096 20 0 EIADRP Clc1ccc(CCC[N@@H+]2CC[C@H]3[C@@H](CCCN3C3CC3)C2)cc1 ZINC000441410721 1027529605 /nfs/dbraw/zinc/52/96/05/1027529605.db2.gz LTMXLAKPEYUKPX-PXNSSMCTSA-N 2 0 332.919 4.221 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1c[nH]c2cc(F)ccc21 ZINC000120826244 1027587106 /nfs/dbraw/zinc/58/71/06/1027587106.db2.gz NIGQTMFJEVWDGI-ZDUSSCGKSA-N 2 0 343.421 4.359 20 0 EIADRP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]Cc1ccc(C[NH3+])cc1 ZINC000582905797 1027648952 /nfs/dbraw/zinc/64/89/52/1027648952.db2.gz RIKINIDHRTZLGC-SFHVURJKSA-N 2 0 330.859 4.111 20 0 EIADRP CCc1cccc(F)c1C[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000474892760 1027746490 /nfs/dbraw/zinc/74/64/90/1027746490.db2.gz KZDPTERLONVXNZ-UHFFFAOYSA-N 2 0 326.459 4.274 20 0 EIADRP COc1ccc([C@H](C)[C@@H](C)[NH2+]Cc2cccc(C[NH+](C)C)c2)cc1 ZINC000474892987 1027749043 /nfs/dbraw/zinc/74/90/43/1027749043.db2.gz VXWLFKQJZKSFSH-IAGOWNOFSA-N 2 0 326.484 4.039 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000582952356 1027753963 /nfs/dbraw/zinc/75/39/63/1027753963.db2.gz WFOMHDCJYMNBRT-SWLSCSKDSA-N 2 0 335.904 4.071 20 0 EIADRP C[C@@H](CC[NH+]1CCC(CCC[NH+](C)C)CC1)OCc1ccccc1 ZINC000474970543 1027839619 /nfs/dbraw/zinc/83/96/19/1027839619.db2.gz RYCMODCNRRWRBX-IBGZPJMESA-N 2 0 332.532 4.036 20 0 EIADRP Cc1nccn1-c1ccc(C[NH2+][C@@H]2CCc3c2cccc3C)cc1F ZINC000153692928 1027872493 /nfs/dbraw/zinc/87/24/93/1027872493.db2.gz MUUBPXHVNIWXAB-HXUWFJFHSA-N 2 0 335.426 4.405 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1[NH2+]CC1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000188657889 1028013766 /nfs/dbraw/zinc/01/37/66/1028013766.db2.gz FWUYJXWUEOMHOY-CKEIUWERSA-N 2 0 340.433 4.055 20 0 EIADRP CC[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(OC)c(OC)c1 ZINC000123639967 1028082561 /nfs/dbraw/zinc/08/25/61/1028082561.db2.gz NADZHLOMDWOUSV-LJQANCHMSA-N 2 0 342.483 4.006 20 0 EIADRP Cc1ccc2cc(C[NH2+]C3CC[NH+](CC4CCCC4)CC3)ccc2n1 ZINC000189294864 1028102141 /nfs/dbraw/zinc/10/21/41/1028102141.db2.gz SJQACBUPZAUILW-UHFFFAOYSA-N 2 0 337.511 4.287 20 0 EIADRP CC[C@@H]1c2ccsc2CC[N@H+]1Cc1cn(-c2cc[nH+]cc2)nc1C ZINC000346132367 1028273487 /nfs/dbraw/zinc/27/34/87/1028273487.db2.gz BVIAVWMHJGQXDU-GOSISDBHSA-N 2 0 338.480 4.147 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+]1CCC[C@@H](c2ccccc2)CC1 ZINC000346143614 1028278360 /nfs/dbraw/zinc/27/83/60/1028278360.db2.gz DVCWYVKNDOLQGY-HXUWFJFHSA-N 2 0 346.478 4.345 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH+]1CCC(C)(c2ccccc2)CC1 ZINC000346159508 1028294450 /nfs/dbraw/zinc/29/44/50/1028294450.db2.gz VQEJMLLOQMPBGO-UHFFFAOYSA-N 2 0 346.478 4.129 20 0 EIADRP Cc1ccc([C@H]2CCC[N@@H+]2Cc2cn(-c3cc[nH+]cc3)nc2C)s1 ZINC000346205298 1028328389 /nfs/dbraw/zinc/32/83/89/1028328389.db2.gz LYPRIIGMRSXBAQ-GOSISDBHSA-N 2 0 338.480 4.283 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCCCC2)c1)c1cncs1 ZINC000125068159 1028344484 /nfs/dbraw/zinc/34/44/84/1028344484.db2.gz LEZAKWISBRUHIF-MRXNPFEDSA-N 2 0 329.513 4.370 20 0 EIADRP COCc1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@@H]3C)cc2)o1 ZINC000125504511 1028416375 /nfs/dbraw/zinc/41/63/75/1028416375.db2.gz IZVNWKNFOZYEKY-KRWDZBQOSA-N 2 0 342.483 4.090 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3ccc4c(n3)CCC4)cc2)C1 ZINC000564711607 1028485557 /nfs/dbraw/zinc/48/55/57/1028485557.db2.gz VLXZZHXHDDBGSQ-GOSISDBHSA-N 2 0 349.522 4.092 20 0 EIADRP Cc1nn(C(C)C)cc1C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000281352177 1028535238 /nfs/dbraw/zinc/53/52/38/1028535238.db2.gz MQOWUFAAWTTYBZ-UHFFFAOYSA-N 2 0 340.515 4.048 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccnc(Cl)c2)c1 ZINC000161720798 1028742753 /nfs/dbraw/zinc/74/27/53/1028742753.db2.gz JOQSFSNQFFPRSW-OAHLLOKOSA-N 2 0 331.891 4.426 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1ccc(Br)c(F)c1 ZINC000127352988 1028774337 /nfs/dbraw/zinc/77/43/37/1028774337.db2.gz YIBDHWITMXHTLA-CYBMUJFWSA-N 2 0 345.300 4.188 20 0 EIADRP Cc1nc(F)ccc1C[NH2+]Cc1ccc(C[N@H+]2CCCC[C@@H]2C)cc1 ZINC000278285144 1028821369 /nfs/dbraw/zinc/82/13/69/1028821369.db2.gz BFSSEEUKWSVAEW-INIZCTEOSA-N 2 0 341.474 4.193 20 0 EIADRP C[C@H]([NH2+]CC[C@H]1CNc2ccccc21)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000635021327 1028831556 /nfs/dbraw/zinc/83/15/56/1028831556.db2.gz NXESBSKLAMBYHW-JBACZVJFSA-N 2 0 349.522 4.086 20 0 EIADRP C[NH2+]Cc1ccccc1C[NH2+][C@H](C)CCc1ccc(OC(F)F)cc1 ZINC000650719124 1028878879 /nfs/dbraw/zinc/87/88/79/1028878879.db2.gz DTYYDFQSQDDRQH-OAHLLOKOSA-N 2 0 348.437 4.118 20 0 EIADRP C[NH+]1CCC(C[NH2+]CC(Cc2ccccc2)Cc2ccccc2)CC1 ZINC000569633453 1029027944 /nfs/dbraw/zinc/02/79/44/1029027944.db2.gz CHHVTBIWFYRCER-UHFFFAOYSA-N 2 0 336.523 4.019 20 0 EIADRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000650744606 1029062186 /nfs/dbraw/zinc/06/21/86/1029062186.db2.gz RQQCNGSWQXSTGL-INIZCTEOSA-N 2 0 342.458 4.184 20 0 EIADRP COc1ccc([C@@H]([NH2+]CCC2(C[NH3+])CC2)c2ccccc2Cl)cc1 ZINC000650745740 1029073755 /nfs/dbraw/zinc/07/37/55/1029073755.db2.gz MTQXCUOAMPKMFY-LJQANCHMSA-N 2 0 344.886 4.157 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccccc1C(F)(F)F ZINC000561961632 1029091490 /nfs/dbraw/zinc/09/14/90/1029091490.db2.gz ZRXFXSGOWDKAJD-ZDUSSCGKSA-N 2 0 326.406 4.230 20 0 EIADRP [NH3+]CC1(CC[NH2+][C@@H](Cc2ccccc2Cl)c2ccsc2)CC1 ZINC000650747934 1029091777 /nfs/dbraw/zinc/09/17/77/1029091777.db2.gz KTVKQPICITVAAZ-KRWDZBQOSA-N 2 0 334.916 4.404 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](CC)c2ccccc2OC(F)F)C1 ZINC000151127631 1029120280 /nfs/dbraw/zinc/12/02/80/1029120280.db2.gz YVJHJHZGSCRUKS-HOCLYGCPSA-N 2 0 326.431 4.061 20 0 EIADRP [NH3+]Cc1ccc(C[NH2+][C@@H]2CCSc3c(Cl)cccc32)c(F)c1 ZINC000650753505 1029155024 /nfs/dbraw/zinc/15/50/24/1029155024.db2.gz OTEOUJKALCAIEB-MRXNPFEDSA-N 2 0 336.863 4.265 20 0 EIADRP C[C@@H]1CC([N@@H+]2CC[C@H](c3ccncc3)C2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168053359 1029160018 /nfs/dbraw/zinc/16/00/18/1029160018.db2.gz OCGOLJUOUGSCFN-KNKQGSTJSA-N 2 0 349.522 4.313 20 0 EIADRP COc1ccccc1[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)C1CCCC1 ZINC000650754648 1029177938 /nfs/dbraw/zinc/17/79/38/1029177938.db2.gz NPOAVSJRDPHMNP-NRFANRHFSA-N 2 0 342.458 4.314 20 0 EIADRP C[NH2+]Cc1ccc(NC2C[C@H](C)[NH+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC001168055391 1029199726 /nfs/dbraw/zinc/19/97/26/1029199726.db2.gz VOZZBDGHKIJRMF-ROUUACIJSA-N 2 0 337.511 4.260 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cccc(COC)c2)CC1)CC1CC1 ZINC000536140773 1029247881 /nfs/dbraw/zinc/24/78/81/1029247881.db2.gz LQLAVLURBVKAMA-UHFFFAOYSA-N 2 0 344.543 4.167 20 0 EIADRP COC1CCC(C)(C[NH2+]C2CC[NH+]([C@@H]3CCCC[C@@H]3C)CC2)CC1 ZINC000475202329 1029431870 /nfs/dbraw/zinc/43/18/70/1029431870.db2.gz MBDIVHRJQGANHW-RCKXYERXSA-N 2 0 336.564 4.214 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C1CCC(F)(F)CC1 ZINC000475281268 1029496616 /nfs/dbraw/zinc/49/66/16/1029496616.db2.gz PWKAYWQMCYOSJW-WMZOPIPTSA-N 2 0 336.470 4.312 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+]([C@H](C)c2ccc(OC(F)F)cc2)CC1 ZINC000523017342 1029552412 /nfs/dbraw/zinc/55/24/12/1029552412.db2.gz KUGMSOPHWMBAOX-OAHLLOKOSA-N 2 0 340.458 4.401 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2F ZINC000325233188 1029629963 /nfs/dbraw/zinc/62/99/63/1029629963.db2.gz BQICYSHKZADMPC-OAQYLSRUSA-N 2 0 326.459 4.445 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000446887188 1029631522 /nfs/dbraw/zinc/63/15/22/1029631522.db2.gz PDLPJMMKHPQOEO-AWEZNQCLSA-N 2 0 340.433 4.100 20 0 EIADRP COc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)CCCS2 ZINC000446935336 1029645332 /nfs/dbraw/zinc/64/53/32/1029645332.db2.gz ZLBYZKDPEYRHCF-RVKKMQEKSA-N 2 0 334.529 4.085 20 0 EIADRP CSc1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000192920287 1029646596 /nfs/dbraw/zinc/64/65/96/1029646596.db2.gz XYWCAFOCGUIQDF-LJQANCHMSA-N 2 0 326.509 4.020 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccccc2C[NH2+]C2CC(CF)(CF)C2)C1 ZINC000657838663 1029715827 /nfs/dbraw/zinc/71/58/27/1029715827.db2.gz WYPYFDUQKDYYKE-INIZCTEOSA-N 2 0 336.470 4.096 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C[NH2+]Cc1ccc(Cl)s1 ZINC000708528745 1029813372 /nfs/dbraw/zinc/81/33/72/1029813372.db2.gz IGKGJNJDPDFCDV-ZBFHGGJFSA-N 2 0 334.916 4.259 20 0 EIADRP C[C@H]([NH2+][C@@H]1c2ccccc2C[C@H]1C)c1ccc(OCC[NH+](C)C)cc1 ZINC000089613786 1029850671 /nfs/dbraw/zinc/85/06/71/1029850671.db2.gz CDQUDJXWYJOLAG-JLHGSKIFSA-N 2 0 338.495 4.211 20 0 EIADRP C[N@@H+]1CC[C@@H](C[NH2+]C/C=C/c2ccc(F)c(F)c2)[C@@H]1c1cccs1 ZINC000375751955 1029859759 /nfs/dbraw/zinc/85/97/59/1029859759.db2.gz YWUBBPJFJMGRDR-CILJEUCVSA-N 2 0 348.462 4.322 20 0 EIADRP CC(C)[C@H]([NH2+]C1CCC([NH+]2CCC(C)CC2)CC1)c1cccnc1 ZINC000091403721 1029884933 /nfs/dbraw/zinc/88/49/33/1029884933.db2.gz ZQPGSNZOYRAFFA-CBNMVNINSA-N 2 0 329.532 4.411 20 0 EIADRP COc1ccccc1-c1ccc(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)cc1 ZINC000092072857 1029900443 /nfs/dbraw/zinc/90/04/43/1029900443.db2.gz DMSQHTKSJWTHRD-IBGZPJMESA-N 2 0 347.462 4.465 20 0 EIADRP Cc1sccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000390846017 1030035386 /nfs/dbraw/zinc/03/53/86/1030035386.db2.gz FJQGZSMODPTHHC-IHWFROFDSA-N 2 0 326.509 4.342 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+](C)C)cc1)c1ccccc1Br ZINC000171126596 1030062154 /nfs/dbraw/zinc/06/21/54/1030062154.db2.gz TVJNBSYJDZKIKQ-AWEZNQCLSA-N 2 0 347.300 4.362 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H]2CCCc3c4cc(C)ccc4[nH]c32)CC1 ZINC000204974992 1030127884 /nfs/dbraw/zinc/12/78/84/1030127884.db2.gz OEEMLHHQHZVGKA-FQEVSTJZSA-N 2 0 325.500 4.318 20 0 EIADRP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]C[C@@H]1CCC[N@H+](C)C1 ZINC000657875699 1030142408 /nfs/dbraw/zinc/14/24/08/1030142408.db2.gz HSGZOLSWTBAQGI-OCCSQVGLSA-N 2 0 348.840 4.221 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)c2cc(C)oc2C)cc1 ZINC000447544337 1030147796 /nfs/dbraw/zinc/14/77/96/1030147796.db2.gz ULCHTJPCXFSLHL-KRWDZBQOSA-N 2 0 344.499 4.468 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1nc(-c2ccccc2)cs1 ZINC000447571452 1030156567 /nfs/dbraw/zinc/15/65/67/1030156567.db2.gz KEKAAJCBCWKFAY-HNNXBMFYSA-N 2 0 341.524 4.335 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(c2c(Cl)cccc2Cl)CCC1 ZINC000447571377 1030157749 /nfs/dbraw/zinc/15/77/49/1030157749.db2.gz XXIAANBZCJNINZ-CZUORRHYSA-N 2 0 341.326 4.345 20 0 EIADRP Clc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](C3CC3)CC1)CCCO2 ZINC000447573619 1030162609 /nfs/dbraw/zinc/16/26/09/1030162609.db2.gz SMQVCEDNULAEOK-GOSISDBHSA-N 2 0 334.891 4.018 20 0 EIADRP COc1ccccc1[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)C1CCCC1 ZINC000447558120 1030167391 /nfs/dbraw/zinc/16/73/91/1030167391.db2.gz MUDATZMTEBNWDV-JOCHJYFZSA-N 2 0 342.527 4.391 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C[C@H]2CCCCS2)C3)cc1 ZINC000447601364 1030223085 /nfs/dbraw/zinc/22/30/85/1030223085.db2.gz PKMPQMPGHGZDEZ-IYWMVGAKSA-N 2 0 330.541 4.057 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCc2c(F)cccc2Cl)[C@@H](C)C1 ZINC000447728299 1030291762 /nfs/dbraw/zinc/29/17/62/1030291762.db2.gz LBGSGTHZSMZWOD-KBXCAEBGSA-N 2 0 326.887 4.074 20 0 EIADRP CC[NH+](CC)CCOC1CC[NH+](CC[C@H](C)c2ccccc2)CC1 ZINC000447729703 1030298642 /nfs/dbraw/zinc/29/86/42/1030298642.db2.gz PLDWOPUODBGNPQ-IBGZPJMESA-N 2 0 332.532 4.003 20 0 EIADRP C/C=C\COc1ccc(CC[C@H](C)[NH2+]C[C@@H]2CC[N@@H+](C(C)C)C2)cc1 ZINC000685455691 1030340868 /nfs/dbraw/zinc/34/08/68/1030340868.db2.gz LFXUHYOGVFTFRB-SFMFPFJOSA-N 2 0 344.543 4.283 20 0 EIADRP CC(C)(C)[NH+]1CCC([NH2+]CCCc2c(F)cccc2Cl)CC1 ZINC000447818514 1030341349 /nfs/dbraw/zinc/34/13/49/1030341349.db2.gz TZSKZJBABSDPHH-UHFFFAOYSA-N 2 0 326.887 4.264 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@@H]2CCCc3c4ccccc4[nH]c32)CC1 ZINC000392588523 1030354633 /nfs/dbraw/zinc/35/46/33/1030354633.db2.gz JTXPHHQJKFRTAW-HXUWFJFHSA-N 2 0 325.500 4.399 20 0 EIADRP C[N@H+](Cc1cc(-n2ccnc2)cs1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000685476881 1030367570 /nfs/dbraw/zinc/36/75/70/1030367570.db2.gz WHOOVCGCQSHLJP-BETUJISGSA-N 2 0 343.418 4.487 20 0 EIADRP CSCC1CCC([NH2+]C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)CC1 ZINC000708573365 1030397476 /nfs/dbraw/zinc/39/74/76/1030397476.db2.gz IWENDDZNZUOBEN-RCKXYERXSA-N 2 0 346.584 4.266 20 0 EIADRP C[C@@H](Cc1ccc(Cl)cc1)[NH+]1CCC([NH3+])(Cc2ccccc2)CC1 ZINC001168168618 1030397963 /nfs/dbraw/zinc/39/79/63/1030397963.db2.gz SWMSMBIFBHEBHZ-KRWDZBQOSA-N 2 0 342.914 4.307 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@@H](C)c2ccc(C(F)F)nc2)CC1 ZINC000657901713 1030411463 /nfs/dbraw/zinc/41/14/63/1030411463.db2.gz SRDCICLPIBBUTD-HNNXBMFYSA-N 2 0 339.474 4.428 20 0 EIADRP c1cc(-c2n[nH]cc2C[NH2+]C2CCC([NH+]3CCCCC3)CC2)cs1 ZINC000780537719 1030427712 /nfs/dbraw/zinc/42/77/12/1030427712.db2.gz VHLZRWZXMDIJSW-UHFFFAOYSA-N 2 0 344.528 4.025 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2cccc(Br)c2Cl)CC1 ZINC000666197063 1030486163 /nfs/dbraw/zinc/48/61/63/1030486163.db2.gz XDSKKXFXKFYNCZ-UHFFFAOYSA-N 2 0 345.712 4.065 20 0 EIADRP C[C@H](C[NH2+]C[C@@H]1CC[N@H+](CCc2ccccc2)C1)c1ccc(F)cc1 ZINC000527111373 1030498597 /nfs/dbraw/zinc/49/85/97/1030498597.db2.gz UAGPOEQRTIZNDO-QUCCMNQESA-N 2 0 340.486 4.083 20 0 EIADRP Cn1cncc1CC[NH2+][C@@H](c1cccc(F)c1)c1cccc(Cl)c1 ZINC000530513192 1030503254 /nfs/dbraw/zinc/50/32/54/1030503254.db2.gz QKKRYHMNOZGWFE-LJQANCHMSA-N 2 0 343.833 4.134 20 0 EIADRP C[NH2+]C[C@@H]1CCC[N@H+](Cc2c(OC(C)C)ccc3ccccc32)C1 ZINC000470013468 1030551537 /nfs/dbraw/zinc/55/15/37/1030551537.db2.gz OCTKQXGMSMZBHJ-KRWDZBQOSA-N 2 0 326.484 4.058 20 0 EIADRP CSc1ccc(C[NH2+]C[C@@H]2CCC[N@H+](Cc3ccccc3)C2)s1 ZINC000685614100 1030566373 /nfs/dbraw/zinc/56/63/73/1030566373.db2.gz HAHMKBMUZGRERF-KRWDZBQOSA-N 2 0 346.565 4.472 20 0 EIADRP C[C@H](Cc1ccc(Cl)c(C(F)(F)F)c1)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000657939002 1030648226 /nfs/dbraw/zinc/64/82/26/1030648226.db2.gz SRVYFQRIFYIWDJ-GFCCVEGCSA-N 2 0 346.824 4.141 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccc(C(F)F)nc1 ZINC000657969674 1030704210 /nfs/dbraw/zinc/70/42/10/1030704210.db2.gz SXQAHJCPXGNHDC-OFQRWUPVSA-N 2 0 337.458 4.323 20 0 EIADRP C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]Cc1cccc2cc[nH]c21 ZINC000398167216 1030719888 /nfs/dbraw/zinc/71/98/88/1030719888.db2.gz TZNXXSQHOVWSQK-UWJYYQICSA-N 2 0 333.479 4.168 20 0 EIADRP CC(C)Oc1cc(Cl)c(C[NH2+][C@@H](C)Cn2ccnc2)cc1Cl ZINC000527637648 1030792099 /nfs/dbraw/zinc/79/20/99/1030792099.db2.gz NHGPDDRFFLAEKZ-LBPRGKRZSA-N 2 0 342.270 4.155 20 0 EIADRP Clc1cnccc1CNCc1cccc(C[NH+]2CCCCCC2)c1 ZINC000527652086 1030803037 /nfs/dbraw/zinc/80/30/37/1030803037.db2.gz ZRGBFYJEUSNRJK-UHFFFAOYSA-N 2 0 343.902 4.401 20 0 EIADRP C[C@H](CCC1CCCCC1)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658066725 1030811680 /nfs/dbraw/zinc/81/16/80/1030811680.db2.gz DIGLYBWNPXWVHK-GOSISDBHSA-N 2 0 336.564 4.216 20 0 EIADRP CC(C)C[C@@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccccc1 ZINC000658066638 1030811965 /nfs/dbraw/zinc/81/19/65/1030811965.db2.gz CRGGYQYUKLGRBS-JOCHJYFZSA-N 2 0 344.543 4.254 20 0 EIADRP CC(C)C[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccccc1 ZINC000658066647 1030812466 /nfs/dbraw/zinc/81/24/66/1030812466.db2.gz CRGGYQYUKLGRBS-QFIPXVFZSA-N 2 0 344.543 4.254 20 0 EIADRP c1ccc([C@@H](CC2CC2)[NH2+]CC2CC[NH+](Cc3ccncc3)CC2)cc1 ZINC000658163902 1030860591 /nfs/dbraw/zinc/86/05/91/1030860591.db2.gz BXVKXBCSUKPBIQ-HSZRJFAPSA-N 2 0 349.522 4.425 20 0 EIADRP c1cc(C[NH+]2CCC(C[NH2+][C@@H]3CCCCC34CCCC4)CC2)ccn1 ZINC000658166939 1030863014 /nfs/dbraw/zinc/86/30/14/1030863014.db2.gz WNTJBSKAFKIORV-OAQYLSRUSA-N 2 0 341.543 4.386 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCN1C1CCCCC1)c1cnc2ccsc2c1 ZINC000527949014 1030964189 /nfs/dbraw/zinc/96/41/89/1030964189.db2.gz NQICBPAWJMESSN-PBHICJAKSA-N 2 0 329.513 4.354 20 0 EIADRP Cc1cncc([C@@H](C)[NH2+]C[C@H]2C[N@H+](Cc3ccccc3)CC23CCC3)c1 ZINC000658320181 1030977317 /nfs/dbraw/zinc/97/73/17/1030977317.db2.gz PLRQHZYWPSYAOD-KNQAVFIVSA-N 2 0 349.522 4.343 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1ccncc1 ZINC000658319277 1030982447 /nfs/dbraw/zinc/98/24/47/1030982447.db2.gz YWDQQYRVJZEESP-FCHUYYIVSA-N 2 0 349.522 4.425 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1cccc(Br)n1 ZINC000924528619 1031037260 /nfs/dbraw/zinc/03/72/60/1031037260.db2.gz ONVNJQBHOXMDOW-KGLIPLIRSA-N 2 0 342.325 4.005 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@H]1CSCCc2ccccc21 ZINC000532459797 1031098813 /nfs/dbraw/zinc/09/88/13/1031098813.db2.gz MGUXAHSFRAMYGF-XLIONFOSSA-N 2 0 332.557 4.261 20 0 EIADRP CN1CC[C@@H]([NH2+]Cc2cccc3cccnc32)C[C@@H]1c1ccccc1 ZINC000340213237 1031189367 /nfs/dbraw/zinc/18/93/67/1031189367.db2.gz VDTBZFZNZFNWFT-NHCUHLMSSA-N 2 0 331.463 4.160 20 0 EIADRP Cc1ccc([C@H](C)[NH2+]Cc2ccc(OCCC[NH+](C)C)cc2)c(C)c1 ZINC000532485405 1031216888 /nfs/dbraw/zinc/21/68/88/1031216888.db2.gz JJKXURQIEVWGFM-IBGZPJMESA-N 2 0 340.511 4.485 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCC[N@H+](C)C1)c1ccccc1OCc1ccccc1 ZINC000532507300 1031229332 /nfs/dbraw/zinc/22/93/32/1031229332.db2.gz RGQQYFDMWJSTCR-UYAOXDASSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000532500226 1031238941 /nfs/dbraw/zinc/23/89/41/1031238941.db2.gz MTWAJEYWZKZGLJ-SZNDQCEHSA-N 2 0 344.449 4.440 20 0 EIADRP Fc1ccccc1-c1ncc(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)s1 ZINC000449015208 1031343790 /nfs/dbraw/zinc/34/37/90/1031343790.db2.gz KQADVHDIAVVFNI-CYBMUJFWSA-N 2 0 342.443 4.052 20 0 EIADRP COc1cccc2c(C[N@@H+]3CC[C@H](C[NH+](C)CC4CC4)C3)cccc12 ZINC000449035686 1031370203 /nfs/dbraw/zinc/37/02/03/1031370203.db2.gz HRDWMIDBRJOJSB-GOSISDBHSA-N 2 0 338.495 4.012 20 0 EIADRP C[NH+](C)CCOc1ccc(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)cc1 ZINC000062257638 1031391326 /nfs/dbraw/zinc/39/13/26/1031391326.db2.gz SDMIVZLZKXRFET-HXUWFJFHSA-N 2 0 344.886 4.058 20 0 EIADRP COc1cccc2c(C[NH2+]Cc3ccc(C[NH+](C)C)cc3)cccc12 ZINC000449064029 1031393657 /nfs/dbraw/zinc/39/36/57/1031393657.db2.gz SIBSXFGUOVQZRP-UHFFFAOYSA-N 2 0 334.463 4.200 20 0 EIADRP c1c2cccnc2oc1C[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000449066879 1031418431 /nfs/dbraw/zinc/41/84/31/1031418431.db2.gz GMPGDUCRROIIAX-UHFFFAOYSA-N 2 0 335.451 4.104 20 0 EIADRP Clc1ccc([C@H]2CC[C@H]([NH2+]C3CC[NH+](CC4CC4)CC3)C2)cc1 ZINC000449091539 1031451670 /nfs/dbraw/zinc/45/16/70/1031451670.db2.gz QDBRNJJEHHPFMW-PXNSSMCTSA-N 2 0 332.919 4.440 20 0 EIADRP COc1cccc2c(C[NH2+]C[C@@H]3CCC[N@@H+](C(C)C)C3)cccc12 ZINC000449133308 1031469604 /nfs/dbraw/zinc/46/96/04/1031469604.db2.gz XXYBMWXJHQAYMA-KRWDZBQOSA-N 2 0 326.484 4.058 20 0 EIADRP COc1cc(C[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)cc2ccccc21 ZINC000449133138 1031470819 /nfs/dbraw/zinc/47/08/19/1031470819.db2.gz XFFDDVFUNJBPBV-QGZVFWFLSA-N 2 0 326.484 4.058 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ncccc2Cl)CC1)CC1CC1 ZINC000528434403 1031490845 /nfs/dbraw/zinc/49/08/45/1031490845.db2.gz ZVJBGVSGAXKJSI-UHFFFAOYSA-N 2 0 335.923 4.069 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]Cc1ccc(OC2CCCCC2)cc1 ZINC000531708619 1031494121 /nfs/dbraw/zinc/49/41/21/1031494121.db2.gz VUPLVKCBIUSEEW-LZJOCLMNSA-N 2 0 330.516 4.216 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(F)cc1 ZINC000124066665 1031503908 /nfs/dbraw/zinc/50/39/08/1031503908.db2.gz PESRETOWASEPAX-HXUWFJFHSA-N 2 0 330.447 4.007 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1[NH2+]CC(C)(C)c1ccc(F)cc1Cl ZINC000531718367 1031517207 /nfs/dbraw/zinc/51/72/07/1031517207.db2.gz WNYOXBZCPLLBQG-XNJGSVPQSA-N 2 0 326.887 4.075 20 0 EIADRP COc1cccc(-c2ccc(C[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@H]3C)cc2)c1 ZINC000531725044 1031525625 /nfs/dbraw/zinc/52/56/25/1031525625.db2.gz GKOGDKVOLNRRMT-HYFFOGBASA-N 2 0 338.495 4.181 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ncc(-c2ccccc2)n1C ZINC000453065788 1031530253 /nfs/dbraw/zinc/53/02/53/1031530253.db2.gz XTHVYVBKSVMXIM-ROUUACIJSA-N 2 0 342.531 4.248 20 0 EIADRP C[NH+](C)CC1CCC([NH2+]Cc2cnc(-c3ccccc3F)s2)CC1 ZINC000449198811 1031543618 /nfs/dbraw/zinc/54/36/18/1031543618.db2.gz DLYUKHLKUKHXJX-UHFFFAOYSA-N 2 0 347.503 4.159 20 0 EIADRP C[N@@H+](Cc1cccc2ccoc21)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000449238425 1031575012 /nfs/dbraw/zinc/57/50/12/1031575012.db2.gz GJUYYFIUXKEAEJ-UHFFFAOYSA-N 2 0 335.451 4.176 20 0 EIADRP CCOc1ccc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cc1 ZINC000065976618 1031639688 /nfs/dbraw/zinc/63/96/88/1031639688.db2.gz RHBNPGFRESXPIY-UHFFFAOYSA-N 2 0 326.484 4.215 20 0 EIADRP Cc1cc([C@H](C)[NH2+]C2CCN([C@@H](C)c3ccncc3)CC2)cs1 ZINC000453176532 1031649056 /nfs/dbraw/zinc/64/90/56/1031649056.db2.gz RCVJAULUTVYPEU-HOTGVXAUSA-N 2 0 329.513 4.328 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C2CC(C(F)(F)F)C2)CC1 ZINC000449335410 1031653519 /nfs/dbraw/zinc/65/35/19/1031653519.db2.gz ZSVCZUOMVALMCL-MXWWQKGMSA-N 2 0 340.433 4.013 20 0 EIADRP CC(C)[C@H](O)C1(C[NH2+]C2CC[NH+](C(C)(C)CC(C)(C)C)CC2)CC1 ZINC000453172019 1031680917 /nfs/dbraw/zinc/68/09/17/1031680917.db2.gz GAAZVVRKCUTCQO-SFHVURJKSA-N 2 0 338.580 4.052 20 0 EIADRP CC[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000453184463 1031687026 /nfs/dbraw/zinc/68/70/26/1031687026.db2.gz ZZHTURGNDMOUHT-DWLFOUALSA-N 2 0 337.511 4.423 20 0 EIADRP COCCC(C)(C)C[NH2+][C@@H]1CC[N@H+](Cc2ccccc2)[C@@H]2CCC[C@H]21 ZINC000453198906 1031708111 /nfs/dbraw/zinc/70/81/11/1031708111.db2.gz PESYJQNADREOQK-PWRODBHTSA-N 2 0 344.543 4.082 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C2CCN(Cc3ccccc3)CC2)c2ccccc2O1 ZINC000449428560 1031723973 /nfs/dbraw/zinc/72/39/73/1031723973.db2.gz VEGRWGJBUNKKFT-DYESRHJHSA-N 2 0 336.479 4.153 20 0 EIADRP CCC(C)(C)[NH2+][C@H](C)C(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000475900071 1031730001 /nfs/dbraw/zinc/73/00/01/1031730001.db2.gz SEFGEIKHWBTQRS-QGZVFWFLSA-N 2 0 345.531 4.168 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]C[C@@H]2CCCC2(F)F)CC1 ZINC000449499632 1031808130 /nfs/dbraw/zinc/80/81/30/1031808130.db2.gz UBLTZIMEGXNGML-AEFFLSMTSA-N 2 0 336.470 4.107 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]C[C@H]2CCCC2(F)F)CC1 ZINC000453317175 1031843882 /nfs/dbraw/zinc/84/38/82/1031843882.db2.gz JNDUPHDVMAWPPT-LMDPOFIKSA-N 2 0 336.470 4.455 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1 ZINC000449560107 1031847899 /nfs/dbraw/zinc/84/78/99/1031847899.db2.gz GEUWPKXYXNJYOZ-MUCWCHJTSA-N 2 0 342.527 4.325 20 0 EIADRP FC1(F)CCC[C@@H]1C[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000453326561 1031852401 /nfs/dbraw/zinc/85/24/01/1031852401.db2.gz YIXCVSIIRZKKQN-MKXGPGLRSA-N 2 0 334.454 4.207 20 0 EIADRP CCN(c1ccccc1)c1ccc(C[NH2+][C@H]2CC[N@H+](C)C[C@H]2C)cc1 ZINC000531980182 1031927837 /nfs/dbraw/zinc/92/78/37/1031927837.db2.gz AOEPSNZGRMTPHM-GCJKJVERSA-N 2 0 337.511 4.274 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CC(C)(C)C(C)(C)O)CC1 ZINC000449728501 1031956491 /nfs/dbraw/zinc/95/64/91/1031956491.db2.gz VTUJWDYAYOODDO-UHFFFAOYSA-N 2 0 326.569 4.052 20 0 EIADRP Clc1ccc([C@@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)C2CC2)cc1 ZINC000459369484 1031975330 /nfs/dbraw/zinc/97/53/30/1031975330.db2.gz OFAVIWQEQBGSTK-FQEVSTJZSA-N 2 0 341.886 4.445 20 0 EIADRP C[N@H+](CCCC[NH2+]Cc1ccc(Cl)c(C(F)(F)F)c1)C1CC1 ZINC000453598095 1032021040 /nfs/dbraw/zinc/02/10/40/1032021040.db2.gz PESMWUPXAUCYIM-UHFFFAOYSA-N 2 0 334.813 4.323 20 0 EIADRP CC(C)(C)c1cccc(C[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)c1 ZINC001168264687 1032027588 /nfs/dbraw/zinc/02/75/88/1032027588.db2.gz LTKYTYDHUCOSQM-WIYYLYMNSA-N 2 0 326.528 4.433 20 0 EIADRP C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H](C)[C@H]1[NH2+]Cc1cccc2[nH]ccc21 ZINC000532120800 1032050552 /nfs/dbraw/zinc/05/05/52/1032050552.db2.gz LIVLJYIEKMWQTL-CYGODWOOSA-N 2 0 347.506 4.414 20 0 EIADRP C[C@@H]([NH2+]CCc1c(F)cccc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000544424367 1032054492 /nfs/dbraw/zinc/05/44/92/1032054492.db2.gz LGDLBJZRLUBRJV-HUUCEWRRSA-N 2 0 338.898 4.264 20 0 EIADRP CC(C)Oc1ccc(C[NH2+]CCCC[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000512831765 1034027381 /nfs/dbraw/zinc/02/73/81/1034027381.db2.gz DNTGUKHDIYOVHM-OALUTQOASA-N 2 0 332.532 4.322 20 0 EIADRP c1cc2cccc(C[NH2+]CC3CC[NH+](Cc4ccccc4)CC3)c2[nH]1 ZINC000397578197 1034380970 /nfs/dbraw/zinc/38/09/70/1034380970.db2.gz DBWAIPXBEPWCDV-UHFFFAOYSA-N 2 0 333.479 4.170 20 0 EIADRP FC(F)(F)c1ccccc1C[NH2+][C@@H]1CCC[C@@H]1[C@H]1CCCC[NH2+]1 ZINC000261762089 1034562458 /nfs/dbraw/zinc/56/24/58/1034562458.db2.gz PWKBOIFZSGLQFI-DJIMGWMZSA-N 2 0 326.406 4.106 20 0 EIADRP C[N@H+](CCc1cc(Cl)ccc1Cl)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000513145051 1034655526 /nfs/dbraw/zinc/65/55/26/1034655526.db2.gz PNQQRMZQYUSLHE-XYPWUTKMSA-N 2 0 327.299 4.093 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+]CCCC[N@@H+]1CCCC[C@@H]1C ZINC000509921700 1034850617 /nfs/dbraw/zinc/85/06/17/1034850617.db2.gz BBCLHUXFOWCZPX-UETJRYKRSA-N 2 0 344.543 4.481 20 0 EIADRP CCC(CC)[C@H]1C[C@@H]([NH2+]C2CC[NH+](C3CCCCC3)CC2)CCO1 ZINC000513414548 1034933798 /nfs/dbraw/zinc/93/37/98/1034933798.db2.gz OHAVKTNDUUTKGT-PZJWPPBQSA-N 2 0 336.564 4.357 20 0 EIADRP Cc1nc(C)c(C[NH2+]CC[C@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)s1 ZINC000513493702 1034985032 /nfs/dbraw/zinc/98/50/32/1034985032.db2.gz CDCMRPVIUGMDNV-KXBFYZLASA-N 2 0 343.540 4.150 20 0 EIADRP c1cncc([C@@H]2CCC[C@@H]([NH2+]CCCCC[NH+]3CCCCC3)C2)c1 ZINC000501425818 1035442651 /nfs/dbraw/zinc/44/26/51/1035442651.db2.gz PHFHFPOCNBDGAH-TZIWHRDSSA-N 2 0 329.532 4.354 20 0 EIADRP Cc1nc([C@H](C)N2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)oc1-c1ccc(Cl)cc1 ZINC000420315679 1035509107 /nfs/dbraw/zinc/50/91/07/1035509107.db2.gz XEPDGSZYZDPIMX-CSFVBSKPSA-N 2 0 345.874 4.034 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[N@H+](C)CC[C@@H]1CC[NH2+]C1 ZINC000420328278 1035530911 /nfs/dbraw/zinc/53/09/11/1035530911.db2.gz ZVTDIVMAVVLURT-HOTGVXAUSA-N 2 0 329.513 4.111 20 0 EIADRP C[C@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC([C@@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000420389093 1035563019 /nfs/dbraw/zinc/56/30/19/1035563019.db2.gz LXPLISWVTBIJPM-CZAAIQMYSA-N 2 0 344.543 4.263 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]C[C@@H]1CC[NH2+]C1 ZINC000420396461 1035567123 /nfs/dbraw/zinc/56/71/23/1035567123.db2.gz FHHSTOMFRSSHQP-WCQYABFASA-N 2 0 335.904 4.032 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2cc(-c3ccc(F)cc3)no2)CC1 ZINC000501771630 1035574524 /nfs/dbraw/zinc/57/45/24/1035574524.db2.gz DFSXPTAIVAZJFI-UHFFFAOYSA-N 2 0 345.462 4.035 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(Cl)c3cccnc23)CC1 ZINC000501777349 1035585092 /nfs/dbraw/zinc/58/50/92/1035585092.db2.gz QGWNXRBLCQXHAY-UHFFFAOYSA-N 2 0 345.918 4.442 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]CC2)c1cccc(Cl)c1Cl ZINC000574994743 1035650304 /nfs/dbraw/zinc/65/03/04/1035650304.db2.gz IOWNIWAZDBBUGZ-LBPRGKRZSA-N 2 0 335.278 4.490 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H]2CCc3[nH]c4ccc(C)cc4c3C2)CC1 ZINC000491010168 1035753567 /nfs/dbraw/zinc/75/35/67/1035753567.db2.gz SFXPICUPQBKNSM-SFHVURJKSA-N 2 0 339.527 4.045 20 0 EIADRP C[N@@H+](Cc1ccc(OCc2ccccc2)cc1)CC1CC[NH+](C)CC1 ZINC000513729913 1035837817 /nfs/dbraw/zinc/83/78/17/1035837817.db2.gz SSJHJQJGKZRGDS-UHFFFAOYSA-N 2 0 338.495 4.039 20 0 EIADRP CCCCOc1ccc(C[N@H+](C)CC2CC[NH+](C)CC2)cc1OCC ZINC000513736687 1035929119 /nfs/dbraw/zinc/92/91/19/1035929119.db2.gz IYEVSJBDYHZCPP-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP C[N@@H+](Cc1ccc(Cl)c(C(F)(F)F)c1)CC1CC[NH+](C)CC1 ZINC000513736413 1035940734 /nfs/dbraw/zinc/94/07/34/1035940734.db2.gz AQIFXOZFZWDRIW-UHFFFAOYSA-N 2 0 334.813 4.132 20 0 EIADRP FC1(F)CC[C@@H](C[N@@H+]2CCC3(C2)CC[NH+](Cc2ccccc2)CC3)C1 ZINC000485496601 1035969688 /nfs/dbraw/zinc/96/96/88/1035969688.db2.gz UMTJKSGMZBODCB-LJQANCHMSA-N 2 0 348.481 4.410 20 0 EIADRP Fc1ccc(CC[NH2+]C2CC[NH+](CC3CCCC3)CC2)c(Cl)c1 ZINC000571488747 1036054583 /nfs/dbraw/zinc/05/45/83/1036054583.db2.gz SFKRHWVILQOWOU-UHFFFAOYSA-N 2 0 338.898 4.266 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@@H]3CCCC(F)(F)C3)CC2)C1 ZINC000502368810 1036141601 /nfs/dbraw/zinc/14/16/01/1036141601.db2.gz GNBRFZKDVXZTAP-JFIYKMOQSA-N 2 0 328.491 4.445 20 0 EIADRP COCC[C@H]1CCC[C@H]1[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC000502431911 1036196045 /nfs/dbraw/zinc/19/60/45/1036196045.db2.gz CKJFUFNZIRTMAG-DENIHFKCSA-N 2 0 344.543 4.213 20 0 EIADRP COc1ccc(C2CCC([NH2+]C[C@@H]3CC[N@@H+](C(C)C)C3)CC2)cc1 ZINC000571807298 1036258883 /nfs/dbraw/zinc/25/88/83/1036258883.db2.gz XWHHSHZXOHLBSZ-ZJRDLVKKSA-N 2 0 330.516 4.041 20 0 EIADRP COc1ccc(C[NH2+]C2CCC([NH+](C)C)CC2)cc1OCCC(C)C ZINC000421373350 1036320364 /nfs/dbraw/zinc/32/03/64/1036320364.db2.gz NQDWRMRAEGUVPK-UHFFFAOYSA-N 2 0 348.531 4.083 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC12CCSCC2)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000421384976 1036344387 /nfs/dbraw/zinc/34/43/87/1036344387.db2.gz QAJVINTXXXXKEL-IHPCNDPISA-N 2 0 344.568 4.020 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1cnn(C2CCCC2)c1 ZINC000502727534 1036582858 /nfs/dbraw/zinc/58/28/58/1036582858.db2.gz NRVMEIMBNUTJDW-MSOLQXFVSA-N 2 0 332.536 4.303 20 0 EIADRP COc1cc(Cl)ccc1[C@H](C)[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000421820218 1036805215 /nfs/dbraw/zinc/80/52/15/1036805215.db2.gz LJVVGLGIDWWJTC-AWEZNQCLSA-N 2 0 332.875 4.261 20 0 EIADRP C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1csc(-c2ccccc2F)n1 ZINC000421868869 1036839699 /nfs/dbraw/zinc/83/96/99/1036839699.db2.gz CTCSSJUTNJTSRY-WLYUNCDWSA-N 2 0 347.503 4.473 20 0 EIADRP CC(C)C[NH2+]C[C@@H]1CCCN(C)[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000503043716 1036884377 /nfs/dbraw/zinc/88/43/77/1036884377.db2.gz HDLPTYWMRGXHNR-DOTOQJQBSA-N 2 0 328.422 4.334 20 0 EIADRP C[C@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]CC2CCC(F)(F)CC2)CC1 ZINC000503079228 1036895384 /nfs/dbraw/zinc/89/53/84/1036895384.db2.gz UXCGXKKSNLMOQA-YJBOKZPZSA-N 2 0 328.491 4.445 20 0 EIADRP CC[N@H+](CCO[C@H]1CCCC[C@H]1C)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999651 1036917501 /nfs/dbraw/zinc/91/75/01/1036917501.db2.gz QIMFCIVCMWQDNE-NQIIRXRSSA-N 2 0 332.532 4.165 20 0 EIADRP CC[N@H+](Cc1cc(-c2ccccc2)no1)Cc1ccc(C[NH+](C)C)cc1 ZINC000589999478 1036918985 /nfs/dbraw/zinc/91/89/85/1036918985.db2.gz KZUWFDVIZBFIFL-UHFFFAOYSA-N 2 0 349.478 4.425 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3cccc4[nH]ccc43)CC2)C1 ZINC000503116685 1036928698 /nfs/dbraw/zinc/92/86/98/1036928698.db2.gz HLQZNHXIXHROAW-YLJYHZDGSA-N 2 0 339.527 4.343 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]CCc3cccc4[nH]ccc43)CC2)C1 ZINC000503116684 1036930257 /nfs/dbraw/zinc/93/02/57/1036930257.db2.gz HLQZNHXIXHROAW-XLIONFOSSA-N 2 0 339.527 4.343 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccccc2C[NH2+]C[C@@H]2CCSC2)C1 ZINC000486982926 1036935246 /nfs/dbraw/zinc/93/52/46/1036935246.db2.gz VJVFQPOHCWERLG-KURKYZTESA-N 2 0 332.557 4.007 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]C[C@H]3CCSC3)cc2)C1 ZINC000486985698 1036935354 /nfs/dbraw/zinc/93/53/54/1036935354.db2.gz HXLYYRMMWIDVKE-FUHIMQAGSA-N 2 0 332.557 4.007 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C[NH2+]C[C@@H]3CCSC3)cc2)C1 ZINC000486985701 1036935439 /nfs/dbraw/zinc/93/54/39/1036935439.db2.gz HXLYYRMMWIDVKE-QKLQHJQFSA-N 2 0 332.557 4.007 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C[NH2+]C/C=C/c3ccncc3)cc2)C1 ZINC000486989680 1036937068 /nfs/dbraw/zinc/93/70/68/1036937068.db2.gz UUVHQLXZIUMBGJ-FMEUAVTJSA-N 2 0 349.522 4.363 20 0 EIADRP c1cc2cccc(C[NH2+][C@H]3CCN(Cc4ccccc4)C4(CC4)C3)c2[nH]1 ZINC000569722678 1037018024 /nfs/dbraw/zinc/01/80/24/1037018024.db2.gz APMKPYLVVWKNNP-NRFANRHFSA-N 2 0 345.490 4.455 20 0 EIADRP c1ccc(CC2CC[NH+](CCCC[NH2+]C[C@H]3CCSC3)CC2)cc1 ZINC000487280654 1037094891 /nfs/dbraw/zinc/09/48/91/1037094891.db2.gz RNVDIFYTCNYJAF-OAQYLSRUSA-N 2 0 346.584 4.064 20 0 EIADRP C[NH+](C)CC[C@H]([NH2+]Cc1cccc(OCC(F)(F)F)c1)C(C)(C)C ZINC000604770682 1037511044 /nfs/dbraw/zinc/51/10/44/1037511044.db2.gz BBQMNVJIXKSRPI-INIZCTEOSA-N 2 0 346.437 4.084 20 0 EIADRP C[NH+](C)CC[C@@H]([NH2+]Cc1cccc(OCC(F)(F)F)c1)C(C)(C)C ZINC000604770685 1037511431 /nfs/dbraw/zinc/51/14/31/1037511431.db2.gz BBQMNVJIXKSRPI-MRXNPFEDSA-N 2 0 346.437 4.084 20 0 EIADRP C[NH+](C)CC1CC[NH+]([C@@H]2CCc3c2cc(Cl)cc3Cl)CC1 ZINC000488449766 1037603171 /nfs/dbraw/zinc/60/31/71/1037603171.db2.gz OVLVUTVSKPCROP-QGZVFWFLSA-N 2 0 327.299 4.254 20 0 EIADRP C[N@H+](Cc1cccc(OCc2ccccc2Cl)c1)C1CC[NH2+]CC1 ZINC000414649229 1037651918 /nfs/dbraw/zinc/65/19/18/1037651918.db2.gz CDOSCYMSOCZPSA-UHFFFAOYSA-N 2 0 344.886 4.103 20 0 EIADRP CC1CC[NH+](Cc2cccc(CN[C@H]3C[C@@H]([NH3+])c4ccccc43)c2)CC1 ZINC000422745043 1037821860 /nfs/dbraw/zinc/82/18/60/1037821860.db2.gz ULQQAESAYUWCMU-PKTZIBPZSA-N 2 0 349.522 4.153 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CCC[NH2+]CC1 ZINC000422743187 1037822222 /nfs/dbraw/zinc/82/22/22/1037822222.db2.gz RAMBCTAMGWBUPJ-BLLLJJGKSA-N 2 0 333.476 4.050 20 0 EIADRP CCC(CC)(CN[C@@H](C)c1c[nH+]ccc1N)[NH2+][C@H](C)c1ccccc1 ZINC000422773360 1037829910 /nfs/dbraw/zinc/82/99/10/1037829910.db2.gz YMRSGMWLXFLHJH-SJORKVTESA-N 2 0 340.515 4.054 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@H](c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000422774239 1037830894 /nfs/dbraw/zinc/83/08/94/1037830894.db2.gz WFGGEMQKJCLCFW-KBXCAEBGSA-N 2 0 334.410 4.094 20 0 EIADRP c1cncc(-c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)cc2)c1 ZINC000422804316 1037837558 /nfs/dbraw/zinc/83/75/58/1037837558.db2.gz HJFFSRGAKQNWDR-YPAWHYETSA-N 2 0 335.495 4.149 20 0 EIADRP [NH3+][C@@H]1C[C@H](NCc2ccc(C[NH+]3CCCCCC3)cc2)c2ccccc21 ZINC000422792886 1037839324 /nfs/dbraw/zinc/83/93/24/1037839324.db2.gz ZYSCPOHCGXBQJG-PKTZIBPZSA-N 2 0 349.522 4.297 20 0 EIADRP Cc1ccc([C@H]([NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)C2CC2)cc1 ZINC000422813367 1037839375 /nfs/dbraw/zinc/83/93/75/1037839375.db2.gz RQWYTOFKZCESFC-PUHATCMVSA-N 2 0 348.490 4.292 20 0 EIADRP [NH3+][C@H]1C[C@@H](NCc2ccc(C[NH+]3CCCCCC3)cc2)c2ccccc21 ZINC000422792887 1037840254 /nfs/dbraw/zinc/84/02/54/1037840254.db2.gz ZYSCPOHCGXBQJG-XZOQPEGZSA-N 2 0 349.522 4.297 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCC[NH2+]C2)cc1 ZINC000422791559 1037840505 /nfs/dbraw/zinc/84/05/05/1037840505.db2.gz YQYCBSLFYNDEPE-ABSDTBQOSA-N 2 0 338.495 4.401 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCCc2nc(-c3ccccc3)sc21 ZINC000422863236 1037848449 /nfs/dbraw/zinc/84/84/49/1037848449.db2.gz RJVNQIDYGIVBLD-ZBFHGGJFSA-N 2 0 329.513 4.295 20 0 EIADRP Cc1ccc(-c2nc(CC[NH2+][C@@H](C)C[C@@H]3CCCCC[NH2+]3)co2)cc1 ZINC000422878864 1037851906 /nfs/dbraw/zinc/85/19/06/1037851906.db2.gz LAEPUEYQLWSYIX-HKUYNNGSSA-N 2 0 341.499 4.093 20 0 EIADRP COC[C@H](CCC[NH3+])[NH2+][C@@H](c1ccccc1)c1ccc2ccccc2c1 ZINC000422906303 1037863137 /nfs/dbraw/zinc/86/31/37/1037863137.db2.gz JNSOPAOGYZHLPB-GOTSBHOMSA-N 2 0 348.490 4.273 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000422908732 1037863227 /nfs/dbraw/zinc/86/32/27/1037863227.db2.gz DSLWZXCLVYZEKB-VNHYZAJKSA-N 2 0 347.503 4.296 20 0 EIADRP c1ccc(SC2(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)CC2)cc1 ZINC000422910673 1037866215 /nfs/dbraw/zinc/86/62/15/1037866215.db2.gz RGTGEYDEPNSMEX-CEXWTWQISA-N 2 0 330.541 4.212 20 0 EIADRP Cc1cc(C)cc([C@H](C)[NH2+][C@@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000422891482 1037868031 /nfs/dbraw/zinc/86/80/31/1037868031.db2.gz VKPCHDXDGVPKFG-WEYGHZABSA-N 2 0 336.479 4.210 20 0 EIADRP c1ccc2c(c1)cccc2C[NH2+][C@@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000422924189 1037870438 /nfs/dbraw/zinc/87/04/38/1037870438.db2.gz YCVQWZXZVBAFHM-FYYLOGMGSA-N 2 0 344.458 4.185 20 0 EIADRP COc1ccc([C@@H]([NH2+][C@H](C)CCCC[NH3+])c2ccc(C)cc2)cc1 ZINC000422936415 1037873547 /nfs/dbraw/zinc/87/35/47/1037873547.db2.gz MIYMLEOQYBFSJV-UTKZUKDTSA-N 2 0 326.484 4.200 20 0 EIADRP Clc1ccc(OCCCC[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)cc1 ZINC000422934252 1037873844 /nfs/dbraw/zinc/87/38/44/1037873844.db2.gz JKBQQDVULYJUHJ-IPMKNSEASA-N 2 0 336.907 4.009 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H](c1ccccc1Cl)c1cc(F)ccc1F ZINC000422917575 1037878384 /nfs/dbraw/zinc/87/83/84/1037878384.db2.gz GKQXRERQKZUEMV-KZULUSFZSA-N 2 0 338.829 4.425 20 0 EIADRP COc1ccc([C@H]([NH2+][C@@H](C)CCCC[NH3+])c2ccc(F)cc2)cc1 ZINC000422950967 1037886620 /nfs/dbraw/zinc/88/66/20/1037886620.db2.gz ZFRHFIZRETWCOB-MGPUTAFESA-N 2 0 330.447 4.031 20 0 EIADRP [NH3+]CC1CCC([NH2+][C@@H]2CCOc3c(-c4ccccc4)cccc32)CC1 ZINC000422958698 1037889471 /nfs/dbraw/zinc/88/94/71/1037889471.db2.gz YSJFHBGVYVXBDV-QYGXFBIXSA-N 2 0 336.479 4.284 20 0 EIADRP Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C ZINC000422974244 1037893302 /nfs/dbraw/zinc/89/33/02/1037893302.db2.gz QQCCNPFJCGUWQA-KBXCAEBGSA-N 2 0 327.472 4.114 20 0 EIADRP c1ccc(-c2cccc(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCCC[NH2+]3)c2)nc1 ZINC000422997589 1037897299 /nfs/dbraw/zinc/89/72/99/1037897299.db2.gz OLXKLVUDFPKWAL-KSEOMHKRSA-N 2 0 335.495 4.149 20 0 EIADRP Fc1ccc(C2(C[NH2+][C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)CC2)c(Cl)c1 ZINC000423030290 1037910658 /nfs/dbraw/zinc/91/06/58/1037910658.db2.gz WACDWJGHESASGW-BMGDILEWSA-N 2 0 336.882 4.021 20 0 EIADRP CC(C)c1cccc(C[NH2+][C@H]2C[C@]3(CC[NH2+]C3)Oc3ccccc32)c1 ZINC000423050404 1037911178 /nfs/dbraw/zinc/91/11/78/1037911178.db2.gz LDUURPAKVMHHGF-UNMCSNQZSA-N 2 0 336.479 4.156 20 0 EIADRP C[C@@H]1CCc2ccccc2[C@@H]1[NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21 ZINC000423028935 1037911548 /nfs/dbraw/zinc/91/15/48/1037911548.db2.gz UCSFGSNXRYRQOC-VAOHTUKJSA-N 2 0 348.490 4.156 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1CCC(c2ccc(F)cc2)CC1 ZINC000423033545 1037914757 /nfs/dbraw/zinc/91/47/57/1037914757.db2.gz OPVHVJQEVMJDEO-STJZUHDESA-N 2 0 341.474 4.365 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CC(C)(C)c1cccc(Cl)c1F ZINC000423056284 1037923282 /nfs/dbraw/zinc/92/32/82/1037923282.db2.gz XXIPLWAGYFKRQP-LBPRGKRZSA-N 2 0 349.881 4.270 20 0 EIADRP [NH3+][C@H]1C[C@@H]([NH+]2CCC(Cc3ccc(F)c(F)c3)CC2)c2ccccc21 ZINC000423046142 1037924485 /nfs/dbraw/zinc/92/44/85/1037924485.db2.gz DVOSYYNFBAAURW-LEWJYISDSA-N 2 0 342.433 4.364 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@H](CC1CC1)c1cc(F)cc(Br)c1 ZINC000423057835 1037931080 /nfs/dbraw/zinc/93/10/80/1037931080.db2.gz AYOWQYPJSQOIPL-BDJLRTHQSA-N 2 0 343.284 4.146 20 0 EIADRP CC(C)Oc1ccc([C@H](C)[NH2+]CCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000574226558 1037955122 /nfs/dbraw/zinc/95/51/22/1037955122.db2.gz LXEUECOKWKUMSH-OTWHNJEPSA-N 2 0 348.531 4.014 20 0 EIADRP CC(C)Oc1ccc([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000574226557 1037955871 /nfs/dbraw/zinc/95/58/71/1037955871.db2.gz LXEUECOKWKUMSH-FHWLQOOXSA-N 2 0 348.531 4.014 20 0 EIADRP C[C@@H]([NH3+])[C@@H](Cc1ccccc1)[NH2+]C1CC(F)(c2cccc(Cl)c2)C1 ZINC000423099384 1037957919 /nfs/dbraw/zinc/95/79/19/1037957919.db2.gz TZUQDFUIORGXTB-VVXDDCKHSA-N 2 0 346.877 4.215 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H]1C[C@H](c2cccc(Cl)c2)C1 ZINC000423100303 1037959654 /nfs/dbraw/zinc/95/96/54/1037959654.db2.gz VCPJDHIYANZKPY-YEWWUXTCSA-N 2 0 329.875 4.099 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000423111467 1037987064 /nfs/dbraw/zinc/98/70/64/1037987064.db2.gz WAEPCVJJLNHABQ-WBMJQRKESA-N 2 0 330.394 4.143 20 0 EIADRP c1ccc(C2CC(C[NH2+][C@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)C2)cc1 ZINC000423110761 1037991879 /nfs/dbraw/zinc/99/18/79/1037991879.db2.gz INORSBRZEXZMNJ-HIYLJXDJSA-N 2 0 348.490 4.026 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](c1cccc(OC(F)(F)F)c1)C1CC1 ZINC000423111465 1037992780 /nfs/dbraw/zinc/99/27/80/1037992780.db2.gz WAEPCVJJLNHABQ-LRDDRELGSA-N 2 0 330.394 4.143 20 0 EIADRP [NH3+][C@@H]1C[C@H]([NH+]2CCC(Cc3cccc(F)c3F)CC2)c2ccccc21 ZINC000423153205 1038007735 /nfs/dbraw/zinc/00/77/35/1038007735.db2.gz GXSWJBUFXHHVMU-UXHICEINSA-N 2 0 342.433 4.364 20 0 EIADRP C[C@@H]([NH2+][C@H]1C[C@@]2(CC[NH2+]C2)Oc2ccccc21)c1ccc(Cl)cc1 ZINC000423170477 1038023656 /nfs/dbraw/zinc/02/36/56/1038023656.db2.gz MDZNLDSIVONFDC-HEFCMCLBSA-N 2 0 342.870 4.247 20 0 EIADRP C[C@@H]([NH2+]CCC[NH3+])c1ccc(-c2ccccc2Br)s1 ZINC000423178940 1038033019 /nfs/dbraw/zinc/03/30/19/1038033019.db2.gz LJTVGUZISVBOHA-LLVKDONJSA-N 2 0 339.302 4.177 20 0 EIADRP C[C@H](CCc1ccc(C(F)(F)F)cc1)[NH2+][C@H](C)[C@@H]1CCC[NH2+]C1 ZINC000423209379 1038039798 /nfs/dbraw/zinc/03/97/98/1038039798.db2.gz FDBNHNNOPOVTAX-IIAWOOMASA-N 2 0 328.422 4.004 20 0 EIADRP Clc1ccccc1C[C@H]([NH2+]C[C@@H]1CCC[NH2+]C1)c1ccsc1 ZINC000423214528 1038059023 /nfs/dbraw/zinc/05/90/23/1038059023.db2.gz PBOWCSSJHVZKLA-KDOFPFPSSA-N 2 0 334.916 4.275 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc(SCC(F)F)cc1 ZINC000423214933 1038062293 /nfs/dbraw/zinc/06/22/93/1038062293.db2.gz MBCLGANOCUZQQF-YDHLFZDLSA-N 2 0 328.472 4.083 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+][C@H](C)[C@@H]3CCC[NH2+]C3)cs2)cs1 ZINC000423216833 1038062374 /nfs/dbraw/zinc/06/23/74/1038062374.db2.gz PCOITSMBJVATIE-MBNYWOFBSA-N 2 0 335.542 4.219 20 0 EIADRP C[N@H+](CCCOc1cccc(C(C)(C)C)c1)C[C@@H]1CCC[NH+](C)C1 ZINC000607358494 1038076339 /nfs/dbraw/zinc/07/63/39/1038076339.db2.gz PGUNULQIPFHEAM-GOSISDBHSA-N 2 0 332.532 4.027 20 0 EIADRP Fc1cccc([C@H]([NH2+]CC[C@H]2CC[NH2+]C2)c2cccc(Cl)c2)c1 ZINC000423247869 1038082341 /nfs/dbraw/zinc/08/23/41/1038082341.db2.gz LVXIWRFMPOYUOJ-AUUYWEPGSA-N 2 0 332.850 4.158 20 0 EIADRP C[C@@H]([NH2+]CC[C@H]1CCC[NH2+]C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423256659 1038084464 /nfs/dbraw/zinc/08/44/64/1038084464.db2.gz FPCPBHUITWYKGN-ZIAGYGMSSA-N 2 0 346.462 4.381 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+]CC[C@H]3CCC[NH2+]C3)cs2)cs1 ZINC000423260766 1038087309 /nfs/dbraw/zinc/08/73/09/1038087309.db2.gz QQVIPDSBCBXFJY-GXTWGEPZSA-N 2 0 335.542 4.220 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423283597 1038089781 /nfs/dbraw/zinc/08/97/81/1038089781.db2.gz XNUHACNUVYSSNT-SJORKVTESA-N 2 0 327.516 4.203 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc([C@H](C)[NH3+])cc1)c1ccc(Br)s1 ZINC000423290405 1038092381 /nfs/dbraw/zinc/09/23/81/1038092381.db2.gz CUVGXUFCAPPGSY-WDEREUQCSA-N 2 0 339.302 4.381 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2OC(F)F)cc1 ZINC000423296557 1038119404 /nfs/dbraw/zinc/11/94/04/1038119404.db2.gz ZKDLGKANRXVTBL-NEPJUHHUSA-N 2 0 338.373 4.298 20 0 EIADRP C[C@@H](C[NH3+])C[NH2+][C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423304354 1038128715 /nfs/dbraw/zinc/12/87/15/1038128715.db2.gz YKPFDRSDZJPIPR-FZMZJTMJSA-N 2 0 335.904 4.025 20 0 EIADRP C[C@H](C[NH3+])C[NH2+][C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21 ZINC000423304353 1038130423 /nfs/dbraw/zinc/13/04/23/1038130423.db2.gz YKPFDRSDZJPIPR-BXUZGUMPSA-N 2 0 335.904 4.025 20 0 EIADRP CSC1(C[NH2+][C@@H](c2cccnc2)C2CCCCC2)CC[NH+](C)CC1 ZINC000593710153 1038138722 /nfs/dbraw/zinc/13/87/22/1038138722.db2.gz CGXTVHMBGMCAPN-LJQANCHMSA-N 2 0 347.572 4.120 20 0 EIADRP [NH3+]CCCC[NH2+][C@H](c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 ZINC000423328675 1038139477 /nfs/dbraw/zinc/13/94/77/1038139477.db2.gz OCQCSQASTVDNBY-KRWDZBQOSA-N 2 0 340.364 4.262 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[NH2+][C@@H](C)C1 ZINC000423374834 1038155223 /nfs/dbraw/zinc/15/52/23/1038155223.db2.gz KBTFNHLSYHICRN-MQIPJXDCSA-N 2 0 333.476 4.049 20 0 EIADRP Clc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)C[NH2+]C3)CCS2 ZINC000423363651 1038179849 /nfs/dbraw/zinc/17/98/49/1038179849.db2.gz AEKWDMRWQRSHDF-KRWDZBQOSA-N 2 0 330.884 4.270 20 0 EIADRP Clc1ccc([C@@H]2CC[C@H]([NH2+]Cc3ccc4c(c3)C[NH2+]C4)C2)cc1 ZINC000423370775 1038186336 /nfs/dbraw/zinc/18/63/36/1038186336.db2.gz FWAFVZJMMTZTNL-UZLBHIALSA-N 2 0 326.871 4.369 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CC[NH2+]1 ZINC000423385833 1038194379 /nfs/dbraw/zinc/19/43/79/1038194379.db2.gz RCCHAWSARPKDGS-BASLNEPJSA-N 2 0 326.406 4.072 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+][C@@H]1CC[NH2+]C[C@H]1C ZINC000423392759 1038198667 /nfs/dbraw/zinc/19/86/67/1038198667.db2.gz MACWNAVUTASONN-BFQNTYOBSA-N 2 0 349.931 4.421 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@H](Cc2ccccc2Cl)c2ccsc2)CC[NH2+]1 ZINC000423393603 1038199790 /nfs/dbraw/zinc/19/97/90/1038199790.db2.gz YZJWHDYMABKGPC-MZMPZRCHSA-N 2 0 334.916 4.415 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H]1CC[NH2+][C@H](C)C1 ZINC000423376831 1038204598 /nfs/dbraw/zinc/20/45/98/1038204598.db2.gz LHVAFRSKKRPQJL-DYEKYZERSA-N 2 0 333.476 4.049 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CC[NH2+][C@H](C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423405143 1038214608 /nfs/dbraw/zinc/21/46/08/1038214608.db2.gz ZNXLZCIWLYXKHF-YRGRVCCFSA-N 2 0 332.435 4.132 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[C@H](C[NH3+])CC1)[C@H](C)c1nc2ccccc2s1 ZINC000423417234 1038222749 /nfs/dbraw/zinc/22/27/49/1038222749.db2.gz FFEQNABUUIITAP-FZKCQIBNSA-N 2 0 331.529 4.143 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCCc2nc(-c3ccccc3F)sc21 ZINC000423446800 1038224313 /nfs/dbraw/zinc/22/43/13/1038224313.db2.gz ZCJNAFYAASLWCP-CJNGLKHVSA-N 2 0 347.503 4.434 20 0 EIADRP Cc1nc(-c2cc([C@H](C)[NH2+][C@@H]3C[C@H]3C3CC[NH2+]CC3)cs2)cs1 ZINC000423449380 1038226922 /nfs/dbraw/zinc/22/69/22/1038226922.db2.gz WIYFFXISDWLVPM-KNXALSJPSA-N 2 0 347.553 4.219 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 ZINC000423439601 1038237745 /nfs/dbraw/zinc/23/77/45/1038237745.db2.gz SLXCRQYEXIYHNE-CJNGLKHVSA-N 2 0 347.503 4.434 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CCC[C@H]([NH3+])C1)c1ccc(Br)cc1 ZINC000423461236 1038241115 /nfs/dbraw/zinc/24/11/15/1038241115.db2.gz NSXZHZZKTCDMHI-KCXAZCMYSA-N 2 0 325.294 4.007 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000423478566 1038248560 /nfs/dbraw/zinc/24/85/60/1038248560.db2.gz TYBNDJBLPOVVMF-JCURWCKSSA-N 2 0 326.406 4.264 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CCC[C@H]1CCC[NH2+]1 ZINC000423479716 1038251694 /nfs/dbraw/zinc/25/16/94/1038251694.db2.gz MOJRHFMIZZTCHS-GUYCJALGSA-N 2 0 347.503 4.440 20 0 EIADRP C[C@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1cnn(C2CCCC2)c1 ZINC000423499460 1038255210 /nfs/dbraw/zinc/25/52/10/1038255210.db2.gz AYPYWIDUSATFRY-OXJNMPFZSA-N 2 0 326.488 4.129 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423493606 1038265084 /nfs/dbraw/zinc/26/50/84/1038265084.db2.gz QHJUENNMIPZETK-OBJOEFQTSA-N 2 0 332.435 4.119 20 0 EIADRP C[C@@H]([NH2+][C@@H](CCC[NH3+])c1ccccc1)c1ccc(F)cc1N(C)C ZINC000423513982 1038270006 /nfs/dbraw/zinc/27/00/06/1038270006.db2.gz WCAYHBXRBMDFFY-BEFAXECRSA-N 2 0 329.463 4.023 20 0 EIADRP COc1ccc([C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)c(C)c1OC ZINC000423519686 1038275668 /nfs/dbraw/zinc/27/56/68/1038275668.db2.gz QDLSNRRWVMCUTF-LPHOPBHVSA-N 2 0 342.483 4.143 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@H]2[NH2+][C@H](CCC[NH3+])c1ccccc1 ZINC000423523106 1038277338 /nfs/dbraw/zinc/27/73/38/1038277338.db2.gz VMTPESQOIQEGPW-NHCUHLMSSA-N 2 0 338.495 4.487 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000423522054 1038278166 /nfs/dbraw/zinc/27/81/66/1038278166.db2.gz XGKUXKFRJJIAGG-ZNZDAUKMSA-N 2 0 332.850 4.286 20 0 EIADRP FC(F)(F)c1ccc([C@H]2CCC[C@H]2[NH2+]CCC2=CC[NH2+]CC2)cc1 ZINC000423544175 1038288542 /nfs/dbraw/zinc/28/85/42/1038288542.db2.gz VZTQAPPWSQYDMZ-QZTJIDSGSA-N 2 0 338.417 4.241 20 0 EIADRP FC(F)Oc1ccc([C@@H](NCCC[NH2+]C2CC2)c2ccccc2)cc1 ZINC000423556915 1038294802 /nfs/dbraw/zinc/29/48/02/1038294802.db2.gz NBOOFVKFAYMBSS-IBGZPJMESA-N 2 0 346.421 4.109 20 0 EIADRP C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc(OCc2ccccc2)cc1 ZINC000423564715 1038295327 /nfs/dbraw/zinc/29/53/27/1038295327.db2.gz SBLYUBZRZOTSQE-GOSISDBHSA-N 2 0 336.479 4.226 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]C1(Cc2ccc(Cl)cc2)CCC1 ZINC000574747779 1038322916 /nfs/dbraw/zinc/32/29/16/1038322916.db2.gz GPNBFJYLIVQSCH-HNNXBMFYSA-N 2 0 343.902 4.318 20 0 EIADRP C[C@@H]([NH2+][C@H]1CSCc2ccccc21)c1cccc(C[NH+](C)C)c1 ZINC000924850102 1038327679 /nfs/dbraw/zinc/32/76/79/1038327679.db2.gz QURGSSKUBFBGLA-QRWLVFNGSA-N 2 0 326.509 4.387 20 0 EIADRP CCCC[NH+]1CCC([NH2+][C@@H]2CCc3[nH]c4ccc(C)cc4c3C2)CC1 ZINC000490123752 1038352777 /nfs/dbraw/zinc/35/27/77/1038352777.db2.gz FAUNACDFFUOBAA-GOSISDBHSA-N 2 0 339.527 4.188 20 0 EIADRP CC[N@@H+]1CC[C@@H](CN[C@H](c2ccccc2)c2ccc(Cl)cc2)C1 ZINC000490167132 1038367193 /nfs/dbraw/zinc/36/71/93/1038367193.db2.gz FYARYIKMISZVGT-OXJNMPFZSA-N 2 0 328.887 4.361 20 0 EIADRP C[C@H](c1ccccc1Br)[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000490296164 1038458934 /nfs/dbraw/zinc/45/89/34/1038458934.db2.gz DAIDTGWHCNMIOH-CHWSQXEVSA-N 2 0 334.261 4.113 20 0 EIADRP C[C@H]1CC2(C[N@@H+]1Cc1csc(C3CCCCC3)n1)CC[NH2+]CC2 ZINC000424290587 1038769284 /nfs/dbraw/zinc/76/92/84/1038769284.db2.gz MXFDIYBCDUUIPA-HNNXBMFYSA-N 2 0 333.545 4.155 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](Cc2ccncc2)c2cccs2)CC1 ZINC000424313267 1038797577 /nfs/dbraw/zinc/79/75/77/1038797577.db2.gz NQWPABKEFWQICE-LJQANCHMSA-N 2 0 343.540 4.139 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@H](CC2CCOCC2)c2ccccc2F)CC1 ZINC001168312282 1038797672 /nfs/dbraw/zinc/79/76/72/1038797672.db2.gz OEMSWEJEUQMKOW-WIXQSORDSA-N 2 0 348.506 4.146 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1)c1ccccc1C(C)(C)C ZINC000539059895 1038806313 /nfs/dbraw/zinc/80/63/13/1038806313.db2.gz FBSIJKKYZDIVOW-NDXORKPFSA-N 2 0 344.543 4.013 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+]([C@H]2CCC[C@H]2O)CC1)c1ccccc1C(C)(C)C ZINC000539059897 1038806363 /nfs/dbraw/zinc/80/63/63/1038806363.db2.gz FBSIJKKYZDIVOW-ORYQWCPZSA-N 2 0 344.543 4.013 20 0 EIADRP FC1(F)CCCC[C@H]1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC001168317150 1038824818 /nfs/dbraw/zinc/82/48/18/1038824818.db2.gz JMQLVUCBIUXYDF-SFHVURJKSA-N 2 0 328.491 4.400 20 0 EIADRP Brc1cccc(C2([NH2+][C@@H]3CC[N@@H+]4CCC[C@H]4C3)CCC2)c1 ZINC000252734256 1038860600 /nfs/dbraw/zinc/86/06/00/1038860600.db2.gz GLCNSMUQVVOPGN-SJORKVTESA-N 2 0 349.316 4.045 20 0 EIADRP CC[NH+](CC)[C@H](CNC1CC[NH+](C2CCCCC2)CC1)c1ccco1 ZINC000119070574 1038862894 /nfs/dbraw/zinc/86/28/94/1038862894.db2.gz ABHKIWGADCWOOS-HXUWFJFHSA-N 2 0 347.547 4.049 20 0 EIADRP CC(C)[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(C(F)(F)F)cc1 ZINC000539163213 1038864772 /nfs/dbraw/zinc/86/47/72/1038864772.db2.gz ONUNWJJIMVWOOT-KSSFIOAISA-N 2 0 340.433 4.476 20 0 EIADRP CC(C)[C@@H]([NH2+]CC1CC[NH+](C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000539203885 1038879297 /nfs/dbraw/zinc/87/92/97/1038879297.db2.gz VREDWGJDOCFXQV-QGZVFWFLSA-N 2 0 328.422 4.334 20 0 EIADRP CCCOc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCCC[N@@H+]2C)cc1OC ZINC000539252276 1038896783 /nfs/dbraw/zinc/89/67/83/1038896783.db2.gz ILKJDAFIPRPSJX-AEFFLSMTSA-N 2 0 334.504 4.009 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCC[C@H]2c2ccc(OC)c(F)c2)C1 ZINC000481039923 1038988301 /nfs/dbraw/zinc/98/83/01/1038988301.db2.gz QINATYYIUFKGPW-KPFFTGBYSA-N 2 0 348.506 4.182 20 0 EIADRP CC[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(OC)cc1 ZINC000089214797 1039023283 /nfs/dbraw/zinc/02/32/83/1039023283.db2.gz AWJIYAJPRQZGDB-OAQYLSRUSA-N 2 0 339.483 4.048 20 0 EIADRP COc1ccc(C[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cc1OCC(C)C ZINC000414809736 1039034545 /nfs/dbraw/zinc/03/45/45/1039034545.db2.gz MWVMWZOAINXSLI-INIZCTEOSA-N 2 0 342.483 4.040 20 0 EIADRP Fc1ccc(-c2nc3c(s2)[C@@H]([NH2+][C@H]2CCC[NH2+]CC2)CCC3)cc1 ZINC000643522394 1039034945 /nfs/dbraw/zinc/03/49/45/1039034945.db2.gz MLKXBJDLBMRLCJ-HOTGVXAUSA-N 2 0 345.487 4.058 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)C[C@@H]([NH2+]Cc1ccc([C@@H](C)[NH3+])cc1)CC3 ZINC000414810800 1039055831 /nfs/dbraw/zinc/05/58/31/1039055831.db2.gz OKEFGHUZXDMJAS-QAPCUYQASA-N 2 0 333.479 4.143 20 0 EIADRP CCCOc1ccc(CN(C)[C@@H]2CC[N@H+](CC)[C@@H](C)C2)cc1OCC ZINC000552071109 1039102516 /nfs/dbraw/zinc/10/25/16/1039102516.db2.gz PTRQOOFOOMKJQX-PKOBYXMFSA-N 2 0 348.531 4.179 20 0 EIADRP C[C@H]([NH2+]CC(C)(C)C[NH+]1CCCC1)c1ccc(OC(F)F)cc1 ZINC000477915571 1039194139 /nfs/dbraw/zinc/19/41/39/1039194139.db2.gz LBUHRGQZMZESMC-AWEZNQCLSA-N 2 0 326.431 4.061 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc2c(c1)CCC2 ZINC000120870868 1039233789 /nfs/dbraw/zinc/23/37/89/1039233789.db2.gz PWSKMGIODQOPKU-OAHLLOKOSA-N 2 0 326.459 4.227 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)c(C)c1OC ZINC000552225100 1039275255 /nfs/dbraw/zinc/27/52/55/1039275255.db2.gz AICKNZZEGWEGDU-SJLPKXTDSA-N 2 0 348.531 4.175 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H](C)[C@@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000481322927 1039292463 /nfs/dbraw/zinc/29/24/63/1039292463.db2.gz NYEMHFXCEYJGSL-MGPQQGTHSA-N 2 0 345.314 4.081 20 0 EIADRP Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)cc1C ZINC000481331014 1039305940 /nfs/dbraw/zinc/30/59/40/1039305940.db2.gz HDZKDCJZAVYJQC-LJQANCHMSA-N 2 0 340.511 4.403 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+][C@@H](C)[C@@H]2COc3ccccc32)cc1 ZINC000090845038 1039307242 /nfs/dbraw/zinc/30/72/42/1039307242.db2.gz NZYHVNFHVORNQK-XFQAVAEZSA-N 2 0 347.462 4.396 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1ccc(Br)s1 ZINC000552246158 1039312090 /nfs/dbraw/zinc/31/20/90/1039312090.db2.gz KLHWSDWYARLXOI-UNXYVOJBSA-N 2 0 331.323 4.034 20 0 EIADRP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C[C@@H]1CC[N@H+](CC)C1 ZINC000481339687 1039319862 /nfs/dbraw/zinc/31/98/62/1039319862.db2.gz QZXOQCIGDRZKGU-GOEBONIOSA-N 2 0 326.937 4.142 20 0 EIADRP Cc1ccccc1CN1CCC([NH2+][C@H]2CCc3c2cccc3F)CC1 ZINC000513857701 1039334264 /nfs/dbraw/zinc/33/42/64/1039334264.db2.gz OWNPSDNDLKXATE-QFIPXVFZSA-N 2 0 338.470 4.376 20 0 EIADRP Cc1cc(CC[NH2+]C2CC[NH+]([C@H]3CCCC[C@@H]3C)CC2)cc(C)c1O ZINC000470132796 1039425507 /nfs/dbraw/zinc/42/55/07/1039425507.db2.gz LPAKSRDOOMWUCN-KKSFZXQISA-N 2 0 344.543 4.184 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@@H](C)c2ccccc2OC(F)F)CC1 ZINC000121709772 1039440024 /nfs/dbraw/zinc/44/00/24/1039440024.db2.gz CSSVFDIBYRYZTO-AWEZNQCLSA-N 2 0 326.431 4.061 20 0 EIADRP CCc1ccc([C@@H](CNC2CC[NH+](C(C)C)CC2)[NH+](CC)CC)cc1 ZINC000550848331 1039600690 /nfs/dbraw/zinc/60/06/90/1039600690.db2.gz RFLVUOLVBNJYGH-JOCHJYFZSA-N 2 0 345.575 4.094 20 0 EIADRP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC000481649446 1039682877 /nfs/dbraw/zinc/68/28/77/1039682877.db2.gz FEZQCEPIQWHHSY-UQPPLGOBSA-N 2 0 342.449 4.346 20 0 EIADRP C[C@H]1C[C@@H](Nc2cc[nH+]c3cc(OC(F)(F)F)ccc23)CC[N@@H+]1C ZINC000899874948 1039756813 /nfs/dbraw/zinc/75/68/13/1039756813.db2.gz QKHDSSPNTCLBMC-RYUDHWBXSA-N 2 0 339.361 4.028 20 0 EIADRP CCC[NH+]1CCC(C[NH2+][C@H](C)c2ccccc2OC(F)F)CC1 ZINC000122705559 1039781023 /nfs/dbraw/zinc/78/10/23/1039781023.db2.gz TUXFTWRFQQZCPI-CQSZACIVSA-N 2 0 326.431 4.061 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@@H](CC(C)C)c2ccccc2C)CC1 ZINC000481937027 1039909852 /nfs/dbraw/zinc/90/98/52/1039909852.db2.gz WAUGNAISHLVYIP-NRFANRHFSA-N 2 0 332.532 4.173 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+]C[C@H]1CC[N@@H+](C2CC2)C1 ZINC000551267687 1040130761 /nfs/dbraw/zinc/13/07/61/1040130761.db2.gz SLEAXSPUKYIQAD-IAGOWNOFSA-N 2 0 339.527 4.298 20 0 EIADRP C[N@H+](Cc1ccccc1)C1CCC([NH2+]Cc2ccc(F)cc2F)CC1 ZINC000551271035 1040133515 /nfs/dbraw/zinc/13/35/15/1040133515.db2.gz JKRJOOLDTGWQQE-UHFFFAOYSA-N 2 0 344.449 4.498 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CCC[N@@H+](C(C)C)C1)c1ccc(OC(F)F)cc1 ZINC000482328907 1040180405 /nfs/dbraw/zinc/18/04/05/1040180405.db2.gz IVLIDVYIAYJZSV-YJBOKZPZSA-N 2 0 340.458 4.449 20 0 EIADRP Cc1cccnc1C(C)(C)C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2C)CC1 ZINC000514820439 1040272326 /nfs/dbraw/zinc/27/23/26/1040272326.db2.gz MMJJLVIZNWDSHU-YLJYHZDGSA-N 2 0 343.559 4.300 20 0 EIADRP Cc1cc2[nH]c(C[NH2+]Cc3ccc(F)c(C[NH+](C)C)c3)cc2c(C)c1 ZINC000479375918 1040294812 /nfs/dbraw/zinc/29/48/12/1040294812.db2.gz HBHHXFVGVCMBKN-UHFFFAOYSA-N 2 0 339.458 4.275 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@H](Cc2cccc(F)c2)c2cccc(F)c2)CC1 ZINC000482558671 1040348593 /nfs/dbraw/zinc/34/85/93/1040348593.db2.gz LVLGEWQBNYOXFA-OAQYLSRUSA-N 2 0 344.449 4.180 20 0 EIADRP COc1ccccc1-c1ccc(C[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000666995138 1040408394 /nfs/dbraw/zinc/40/83/94/1040408394.db2.gz DSTQNGYEFRWYAE-LJQANCHMSA-N 2 0 336.479 4.127 20 0 EIADRP CCC1CCC([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)CC1 ZINC000551568897 1040419014 /nfs/dbraw/zinc/41/90/14/1040419014.db2.gz HHRMRRYIBNVKSZ-UHFFFAOYSA-N 2 0 330.516 4.218 20 0 EIADRP Fc1ccc(-c2ccc(C[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)s2)cc1 ZINC000666998515 1040420977 /nfs/dbraw/zinc/42/09/77/1040420977.db2.gz YCORIRMSGPXENZ-INIZCTEOSA-N 2 0 330.472 4.319 20 0 EIADRP CCC1(Cc2ccccc2)CC[NH+]([C@@H]2CC[N@@H+]3CCC[C@H]3C2)CC1 ZINC000479540537 1040446481 /nfs/dbraw/zinc/44/64/81/1040446481.db2.gz GHACOGIEPKFVBY-LEWJYISDSA-N 2 0 326.528 4.348 20 0 EIADRP CC[NH+]1CCC(N(C)Cc2cc(Cl)ccc2OCC2CC2)CC1 ZINC000482775928 1040480790 /nfs/dbraw/zinc/48/07/90/1040480790.db2.gz BYAFBCPJULRBPG-UHFFFAOYSA-N 2 0 336.907 4.045 20 0 EIADRP COc1cc2c(NC[C@H](c3cccs3)[NH+](C)C)cc[nH+]c2cc1F ZINC000479855407 1040710967 /nfs/dbraw/zinc/71/09/67/1040710967.db2.gz ZCELWYXZBSHRTN-MRXNPFEDSA-N 2 0 345.443 4.159 20 0 EIADRP Cc1c([C@H](C)NCC(C)(C)C[NH+](C)C)cnn1-c1cccc(Cl)c1 ZINC000479871024 1040732871 /nfs/dbraw/zinc/73/28/71/1040732871.db2.gz FFGPKYFEGYFEQM-AWEZNQCLSA-N 2 0 348.922 4.073 20 0 EIADRP C[C@@H]([NH2+][C@H]1CSc2ccccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000483157363 1040742576 /nfs/dbraw/zinc/74/25/76/1040742576.db2.gz RNYDWRSXSDZQCV-BEFAXECRSA-N 2 0 342.508 4.125 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2ccc(OCC3CC3)cc2)CC1 ZINC000483171192 1040754103 /nfs/dbraw/zinc/75/41/03/1040754103.db2.gz BIZHTIQNEBOVOX-UHFFFAOYSA-N 2 0 330.516 4.029 20 0 EIADRP C[C@H]([NH2+]CCOC1CCCCCC1)c1cccc(OCC[NH+](C)C)c1 ZINC000483191980 1040765820 /nfs/dbraw/zinc/76/58/20/1040765820.db2.gz FYMHICCKARUOIL-SFHVURJKSA-N 2 0 348.531 4.017 20 0 EIADRP Fc1cccc(-c2ccc(CN3CC[C@@H](C[NH+]4CCCC4)C3)o2)c1F ZINC000483263685 1040798457 /nfs/dbraw/zinc/79/84/57/1040798457.db2.gz PGAPSOMFZZCLCB-HNNXBMFYSA-N 2 0 346.421 4.143 20 0 EIADRP CCC[N@H+](C)C[C@H]1CCN(Cc2ccc(-c3cccc(F)c3F)o2)C1 ZINC000483295837 1040807941 /nfs/dbraw/zinc/80/79/41/1040807941.db2.gz ZZIIQRCVOXXBNU-OAHLLOKOSA-N 2 0 348.437 4.389 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cc(Cl)cc(Cl)c2OC)C[C@H]1C ZINC000539816805 1040809263 /nfs/dbraw/zinc/80/92/63/1040809263.db2.gz DIRFXEZYNUPJKL-IUODEOHRSA-N 2 0 345.314 4.307 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2ccc(F)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000539816874 1040809780 /nfs/dbraw/zinc/80/97/80/1040809780.db2.gz BKSUWNBVUFUJND-WBMJQRKESA-N 2 0 332.385 4.007 20 0 EIADRP CSc1ccc(C[N@H+](C)C[C@H]2CC[NH+](Cc3ccccc3)C2)cc1 ZINC000539830615 1040824168 /nfs/dbraw/zinc/82/41/68/1040824168.db2.gz IOSGFQKDSVALQG-HXUWFJFHSA-N 2 0 340.536 4.362 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cnc(-c3ccc(C)cc3)s2)[C@H](C)C1 ZINC000539835703 1040828050 /nfs/dbraw/zinc/82/80/50/1040828050.db2.gz PAMZFRRVIUKVTQ-APWZRJJASA-N 2 0 343.540 4.281 20 0 EIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000480007906 1040849964 /nfs/dbraw/zinc/84/99/64/1040849964.db2.gz KSZYCRIKOKMRPD-WOJBJXKFSA-N 2 0 346.559 4.328 20 0 EIADRP Cc1cn2c(n1)[C@@H](C[NH2+][C@H]1C[C@H](C)Sc3sccc31)CCC2 ZINC000483432575 1040856731 /nfs/dbraw/zinc/85/67/31/1040856731.db2.gz JDTUDKMXKHTMEV-GUTXKFCHSA-N 2 0 333.526 4.346 20 0 EIADRP C[N@@H+]1CCC[C@H]2C[NH+](CCCOc3ccc4ccccc4c3)CC[C@H]21 ZINC000483479438 1040872875 /nfs/dbraw/zinc/87/28/75/1040872875.db2.gz DWSGJCBCXCTQIF-RBBKRZOGSA-N 2 0 338.495 4.025 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](c2ccccc2F)C2CCOCC2)C1 ZINC000903090961 1040898712 /nfs/dbraw/zinc/89/87/12/1040898712.db2.gz KAKOUIHRIQXDMR-UTKZUKDTSA-N 2 0 348.506 4.003 20 0 EIADRP CC[NH+]1CCC(CC[NH2+]Cc2cccc(OC3CCCC3)c2)CC1 ZINC000462767711 1040903158 /nfs/dbraw/zinc/90/31/58/1040903158.db2.gz NFPNAIGARZRTOX-UHFFFAOYSA-N 2 0 330.516 4.220 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)c1cscn1 ZINC000537944566 1040910663 /nfs/dbraw/zinc/91/06/63/1040910663.db2.gz GHSOJDIGEDRANI-SOLBZPMBSA-N 2 0 329.513 4.094 20 0 EIADRP CC[C@H]1CCC[C@@H]([NH2+]CC2CC[NH+](Cc3ccc(OC)cc3)CC2)C1 ZINC000462772424 1040928960 /nfs/dbraw/zinc/92/89/60/1040928960.db2.gz JZUWGSGSURZVFM-GHTZIAJQSA-N 2 0 344.543 4.466 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH2+][C@@H](C)c2ccc(OCC[NH+](C)C)cc2)o1 ZINC000483660549 1040939457 /nfs/dbraw/zinc/93/94/57/1040939457.db2.gz MDEVBPUJCLPZNV-WMZOPIPTSA-N 2 0 344.499 4.200 20 0 EIADRP Cc1cccc2c1CC[C@H]2[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1 ZINC000537981112 1040955313 /nfs/dbraw/zinc/95/53/13/1040955313.db2.gz XVCHPLRVYUZQGC-HTAPYJJXSA-N 2 0 338.495 4.274 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H](C)[N@H+](C)C[C@@H]3C)cc2)cc1 ZINC000537988488 1040965555 /nfs/dbraw/zinc/96/55/55/1040965555.db2.gz VGGQQABYWYUOLS-PNLZDCPESA-N 2 0 338.495 4.181 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)c2ccccc2Br)CC1 ZINC000483722467 1040972451 /nfs/dbraw/zinc/97/24/51/1040972451.db2.gz DIYZXVICCHAIQY-CQSZACIVSA-N 2 0 339.321 4.222 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@@H]3CC[C@H](c4ccccc4)C3)C2)cc1 ZINC000436241153 1040990501 /nfs/dbraw/zinc/99/05/01/1040990501.db2.gz QNCYICSGDBNDEB-YFNKSVMNSA-N 2 0 348.534 4.477 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)Cc1cccs1 ZINC000483748823 1040997980 /nfs/dbraw/zinc/99/79/80/1040997980.db2.gz WPWKFRSQHNKBTI-SJORKVTESA-N 2 0 346.540 4.218 20 0 EIADRP C[C@H]1Cc2ccc(F)cc2[C@H]1[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000480170112 1041030508 /nfs/dbraw/zinc/03/05/08/1041030508.db2.gz XVXNOWSEXRVFKO-AOMKIAJQSA-N 2 0 338.470 4.445 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)CC(C)(C)c2c[nH]c3ccccc32)C1 ZINC000462889308 1041051029 /nfs/dbraw/zinc/05/10/29/1041051029.db2.gz SJINKFOZHFMYAK-DLBZAZTESA-N 2 0 327.516 4.156 20 0 EIADRP C[N@@H+]1CCC[C@@H](CNc2cc[nH+]c3ccccc23)[C@@H]1c1cccs1 ZINC000462880166 1041063407 /nfs/dbraw/zinc/06/34/07/1041063407.db2.gz AYCYIJGZNYDHIW-MGPUTAFESA-N 2 0 337.492 4.213 20 0 EIADRP C[C@H]([NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)c1cscn1 ZINC000903454380 1041067626 /nfs/dbraw/zinc/06/76/26/1041067626.db2.gz BPRHLOCYAWICET-WZGPROSRSA-N 2 0 341.524 4.094 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@@H]1[NH2+]Cc1ccc(Sc2ccccc2)cc1 ZINC000540148279 1041194224 /nfs/dbraw/zinc/19/42/24/1041194224.db2.gz YKEWNEZPRJDYCY-UZLBHIALSA-N 2 0 326.509 4.268 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CC2CC[NH+](CCC(C)C)CC2)cc1F ZINC000484293328 1041197456 /nfs/dbraw/zinc/19/74/56/1041197456.db2.gz KOVMIUGLFWPEOA-MRXNPFEDSA-N 2 0 336.495 4.243 20 0 EIADRP Cc1cc(C)cc(OC[C@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167960764 1041201310 /nfs/dbraw/zinc/20/13/10/1041201310.db2.gz BURNLQVMBHECDN-XSLAUPDRSA-N 2 0 342.527 4.066 20 0 EIADRP CCO[C@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC000484316752 1041207479 /nfs/dbraw/zinc/20/74/79/1041207479.db2.gz ZOTCIHCIKUFDQS-GXTWGEPZSA-N 2 0 333.303 4.001 20 0 EIADRP CC[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1ccc(Cl)s1 ZINC000540172344 1041216076 /nfs/dbraw/zinc/21/60/76/1041216076.db2.gz AHHVLYODOODIHU-KFWWJZLASA-N 2 0 344.952 4.332 20 0 EIADRP CC(C)CC[C@H](C)[NH2+][C@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000538268474 1041228293 /nfs/dbraw/zinc/22/82/93/1041228293.db2.gz IPWGAYMBBALKIE-HKUYNNGSSA-N 2 0 330.516 4.389 20 0 EIADRP C[NH+](C)[C@@H]1CCC[C@H]([NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)C1 ZINC000484472559 1041247262 /nfs/dbraw/zinc/24/72/62/1041247262.db2.gz KVMMPHJPXGJDCA-JJRVBVJISA-N 2 0 342.405 4.035 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(F)c(Br)c1 ZINC000484481749 1041273514 /nfs/dbraw/zinc/27/35/14/1041273514.db2.gz AEMUEQBZBVNVCM-FPMFFAJLSA-N 2 0 343.284 4.112 20 0 EIADRP c1c2ccncc2sc1C[NH+]1CCC(CCC[NH+]2CCCC2)CC1 ZINC000667680486 1041340972 /nfs/dbraw/zinc/34/09/72/1041340972.db2.gz IGEXNKDPCOYVJV-UHFFFAOYSA-N 2 0 343.540 4.384 20 0 EIADRP CCc1nc(C)c([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)s1 ZINC000480601799 1041412883 /nfs/dbraw/zinc/41/28/83/1041412883.db2.gz BOBDJYXHAHISHN-OAGGEKHMSA-N 2 0 337.577 4.423 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1cc(F)c(F)c(F)c1 ZINC000480606331 1041430687 /nfs/dbraw/zinc/43/06/87/1041430687.db2.gz DDHUWCMPJAZXFO-UONOGXRCSA-N 2 0 328.422 4.267 20 0 EIADRP Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccc(C[N@@H+]2CCC[C@@H](C)C2)cc1 ZINC000924668088 1041438518 /nfs/dbraw/zinc/43/85/18/1041438518.db2.gz OIPCMYGZFPIQCS-CVEARBPZSA-N 2 0 341.499 4.374 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]C1CC(C[NH3+])C1 ZINC000904361997 1041450249 /nfs/dbraw/zinc/45/02/49/1041450249.db2.gz FIXIDAPIHNDZDX-VLRKGOCCSA-N 2 0 335.904 4.160 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc(OCC2CC2)cc1 ZINC000480659345 1041458943 /nfs/dbraw/zinc/45/89/43/1041458943.db2.gz FLWYDUWMAUDAFJ-SFHVURJKSA-N 2 0 330.516 4.220 20 0 EIADRP C[C@@H]1CCC[C@H]([NH2+][C@H]2CC3(CC[NH+](C)CC3)Oc3ccccc32)[C@@H]1C ZINC000540467219 1041472603 /nfs/dbraw/zinc/47/26/03/1041472603.db2.gz DTIWEAGNBNALIW-JYBIWHBTSA-N 2 0 342.527 4.389 20 0 EIADRP COCCC[C@H](C)[NH2+]Cc1ccccc1C[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC000480693541 1041476495 /nfs/dbraw/zinc/47/64/95/1041476495.db2.gz CMYZSRXIODLASE-FHWLQOOXSA-N 2 0 332.532 4.069 20 0 EIADRP COc1cc([C@H](C)[NH2+]C[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1F ZINC000195133215 1041484351 /nfs/dbraw/zinc/48/43/51/1041484351.db2.gz KOGIPFUHFQOKQY-WMZOPIPTSA-N 2 0 342.458 4.007 20 0 EIADRP CC(C)(C[NH3+])C1CC[NH+](Cc2cnc(-c3cccs3)s2)CC1 ZINC000904442707 1041487053 /nfs/dbraw/zinc/48/70/53/1041487053.db2.gz FETKOJNLPUKDBB-UHFFFAOYSA-N 2 0 335.542 4.069 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc3cc(OC)ccc3c2)C[C@H]1C ZINC000538718696 1041487703 /nfs/dbraw/zinc/48/77/03/1041487703.db2.gz IGLRUKDKEUFGHL-OXQOHEQNSA-N 2 0 326.484 4.153 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](Cc2cnc(C3CC3)s2)CC1 ZINC000538721343 1041490816 /nfs/dbraw/zinc/49/08/16/1041490816.db2.gz DDRYBWSEMDZQAI-MRXNPFEDSA-N 2 0 347.572 4.497 20 0 EIADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]C1CC[NH+]([C@H]2CCCC[C@@H]2C)CC1 ZINC000480732573 1041497076 /nfs/dbraw/zinc/49/70/76/1041497076.db2.gz SOZSITHMHXIRFA-VMXMFDLUSA-N 2 0 336.564 4.213 20 0 EIADRP C[N@H+](C[C@H]1C[C@H]1c1ccccc1)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000538731490 1041500831 /nfs/dbraw/zinc/50/08/31/1041500831.db2.gz PGEYQDXHYOLBLN-WWNPGLIZSA-N 2 0 334.507 4.244 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@@H](C)c2cccc(F)c2)cc1 ZINC000480739388 1041512278 /nfs/dbraw/zinc/51/22/78/1041512278.db2.gz SHZRMQDGXXDRJN-KRWDZBQOSA-N 2 0 344.474 4.397 20 0 EIADRP c1sc2ccccc2c1C[N@@H+]1CC[C@H]2[C@@H](CCC[NH+]2C2CC2)C1 ZINC000538799447 1041538813 /nfs/dbraw/zinc/53/88/13/1041538813.db2.gz GDYBWSBGAIJXDZ-KXBFYZLASA-N 2 0 326.509 4.350 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@@H](Cc2ccc(Cl)cc2)c2ccccc2)CC1 ZINC000540606569 1041560325 /nfs/dbraw/zinc/56/03/25/1041560325.db2.gz LWOYDULCWRLGHY-NRFANRHFSA-N 2 0 340.898 4.475 20 0 EIADRP C[C@H](c1ccc(OC(F)F)cc1)N1CCC([NH+]2CCCCC2)CC1 ZINC000138355831 1041585157 /nfs/dbraw/zinc/58/51/57/1041585157.db2.gz AFAWXMWRSKOGEP-OAHLLOKOSA-N 2 0 338.442 4.299 20 0 EIADRP c1ccc(CC[C@H](Cc2ccccc2)[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000461799872 1041593050 /nfs/dbraw/zinc/59/30/50/1041593050.db2.gz XEAKXVZMZKISIX-TZRRMPRUSA-N 2 0 348.534 4.447 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1C[C@H](C)[N@H+](Cc2ccccc2)C1)c1ccc(F)cn1 ZINC000539040590 1041616604 /nfs/dbraw/zinc/61/66/04/1041616604.db2.gz DNZHJXOMVWBMAS-JENIJYKNSA-N 2 0 341.474 4.172 20 0 EIADRP CC(C)[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1ccc(OCC[NH+](C)C)cc1 ZINC000437101882 1041660506 /nfs/dbraw/zinc/66/05/06/1041660506.db2.gz FDFOUSWFXFQUTM-RHSMWYFYSA-N 2 0 346.437 4.255 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC[C@@H]([C@@H]3CCOC3)C2)c1 ZINC000464069681 1041853972 /nfs/dbraw/zinc/85/39/72/1041853972.db2.gz FGTNTOHZIQVIRM-YPAWHYETSA-N 2 0 344.543 4.212 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCC[C@H]([C@@H]3CCOC3)C2)c1 ZINC000464069678 1041854018 /nfs/dbraw/zinc/85/40/18/1041854018.db2.gz FGTNTOHZIQVIRM-BHDDXSALSA-N 2 0 344.543 4.212 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H]([NH2+]Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 ZINC000414909756 1041855306 /nfs/dbraw/zinc/85/53/06/1041855306.db2.gz CKIUBBMSXKSADX-CHWSQXEVSA-N 2 0 340.311 4.084 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+][C@H]2CCCc3cc(N)ccc32)CC1 ZINC000414910775 1041869288 /nfs/dbraw/zinc/86/92/88/1041869288.db2.gz CSBFVBOVHXPIBX-XGRCMKMKSA-N 2 0 341.543 4.279 20 0 EIADRP CC[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)CC(F)(F)F ZINC000402688695 1041947501 /nfs/dbraw/zinc/94/75/01/1041947501.db2.gz HENLUERVXJSJIO-RYRKJORJSA-N 2 0 342.449 4.465 20 0 EIADRP C[C@H](CCC(F)(F)F)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000541555751 1042010940 /nfs/dbraw/zinc/01/09/40/1042010940.db2.gz IRZJHNOWVWWJBG-HLLBOEOZSA-N 2 0 328.422 4.218 20 0 EIADRP c1ccc(OCCCCC[N@@H+]2CC[C@@H]3[C@H](CCC[NH+]3C3CC3)C2)cc1 ZINC000438121442 1042062046 /nfs/dbraw/zinc/06/20/46/1042062046.db2.gz PKEDYNLRPXFFJI-DENIHFKCSA-N 2 0 342.527 4.184 20 0 EIADRP CCCCCOc1ccc(C[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)cc1 ZINC000517547199 1042076461 /nfs/dbraw/zinc/07/64/61/1042076461.db2.gz JQOXYCWTUPIUNR-HXUWFJFHSA-N 2 0 332.532 4.466 20 0 EIADRP C[C@@H](C[NH2+][C@H]1CCCc2nc(-c3ccccc3F)sc21)C[NH+](C)C ZINC000425955487 1042078895 /nfs/dbraw/zinc/07/88/95/1042078895.db2.gz ZYPGDKRCFKQRHJ-BBRMVZONSA-N 2 0 347.503 4.114 20 0 EIADRP C[C@@H]([NH2+]CCCOc1ccc(F)cc1)c1cccc(-n2ccnc2)c1 ZINC000542010147 1042230651 /nfs/dbraw/zinc/23/06/51/1042230651.db2.gz WMJKEUYSTCWBAB-MRXNPFEDSA-N 2 0 339.414 4.131 20 0 EIADRP [NH3+][C@@H]1CCC[C@H](C[NH2+]Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000414989502 1042556705 /nfs/dbraw/zinc/55/67/05/1042556705.db2.gz HFJZHOQQHBZWDY-DZGCQCFKSA-N 2 0 334.410 4.048 20 0 EIADRP CCCCOc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167964269 1042572019 /nfs/dbraw/zinc/57/20/19/1042572019.db2.gz OFEHWOZKZDTKBQ-SEJPIABJSA-N 2 0 342.527 4.361 20 0 EIADRP Cc1cccnc1CCC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000296349050 1042576952 /nfs/dbraw/zinc/57/69/52/1042576952.db2.gz IGAFZNYFIKOGPE-KOUNCHBCSA-N 2 0 349.522 4.108 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310473096 1042837817 /nfs/dbraw/zinc/83/78/17/1042837817.db2.gz BXUBODHVCUMBPF-SQGPQFPESA-N 2 0 326.459 4.387 20 0 EIADRP COc1ccc(C)cc1[C@@H](C)[NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310970371 1042848677 /nfs/dbraw/zinc/84/86/77/1042848677.db2.gz DDQQVYWGAWSCGW-QUCCMNQESA-N 2 0 338.495 4.176 20 0 EIADRP C[C@@H]([NH2+]Cc1coc2ccccc12)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311129923 1042853541 /nfs/dbraw/zinc/85/35/41/1042853541.db2.gz WJBKMGOAOKRSBJ-MJGOQNOKSA-N 2 0 334.463 4.433 20 0 EIADRP CCCOc1cccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000311221593 1042855272 /nfs/dbraw/zinc/85/52/72/1042855272.db2.gz VGIXUEVRUDCTMN-OAQYLSRUSA-N 2 0 338.495 4.087 20 0 EIADRP COc1ccc(F)cc1[C@H](C)NC1CC[NH+](Cc2ccccc2)CC1 ZINC000237182382 1042874642 /nfs/dbraw/zinc/87/46/42/1042874642.db2.gz BKFURRCDALGCFC-INIZCTEOSA-N 2 0 342.458 4.150 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](C)[C@H](OC)c2ccccc2)c1 ZINC000493905185 1042974281 /nfs/dbraw/zinc/97/42/81/1042974281.db2.gz HBVMIRPPKPMYKF-UWJYYQICSA-N 2 0 326.484 4.004 20 0 EIADRP CC[C@@H]1C[C@H](C[NH+]2CCC(CC[N@@H+]3CCCC[C@@H]3C)CC2)CCO1 ZINC000507791854 1042974666 /nfs/dbraw/zinc/97/46/66/1042974666.db2.gz DEELGINHOSLZLF-CEWLAPEOSA-N 2 0 336.564 4.168 20 0 EIADRP COC[C@H]([NH2+]CCCC[NH+]1CCC(C)CC1)c1ccc(Cl)cc1 ZINC000493895418 1042978563 /nfs/dbraw/zinc/97/85/63/1042978563.db2.gz WXZLXWUYUILZAN-IBGZPJMESA-N 2 0 338.923 4.129 20 0 EIADRP C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1N(C)C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183198617 1043039732 /nfs/dbraw/zinc/03/97/32/1043039732.db2.gz FPTWWGJFYBMTKI-IXDOHACOSA-N 2 0 347.522 4.195 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(Oc3ccccc3)o2)C[C@@H]1C ZINC000507809879 1043042159 /nfs/dbraw/zinc/04/21/59/1043042159.db2.gz AMADFQBSMHULST-DLBZAZTESA-N 2 0 328.456 4.377 20 0 EIADRP CCc1ccc(C[NH2+]C[C@H]2CCC[N@H+](Cc3ccccc3)C2)s1 ZINC000309862454 1043084568 /nfs/dbraw/zinc/08/45/68/1043084568.db2.gz DOIGIMJMPNFNCI-GOSISDBHSA-N 2 0 328.525 4.312 20 0 EIADRP Cc1cncc([C@@H](C)[NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)c1 ZINC000184265857 1043086381 /nfs/dbraw/zinc/08/63/81/1043086381.db2.gz VRPUQTYFPZAWMN-LJQANCHMSA-N 2 0 337.511 4.473 20 0 EIADRP Cc1cncc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCC[C@H](C)C2)c1 ZINC000184280783 1043086841 /nfs/dbraw/zinc/08/68/41/1043086841.db2.gz JZALDHCWWVLQOK-PKOBYXMFSA-N 2 0 337.511 4.473 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2[nH]ccc2c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000311138178 1043225043 /nfs/dbraw/zinc/22/50/43/1043225043.db2.gz YESBTBOHVFOTRS-DYESRHJHSA-N 2 0 333.479 4.168 20 0 EIADRP c1ccc(C(CC[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c2ccccc2)cc1 ZINC000165941855 1043262778 /nfs/dbraw/zinc/26/27/78/1043262778.db2.gz KVWMXYLAHDLPIP-FGZHOGPDSA-N 2 0 334.507 4.425 20 0 EIADRP CCc1nc(C)c(CN(C)[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)o1 ZINC000428242692 1043461506 /nfs/dbraw/zinc/46/15/06/1043461506.db2.gz WEBWELBOWQSTNO-VQIMIIECSA-N 2 0 341.499 4.030 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)[C@H](C)C2 ZINC000665273490 1043508771 /nfs/dbraw/zinc/50/87/71/1043508771.db2.gz XYEDBKUSCRSIGP-AVPCASRZSA-N 2 0 348.490 4.074 20 0 EIADRP C(=C/C[N@@H+]1CCC[C@@H]1c1ccccn1)\C[NH+]1CCC[C@@H]1c1ccccn1 ZINC000674371430 1043646414 /nfs/dbraw/zinc/64/64/14/1043646414.db2.gz QRCNTDULJDXPFL-QDWIBDRMSA-N 2 0 348.494 4.007 20 0 EIADRP C[C@H](CC[NH2+][C@@H]1CCCC[C@@H]1[C@@H]1CCOC1)[N@H+](C)Cc1ccccc1 ZINC000474035180 1043696912 /nfs/dbraw/zinc/69/69/12/1043696912.db2.gz OWLPQOXPLDYQJO-ZHHKINOHSA-N 2 0 344.543 4.082 20 0 EIADRP COCCC[C@@H]([NH2+]CCC[NH+]1CCC(C)CC1)c1ccc(F)cc1 ZINC000442643871 1043791157 /nfs/dbraw/zinc/79/11/57/1043791157.db2.gz GUQVXWVGZAZQDG-HXUWFJFHSA-N 2 0 336.495 4.005 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(OCC[NH+](C)C)c1)c1csc(Cl)c1 ZINC000191184361 1043792249 /nfs/dbraw/zinc/79/22/49/1043792249.db2.gz IBQBFLSRZWSKHZ-CYBMUJFWSA-N 2 0 338.904 4.193 20 0 EIADRP CC1(C)CC([NH2+]Cc2ccc3c(c2)CCC(C)(C)O3)CC(C)(C)[NH2+]1 ZINC000731675758 1043815206 /nfs/dbraw/zinc/81/52/06/1043815206.db2.gz XSXCSSIVDKUNFY-UHFFFAOYSA-N 2 0 330.516 4.189 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000442762945 1043826126 /nfs/dbraw/zinc/82/61/26/1043826126.db2.gz ALTCDVXYEGCYNG-UKPHBRMFSA-N 2 0 328.422 4.271 20 0 EIADRP C[C@H]([NH2+]C1[C@H](C)C[NH+](Cc2ccccc2)C[C@H]1C)c1cccc(O)c1 ZINC000442779927 1043831343 /nfs/dbraw/zinc/83/13/43/1043831343.db2.gz MEMAFWKKJBGKGW-KURKYZTESA-N 2 0 338.495 4.199 20 0 EIADRP c1ccc(N2CCC([NH2+]C(C3CCCC3)C3CCCC3)CC2)nc1 ZINC000766066569 1043860494 /nfs/dbraw/zinc/86/04/94/1043860494.db2.gz UFQLIGOAXDJWJQ-UHFFFAOYSA-N 2 0 327.516 4.389 20 0 EIADRP CCC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccccc1 ZINC000658166706 1043942005 /nfs/dbraw/zinc/94/20/05/1043942005.db2.gz OEVQLQIBJDOVFN-JOCHJYFZSA-N 2 0 337.511 4.425 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1cc2ccccc2o1 ZINC000658166793 1043943227 /nfs/dbraw/zinc/94/32/27/1043943227.db2.gz OZLOIYJLXRBMRR-KRWDZBQOSA-N 2 0 349.478 4.391 20 0 EIADRP C[C@H]([NH2+]CCc1ccc(F)cc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000428271200 1044066154 /nfs/dbraw/zinc/06/61/54/1044066154.db2.gz YHMKTQBJKAQMKQ-GOEBONIOSA-N 2 0 338.898 4.264 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@H](C)c2ccc(Br)cc2)CC1 ZINC000226313305 1044119927 /nfs/dbraw/zinc/11/99/27/1044119927.db2.gz GMPIIBFRLPIIPQ-CQSZACIVSA-N 2 0 339.321 4.220 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+][C@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000348008054 1044360463 /nfs/dbraw/zinc/36/04/63/1044360463.db2.gz OESZMOOTNXPZQK-OXQOHEQNSA-N 2 0 342.531 4.198 20 0 EIADRP CC(C)CC[C@H]1CC[C@@H]([NH2+]CC2CC[NH+](C3CCOCC3)CC2)C1 ZINC000657538346 1044381304 /nfs/dbraw/zinc/38/13/04/1044381304.db2.gz ZORLYHKDAKLIRF-AZUAARDMSA-N 2 0 336.564 4.072 20 0 EIADRP CCn1c2ccccc2c2cc(C[NH2+][C@@H]3CC[N@H+](C)[C@H](C)C3)ccc21 ZINC000327016913 1044404603 /nfs/dbraw/zinc/40/46/03/1044404603.db2.gz HMJOJOWVVUOPHZ-SJLPKXTDSA-N 2 0 335.495 4.387 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+]Cc1ccc(C2CCC2)cc1 ZINC000494847584 1044441147 /nfs/dbraw/zinc/44/11/47/1044441147.db2.gz UMHRYLNAEAUDFE-UHFFFAOYSA-N 2 0 332.451 4.133 20 0 EIADRP CN1CCC([NH2+][C@@H](Cc2ccccc2Cl)c2ccccc2)CC1 ZINC000675733722 1044452362 /nfs/dbraw/zinc/45/23/62/1044452362.db2.gz KEVAMFRZQHJEFF-FQEVSTJZSA-N 2 0 328.887 4.308 20 0 EIADRP Cc1nc(-c2ccc([C@@H](C)[NH2+][C@@H](C)C3CC[NH+](C)CC3)cc2)cs1 ZINC000675735437 1044453350 /nfs/dbraw/zinc/45/33/50/1044453350.db2.gz JIAPCDIHHNTABZ-CABCVRRESA-N 2 0 343.540 4.499 20 0 EIADRP CCC[NH+]1CCC([NH2+]CCCc2cccc(C(F)(F)F)c2)CC1 ZINC000675771082 1044484961 /nfs/dbraw/zinc/48/49/61/1044484961.db2.gz INQISLQZRFBCMG-UHFFFAOYSA-N 2 0 328.422 4.102 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H](C)Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000675784418 1044495249 /nfs/dbraw/zinc/49/52/49/1044495249.db2.gz GGEQGGKWPMOTML-CQSZACIVSA-N 2 0 328.422 4.100 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H]2CCCC[C@H]2c2ccc(OC)c(F)c2)CC1 ZINC000675818720 1044514433 /nfs/dbraw/zinc/51/44/33/1044514433.db2.gz IPAUVTJYKUKGNT-AZUAARDMSA-N 2 0 348.506 4.182 20 0 EIADRP C[C@H](C[NH2+][C@H](C[C@@H]1CCOC1)c1ccc(F)cc1)C[NH+]1CCCCC1 ZINC000494926700 1044524168 /nfs/dbraw/zinc/52/41/68/1044524168.db2.gz YSMOKHMCHGJFCK-LVCYWYKZSA-N 2 0 348.506 4.005 20 0 EIADRP C[N@@H+]1CCC[C@@H]2C[NH+](CCCc3ccc(C(F)(F)F)cc3)CC[C@H]21 ZINC000675897598 1044545042 /nfs/dbraw/zinc/54/50/42/1044545042.db2.gz HEQAPAHQZUHIOA-SJLPKXTDSA-N 2 0 340.433 4.054 20 0 EIADRP COc1ccc(-c2ccc(C[NH2+][C@@H](C)C3CC[NH+](C)CC3)s2)cc1 ZINC000675926415 1044569942 /nfs/dbraw/zinc/56/99/42/1044569942.db2.gz XBEWMCCKKVICMV-HNNXBMFYSA-N 2 0 344.524 4.244 20 0 EIADRP c1ccc(C[C@H]([NH2+]C[C@@H]2CC[N@@H+](C3CC3)C2)C2CCCCC2)cc1 ZINC000480753803 1044583150 /nfs/dbraw/zinc/58/31/50/1044583150.db2.gz BUMSKTPRWUPYRM-UGKGYDQZSA-N 2 0 326.528 4.252 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3ncccc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168024271 1044605636 /nfs/dbraw/zinc/60/56/36/1044605636.db2.gz CZYMKNIIAFRCFI-ZRAXVTTISA-N 2 0 335.495 4.100 20 0 EIADRP C[C@H](C[NH2+]CC1CC[NH+](Cc2cccs2)CC1)Cc1ccccc1 ZINC000543446447 1044614847 /nfs/dbraw/zinc/61/48/47/1044614847.db2.gz HZCQLSYLHAENSS-SFHVURJKSA-N 2 0 342.552 4.429 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C(C)(C)c2ccncc2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168025308 1044643292 /nfs/dbraw/zinc/64/32/92/1044643292.db2.gz JIOLMFCFSPWVCG-RMFSNUHRSA-N 2 0 337.511 4.348 20 0 EIADRP C[C@@H]1C[C@@H](NCc2noc3ccccc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168025346 1044657381 /nfs/dbraw/zinc/65/73/81/1044657381.db2.gz JQMCEFRNMRYATC-IZZQQSIFSA-N 2 0 349.478 4.359 20 0 EIADRP C[C@H]([NH2+]C1C[C@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1)c1ccc(N)cc1 ZINC001168028532 1044743066 /nfs/dbraw/zinc/74/30/66/1044743066.db2.gz PGIKSLUUXRPRBE-BZSNNMDCSA-N 2 0 337.511 4.361 20 0 EIADRP C[C@@H]1CC(n2c(C[NH3+])cc3ccncc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168030499 1044801076 /nfs/dbraw/zinc/80/10/76/1044801076.db2.gz WHPHSYXZIPBGDK-IAGOWNOFSA-N 2 0 348.494 4.109 20 0 EIADRP Fc1ccc2nc(C[NH2+]CCCCC[NH+]3CCCCC3)sc2c1 ZINC000428877134 1044803900 /nfs/dbraw/zinc/80/39/00/1044803900.db2.gz SIMZMIHCRVMCQB-UHFFFAOYSA-N 2 0 335.492 4.181 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CC2Cc3ccccc3C2)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168033436 1044895288 /nfs/dbraw/zinc/89/52/88/1044895288.db2.gz LPTHDPVZUZIVJU-NHKMSHSESA-N 2 0 348.534 4.433 20 0 EIADRP C[C@@H](c1ccc(C(C)(C)C)cc1)[NH+]1CCC(C[NH+]2CCOCC2)CC1 ZINC000302982106 1044930383 /nfs/dbraw/zinc/93/03/83/1044930383.db2.gz DHGAGTFZHOLJKR-SFHVURJKSA-N 2 0 344.543 4.089 20 0 EIADRP FC1(F)[C@@H](C[NH2+]C2CC[NH+](C3CCCCC3)CC2)[C@@H]1c1ccccc1 ZINC000922773212 1044941566 /nfs/dbraw/zinc/94/15/66/1044941566.db2.gz VDFGWFYSAPGSFE-PMACEKPBSA-N 2 0 348.481 4.422 20 0 EIADRP Fc1cc2c(c(F)c1)CC[C@@H]2[NH2+]Cc1ccc(C[NH+]2CCCC2)cc1 ZINC000154531940 1044946021 /nfs/dbraw/zinc/94/60/21/1044946021.db2.gz HMJUUNNVYHCEFY-NRFANRHFSA-N 2 0 342.433 4.338 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+]Cc2cc(Br)cs2)CC1 ZINC000922848022 1044994631 /nfs/dbraw/zinc/99/46/31/1044994631.db2.gz KCYVSLYBDLOTRR-UHFFFAOYSA-N 2 0 343.334 4.007 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]Cc3ccc(C(C)(C)O)cc3)CC2)C1 ZINC000186605514 1045034137 /nfs/dbraw/zinc/03/41/37/1045034137.db2.gz DJWKGFPYVUETEO-UTKZUKDTSA-N 2 0 344.543 4.047 20 0 EIADRP CC(C)=CCC[C@H](C)[NH2+]C[C@H]1CN(Cc2ccccc2)CCCO1 ZINC000429431041 1045131448 /nfs/dbraw/zinc/13/14/48/1045131448.db2.gz MLPQBICDFGCODU-FPOVZHCZSA-N 2 0 330.516 4.002 20 0 EIADRP O[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]C2CCC3(CCCCC3)CC2)CC1 ZINC000466747148 1045180410 /nfs/dbraw/zinc/18/04/10/1045180410.db2.gz FDMUNLGCCXLHFB-RTWAWAEBSA-N 2 0 348.575 4.237 20 0 EIADRP CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1cccc(Br)c1 ZINC000322630203 1045491559 /nfs/dbraw/zinc/49/15/59/1045491559.db2.gz VIGBPICLMXOAND-HMQMGEFJSA-N 2 0 337.305 4.115 20 0 EIADRP C[NH2+]CC1CC[NH+](Cc2ccc(C(C)C)cc2Br)CC1 ZINC001235679906 1045493504 /nfs/dbraw/zinc/49/35/04/1045493504.db2.gz OLBJBQGMLRKNOH-UHFFFAOYSA-N 2 0 339.321 4.004 20 0 EIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]CCc1cccs1 ZINC000763079954 1045500000 /nfs/dbraw/zinc/50/00/00/1045500000.db2.gz CTXUXOWMXAWYIR-IRXDYDNUSA-N 2 0 328.525 4.037 20 0 EIADRP C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)C(c1ccccc1)c1ccccc1 ZINC000322881304 1045500636 /nfs/dbraw/zinc/50/06/36/1045500636.db2.gz BLOAPIBHLBFSTF-AMZGXZFVSA-N 2 0 334.507 4.422 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(-n2ccnc2)cc1 ZINC000247201882 1045842973 /nfs/dbraw/zinc/84/29/73/1045842973.db2.gz WIKYXDQVCGRQDY-RBUKOAKNSA-N 2 0 340.515 4.035 20 0 EIADRP CC[C@H]1C[C@H]([N@H+]([C@@H]2C[C@H]2c2ccccc2)C2CCC([NH3+])CC2)CCO1 ZINC001170176614 1045913508 /nfs/dbraw/zinc/91/35/08/1045913508.db2.gz AAEJAJVUHWWWJQ-OKDVXBPUSA-N 2 0 342.527 4.072 20 0 EIADRP Cc1[nH]c2ccc(N[C@@H]3C[C@H]4CC[C@@H](C3)[N@H+]4Cc3ccccc3)cc2[nH+]1 ZINC001170330616 1046000947 /nfs/dbraw/zinc/00/09/47/1046000947.db2.gz CUNBLIHBNTWHEN-OWZKRDHZSA-N 2 0 346.478 4.479 20 0 EIADRP CC(C)O[C@H]1C[C@@H]([NH2+]Cc2cccc(C[NH+]3CCCCC3)c2)C1(C)C ZINC001170397922 1046031977 /nfs/dbraw/zinc/03/19/77/1046031977.db2.gz BEJGTFBTXAPIDW-RTWAWAEBSA-N 2 0 344.543 4.354 20 0 EIADRP CCc1noc(C)c1[C@@H](C)[NH2+]Cc1ccccc1C[NH+](CC)CC ZINC000769867658 1046084411 /nfs/dbraw/zinc/08/44/11/1046084411.db2.gz MUVWOVQNQWOTOL-OAHLLOKOSA-N 2 0 329.488 4.238 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@H](CC)c2cccc(Br)c2)CC1 ZINC000037236916 1046090548 /nfs/dbraw/zinc/09/05/48/1046090548.db2.gz AVXFBIUNHPNHIX-QGZVFWFLSA-N 2 0 339.321 4.364 20 0 EIADRP C[C@@H]([NH3+])c1ccc(-c2nc(-c3cccc(C[NH+]4CCCC4)c3)no2)cc1 ZINC000841826269 1046096710 /nfs/dbraw/zinc/09/67/10/1046096710.db2.gz GDYGLCCZGNCKEZ-OAHLLOKOSA-N 2 0 348.450 4.019 20 0 EIADRP C[C@]1(C[NH+]2CCC(c3nc4cc(Cl)ccc4s3)CC2)CC[NH2+]C1 ZINC000262127012 1046178116 /nfs/dbraw/zinc/17/81/16/1046178116.db2.gz XUSQHGUBGMEHFK-SFHVURJKSA-N 2 0 349.931 4.129 20 0 EIADRP CC(C)Oc1ccc(CC[C@@H](C)[NH2+][C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1 ZINC000166227467 1046355183 /nfs/dbraw/zinc/35/51/83/1046355183.db2.gz KMVKARBQAAMMFX-YZGWKJHDSA-N 2 0 330.516 4.011 20 0 EIADRP Fc1cccc2c1SCC[C@@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459398351 1046594575 /nfs/dbraw/zinc/59/45/75/1046594575.db2.gz YSJPJTKEFCUEFX-SFHVURJKSA-N 2 0 343.471 4.016 20 0 EIADRP c1ccc([C@H]2CCCC[C@H]2[NH2+]C2CCN(c3cc[nH+]cc3)CC2)cc1 ZINC000459402295 1046600192 /nfs/dbraw/zinc/60/01/92/1046600192.db2.gz YZENEIHCYXUUOT-FGZHOGPDSA-N 2 0 335.495 4.366 20 0 EIADRP Cn1cncc1CC[NH2+]C1(c2ccc(C(F)(F)F)cc2)CCCC1 ZINC000459403778 1046601599 /nfs/dbraw/zinc/60/15/99/1046601599.db2.gz GSHCUUHCSYXWIL-UHFFFAOYSA-N 2 0 337.389 4.041 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2cc(C)c(Br)s2)C[C@H]1C ZINC000536662002 1046632150 /nfs/dbraw/zinc/63/21/50/1046632150.db2.gz JXYWTJNXUBXDQY-OLZOCXBDSA-N 2 0 345.350 4.124 20 0 EIADRP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459434972 1046646854 /nfs/dbraw/zinc/64/68/54/1046646854.db2.gz VXFDHGLSCOKENP-QVKFZJNVSA-N 2 0 339.458 4.103 20 0 EIADRP C[C@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1c(F)cccc1Cl ZINC000459434933 1046647768 /nfs/dbraw/zinc/64/77/68/1046647768.db2.gz VOBYAXYGIDRIDZ-ZDUSSCGKSA-N 2 0 333.838 4.194 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1ccc(Br)c(F)c1 ZINC000127353187 1046653843 /nfs/dbraw/zinc/65/38/43/1046653843.db2.gz YIBDHWITMXHTLA-ZDUSSCGKSA-N 2 0 345.300 4.188 20 0 EIADRP COc1ccc2ccccc2c1C[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459463072 1046702248 /nfs/dbraw/zinc/70/22/48/1046702248.db2.gz KTOSACBZFIQJDX-UHFFFAOYSA-N 2 0 347.462 4.002 20 0 EIADRP C[C@@H]1C[C@H](NCc2cc(F)ccc2F)CC[N@@H+]1Cc1ccccc1 ZINC000379624356 1046714590 /nfs/dbraw/zinc/71/45/90/1046714590.db2.gz JPDRXTPSILBZSN-DNVCBOLYSA-N 2 0 330.422 4.108 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+][C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000379625287 1046714789 /nfs/dbraw/zinc/71/47/89/1046714789.db2.gz KPWJNFOUVJPFLV-DBXWQHBBSA-N 2 0 340.486 4.399 20 0 EIADRP CCOc1ccc(C[NH2+][C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)cc1 ZINC000379643035 1046736813 /nfs/dbraw/zinc/73/68/13/1046736813.db2.gz ASJQLZYYGUZDMV-RXVVDRJESA-N 2 0 338.495 4.228 20 0 EIADRP C[C@@H]1C[C@H]([NH2+]C[C@H]2CCCCC2(F)F)CC[N@@H+]1Cc1ccccc1 ZINC000379651222 1046742526 /nfs/dbraw/zinc/74/25/26/1046742526.db2.gz UJEQNTIMWVEJHV-BHIYHBOVSA-N 2 0 336.470 4.455 20 0 EIADRP Fc1ccccc1[C@@H]1CC[C@@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)C1 ZINC000459517082 1046743172 /nfs/dbraw/zinc/74/31/72/1046743172.db2.gz RVRKDTXZNQJRIH-SJLPKXTDSA-N 2 0 339.458 4.115 20 0 EIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)c(Cl)c1 ZINC000536827819 1046797842 /nfs/dbraw/zinc/79/78/42/1046797842.db2.gz ROLMGRDBTRYARV-CQSZACIVSA-N 2 0 347.865 4.441 20 0 EIADRP C[C@@H]1C[NH+](CCCC[NH2+]C2CCC(c3ccccc3)CC2)C[C@@H](C)O1 ZINC000536858421 1046827092 /nfs/dbraw/zinc/82/70/92/1046827092.db2.gz PAMQFKQKVYGUHK-RVEPMOMFSA-N 2 0 344.543 4.192 20 0 EIADRP C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1[NH2+]CCc1cccc(F)c1F ZINC000536863774 1046829620 /nfs/dbraw/zinc/82/96/20/1046829620.db2.gz MSKUJLBHWZNHIN-UZLBHIALSA-N 2 0 344.449 4.008 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c[nH+]cn2c1)[C@H](C)c1nc2ccccc2s1 ZINC000459663726 1046847010 /nfs/dbraw/zinc/84/70/10/1046847010.db2.gz YDBJRSGPOONVIF-KBPBESRZSA-N 2 0 336.464 4.226 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H](c2ccccc2OC)C2CCCC2)C1 ZINC000536959189 1046870092 /nfs/dbraw/zinc/87/00/92/1046870092.db2.gz KUXJAFHGOMGCCV-LAUBAEHRSA-N 2 0 330.516 4.248 20 0 EIADRP CO[C@H](c1ccccc1)[C@@H](C)[NH2+]C1CC[NH+](CC2CCCCC2)CC1 ZINC000786820029 1046875398 /nfs/dbraw/zinc/87/53/98/1046875398.db2.gz MEUHQANTAXXMCO-GCJKJVERSA-N 2 0 344.543 4.397 20 0 EIADRP COc1ccc([C@@H]([NH2+]CCCC[N@@H+]2CCCC[C@H]2C)C2CC2)cc1 ZINC000536947128 1046876718 /nfs/dbraw/zinc/87/67/18/1046876718.db2.gz KCKJLLIOMZRTIG-UTKZUKDTSA-N 2 0 330.516 4.391 20 0 EIADRP C[N@@H+]1CCC[C@@H](C[NH2+][C@H](c2cccc(C(F)(F)F)c2)C2CC2)C1 ZINC000536999916 1046890734 /nfs/dbraw/zinc/89/07/34/1046890734.db2.gz FZTJSTWUJDVXQW-GUYCJALGSA-N 2 0 326.406 4.088 20 0 EIADRP C[C@@H]1CCCC[C@@H]1C[NH2+][C@@H]1CC2(CC[NH+](C)CC2)Oc2ccccc21 ZINC000537160733 1046996066 /nfs/dbraw/zinc/99/60/66/1046996066.db2.gz GNFZKWUUZQXYLP-QWFCFKBJSA-N 2 0 342.527 4.391 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)C1 ZINC000497839062 1047116256 /nfs/dbraw/zinc/11/62/56/1047116256.db2.gz FTLPMRFFWXGHGJ-UTKZUKDTSA-N 2 0 330.491 4.472 20 0 EIADRP CC[NH+](CC)CCC[N@@H+]1CCCCC[C@H]1C[C@@H](O)c1cccs1 ZINC000788482684 1047213387 /nfs/dbraw/zinc/21/33/87/1047213387.db2.gz QLFJBWRDWADLMA-ZWKOTPCHSA-N 2 0 338.561 4.148 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H]1CCc2ccc(Cl)nc21 ZINC000788527565 1047228865 /nfs/dbraw/zinc/22/88/65/1047228865.db2.gz NKJQLBFDEFMYLO-SFHVURJKSA-N 2 0 343.902 4.352 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(C[NH+]2CCCCCC2)cc1)c1cc[nH]c(=O)c1 ZINC000788574447 1047235533 /nfs/dbraw/zinc/23/55/33/1047235533.db2.gz UGBKGWBNTAYRIV-QGZVFWFLSA-N 2 0 339.483 4.014 20 0 EIADRP CC[NH+](CC)CCC[NH2+]C1CC(c2ccc(Br)cc2)C1 ZINC000036842394 1047486635 /nfs/dbraw/zinc/48/66/35/1047486635.db2.gz FCTVEIJLOLTBOE-UHFFFAOYSA-N 2 0 339.321 4.017 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]C[C@@H]3CCc4ccccc43)CC2)CC1 ZINC000790051563 1047510135 /nfs/dbraw/zinc/51/01/35/1047510135.db2.gz AQPHMPJSVVUGTN-MWXLCCTBSA-N 2 0 326.528 4.349 20 0 EIADRP COc1cccc(C[N@@H+]2CCC3(C2)CC[NH+]([C@@H]2CC[C@H](C)C2)CC3)c1 ZINC001170136345 1047591163 /nfs/dbraw/zinc/59/11/63/1047591163.db2.gz JUMFUVWXXICUSI-AZUAARDMSA-N 2 0 342.527 4.172 20 0 EIADRP CC(C)(C)c1cnc(C[NH2+]C2CCC([NH+]3CCCCC3)CC2)s1 ZINC000790473670 1047592912 /nfs/dbraw/zinc/59/29/12/1047592912.db2.gz ZKNLKBSAZMRCMS-UHFFFAOYSA-N 2 0 335.561 4.327 20 0 EIADRP C[C@@H]1CCCC[C@@H]1C[NH2+]Cc1ccc(OC2CC[NH+](C)CC2)cc1 ZINC000556404279 1047737047 /nfs/dbraw/zinc/73/70/47/1047737047.db2.gz PALZLCWOESVCNY-IEBWSBKVSA-N 2 0 330.516 4.076 20 0 EIADRP CC(C)Oc1ccc(C[NH2+][C@@H]2CCN(C)[C@@H](c3ccccc3)C2)cc1 ZINC000550606176 1047746347 /nfs/dbraw/zinc/74/63/47/1047746347.db2.gz FNEDSKRBVSTLST-IFMALSPDSA-N 2 0 338.495 4.399 20 0 EIADRP CC(C)Oc1ccc(C[NH2+][C@H]2CCN(C)[C@H](c3ccccc3)C2)cc1 ZINC000550606179 1047747613 /nfs/dbraw/zinc/74/76/13/1047747613.db2.gz FNEDSKRBVSTLST-UNMCSNQZSA-N 2 0 338.495 4.399 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCC1CC[NH+](C[C@@H]2CC2(Cl)Cl)CC1 ZINC000763435103 1047804740 /nfs/dbraw/zinc/80/47/40/1047804740.db2.gz YZZGPKOSEOTUKB-ZBFHGGJFSA-N 2 0 333.347 4.157 20 0 EIADRP C[NH+](C)CC1CCC([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)CC1 ZINC000498782392 1047845939 /nfs/dbraw/zinc/84/59/39/1047845939.db2.gz DESCHULRJRHFLY-LFNLJPBCSA-N 2 0 330.491 4.472 20 0 EIADRP CC[C@H]1C[C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CCO1 ZINC000824427274 1047867193 /nfs/dbraw/zinc/86/71/93/1047867193.db2.gz IBKWJSGEUFDBAW-FAEIBLRNSA-N 2 0 342.527 4.119 20 0 EIADRP CC1(C)[C@@H]2C[C@H]([NH2+]CC3CC[NH+](Cc4ccccc4F)CC3)C[C@@H]21 ZINC001170732307 1047878116 /nfs/dbraw/zinc/87/81/16/1047878116.db2.gz YBQVRSMTBDUVNE-REPLKXPHSA-N 2 0 330.491 4.062 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C[C@@]2(C)CC2(Cl)Cl)CC[N@@H+]1Cc1ccccc1 ZINC000824775051 1047933614 /nfs/dbraw/zinc/93/36/14/1047933614.db2.gz XRDHYLLTENEGDE-HYVNUMGLSA-N 2 0 341.326 4.213 20 0 EIADRP C[NH+](C)[C@H]1CC[C@H]([NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c3C2)CC1 ZINC001171071821 1047982235 /nfs/dbraw/zinc/98/22/35/1047982235.db2.gz GCPPFZDAVBWWOB-BZUAXINKSA-N 2 0 341.326 4.313 20 0 EIADRP Cc1ccc2c(C[NH+]3CCCC[C@@H]3C[C@@H]3CCC[N@H+]3C)c[nH]c2c1 ZINC001136974963 1048007334 /nfs/dbraw/zinc/00/73/34/1048007334.db2.gz UODJLYRFOATTPF-RBUKOAKNSA-N 2 0 325.500 4.315 20 0 EIADRP CCCCC[C@H]([NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2O)CC1)C(C)(C)C ZINC000808706541 1048052063 /nfs/dbraw/zinc/05/20/63/1048052063.db2.gz MNRRSSGCJKQRGO-ZCNNSNEGSA-N 2 0 338.580 4.339 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CC2)[C@@H]2CCc3cc(Cl)ccc3C2)CC1 ZINC001171112197 1048234897 /nfs/dbraw/zinc/23/48/97/1048234897.db2.gz TYGUIMSJPQVZNQ-VAMGGRTRSA-N 2 0 332.919 4.179 20 0 EIADRP Clc1ccc2c(c1)CC[C@@H]([NH2+]CC1CC[NH+](C3CCC3)CC1)C2 ZINC001171113037 1048246473 /nfs/dbraw/zinc/24/64/73/1048246473.db2.gz YUEDCOJVUFFXII-LJQANCHMSA-N 2 0 332.919 4.051 20 0 EIADRP Fc1ccc(CN[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c(F)c1 ZINC000499147322 1048350073 /nfs/dbraw/zinc/35/00/73/1048350073.db2.gz PALLXCNVDKDQCY-OWZKRDHZSA-N 2 0 342.433 4.250 20 0 EIADRP CN(C)c1cccc(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC000499154462 1048362194 /nfs/dbraw/zinc/36/21/94/1048362194.db2.gz UOSYCBJDBFUDCR-UADZTWIMSA-N 2 0 349.522 4.038 20 0 EIADRP c1ccc([C@H]2CC[C@@H]([NH2+]CC3CCN(c4cc[nH+]cc4)CC3)C2)cc1 ZINC000132608617 1048368452 /nfs/dbraw/zinc/36/84/52/1048368452.db2.gz SUHIWPFVIXEILL-LEWJYISDSA-N 2 0 335.495 4.224 20 0 EIADRP C[NH+]1CCC(CC[NH2+][C@@H]2CCc3cc(Cl)c(Cl)cc3C2)CC1 ZINC001171133962 1048413790 /nfs/dbraw/zinc/41/37/90/1048413790.db2.gz RXCIBOKJHXJROD-MRXNPFEDSA-N 2 0 341.326 4.172 20 0 EIADRP CCO[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC001171145792 1048472325 /nfs/dbraw/zinc/47/23/25/1048472325.db2.gz WELPINIZHUUWTE-NHCUHLMSSA-N 2 0 330.516 4.110 20 0 EIADRP CCCC[NH+]1CCC([N@H+](C)Cc2ccc(-n3cccc3)cc2)CC1 ZINC001144250827 1048542914 /nfs/dbraw/zinc/54/29/14/1048542914.db2.gz BADLYJLEIMRORP-UHFFFAOYSA-N 2 0 325.500 4.174 20 0 EIADRP c1cc2cccc(C[NH+]3CC[C@@H]4C[N@@H+](Cc5ccccc5)C[C@H]4C3)c2[nH]1 ZINC001144718327 1048818793 /nfs/dbraw/zinc/81/87/93/1048818793.db2.gz HQZRWDQUAYKAET-IFMALSPDSA-N 2 0 345.490 4.122 20 0 EIADRP Cc1cc(NCc2ccccc2C[NH+]2CCCC2)c2ccccc2[nH+]1 ZINC000649268208 1048998413 /nfs/dbraw/zinc/99/84/13/1048998413.db2.gz BSOZADNTJZRFBS-UHFFFAOYSA-N 2 0 331.463 4.173 20 0 EIADRP c1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3C[C@@]4(CC[NH2+]C4)Oc4ccccc43)C2)cc1 ZINC000817913941 1049058978 /nfs/dbraw/zinc/05/89/78/1049058978.db2.gz TWJKWCBTVKPCLY-MHXAIHSWSA-N 2 0 348.490 4.168 20 0 EIADRP Cc1cc(Cl)cc2c1OCCC[C@@H]2[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000817948410 1049064283 /nfs/dbraw/zinc/06/42/83/1049064283.db2.gz JIMRGFDQSCDWFJ-IBGZPJMESA-N 2 0 344.886 4.153 20 0 EIADRP [NH3+]CCc1ccc(C[NH2+][C@@H]2CCc3cc(Cl)cc(Cl)c32)cc1 ZINC000817948441 1049064569 /nfs/dbraw/zinc/06/45/69/1049064569.db2.gz KBMZMKDZXJMQMA-QGZVFWFLSA-N 2 0 335.278 4.272 20 0 EIADRP Cc1c([C@@H](C)[NH2+]Cc2ccc([C@H](C)[NH3+])cc2)cnn1-c1ccccc1 ZINC000817962513 1049070464 /nfs/dbraw/zinc/07/04/64/1049070464.db2.gz JGSODUYDVFNHTA-JKSUJKDBSA-N 2 0 334.467 4.051 20 0 EIADRP FC(F)Sc1ccc2c(c1)CCC[C@@H]2[NH2+][C@@H]1CC12CC[NH2+]CC2 ZINC000817976647 1049073991 /nfs/dbraw/zinc/07/39/91/1049073991.db2.gz QCXMIIYYSZTLHQ-JKSUJKDBSA-N 2 0 338.467 4.110 20 0 EIADRP COc1ccc([C@@H]([NH2+][C@H](C)CCC[NH3+])c2ccc(Cl)cc2)cc1C ZINC000817977455 1049075884 /nfs/dbraw/zinc/07/58/84/1049075884.db2.gz KOJVJOCRWUKVMA-QRWLVFNGSA-N 2 0 346.902 4.463 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CCC[C@H]2CCC[NH2+]2)ccc1SC(F)F ZINC000817980996 1049077028 /nfs/dbraw/zinc/07/70/28/1049077028.db2.gz OSSRBKKESGROKV-OCCSQVGLSA-N 2 0 344.471 4.193 20 0 EIADRP Cc1nc2ccc(-n3c(CC[NH3+])cc4ccccc43)cc2n1C(C)C ZINC001171304268 1049149751 /nfs/dbraw/zinc/14/97/51/1049149751.db2.gz FTWUOBJDZCRPPU-UHFFFAOYSA-N 2 0 332.451 4.371 20 0 EIADRP CC(C)(C)C[NH+]1CCC([NH2+][C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170911346 1049185111 /nfs/dbraw/zinc/18/51/11/1049185111.db2.gz WGVGCOLQWBCLLK-KRWDZBQOSA-N 2 0 334.935 4.297 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H]2CCc3cc(F)cc(F)c3C2)CC1 ZINC001170669682 1049391151 /nfs/dbraw/zinc/39/11/51/1049391151.db2.gz MHHDJKQCWLNUMR-LXPRWKDFSA-N 2 0 336.470 4.065 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](CCSc2ccc(F)cc2)CC1 ZINC000195667381 1049488287 /nfs/dbraw/zinc/48/82/87/1049488287.db2.gz MBVBDOJUAYCTDZ-UHFFFAOYSA-N 2 0 338.536 4.362 20 0 EIADRP CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2cccc(C[NH+](C)C)c2)C12CCCC2 ZINC000820813118 1049556434 /nfs/dbraw/zinc/55/64/34/1049556434.db2.gz YYIHBXIKJQZKEL-NSISKUIASA-N 2 0 330.516 4.137 20 0 EIADRP C[C@H](C[C@@H](O)c1ccc(F)cc1)[NH2+][C@H](C)c1cccc(C[NH+](C)C)c1 ZINC000820814879 1049558058 /nfs/dbraw/zinc/55/80/58/1049558058.db2.gz NVZYKBIDAKEEHV-WHSLLNHNSA-N 2 0 344.474 4.050 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@H]3CCc4ccccc4OC3)CC2)C1 ZINC000511008212 1049619992 /nfs/dbraw/zinc/61/99/92/1049619992.db2.gz AGORKKOLRAOQTB-JRGCBEDISA-N 2 0 342.527 4.013 20 0 EIADRP CCC(CC)[NH+]1CCC(C[NH2+][C@H]2CCc3c(F)cccc3C2)CC1 ZINC001171411196 1049645275 /nfs/dbraw/zinc/64/52/75/1049645275.db2.gz GMAOXCOKPQYKFM-SFHVURJKSA-N 2 0 332.507 4.173 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](CC2CCCC2)[C@H]2CCc3c(F)cccc3C2)CC1 ZINC001171414182 1049645689 /nfs/dbraw/zinc/64/56/89/1049645689.db2.gz OGBPCZBZGAZSPS-UFYCRDLUSA-N 2 0 344.518 4.445 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c3cccnc23)[C@@H](C)C1 ZINC000245426608 1049719774 /nfs/dbraw/zinc/71/97/74/1049719774.db2.gz LMOVSLVEFVKZSF-KBXCAEBGSA-N 2 0 331.891 4.050 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC2(C1)CC[NH2+]CC2)c1ccc(Br)s1 ZINC001246175150 1049749666 /nfs/dbraw/zinc/74/96/66/1049749666.db2.gz HEEZEHVLTQOUQU-RYUDHWBXSA-N 2 0 343.334 4.084 20 0 EIADRP Cc1cccc2c1CC[C@H]([NH2+]C1CC[NH+](C[C@@H]3CC=CCC3)CC1)C2 ZINC001171563776 1049756423 /nfs/dbraw/zinc/75/64/23/1049756423.db2.gz MJMSILRNFOCPAX-KNQAVFIVSA-N 2 0 338.539 4.263 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CC2(CC3CCC3)CCOCC2)CC1(C)C ZINC001171629683 1049761425 /nfs/dbraw/zinc/76/14/25/1049761425.db2.gz CAOIFBHFSZNRMX-UHFFFAOYSA-N 2 0 336.564 4.214 20 0 EIADRP C[NH+]1C(C)(C)CC([NH2+]CCOc2cccc3ccccc32)CC1(C)C ZINC001171623240 1049768401 /nfs/dbraw/zinc/76/84/01/1049768401.db2.gz PZAVHVVNVHHKBX-UHFFFAOYSA-N 2 0 340.511 4.460 20 0 EIADRP Cc1ccc(CC[C@H](C)N(c2cc[nH+]cc2C)C2CC[NH2+]CC2)cc1 ZINC001171682439 1049776830 /nfs/dbraw/zinc/77/68/30/1049776830.db2.gz VMBRTCVNALCAEK-IBGZPJMESA-N 2 0 337.511 4.278 20 0 EIADRP C[NH+](C)CCC[NH2+]C1CCC(c2ccc(Br)cc2)CC1 ZINC001171644512 1049781381 /nfs/dbraw/zinc/78/13/81/1049781381.db2.gz CHFINLIJNLLZPU-UHFFFAOYSA-N 2 0 339.321 4.017 20 0 EIADRP C[C@H]([NH3+])c1ccc2c(ccn2[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1 ZINC001171726745 1049785338 /nfs/dbraw/zinc/78/53/38/1049785338.db2.gz HYUKEBSYGJXHJT-LLGFUMIMSA-N 2 0 333.479 4.497 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CCOc2ccccc2)CC[N@@H+]1Cc1ccccc1 ZINC001171961610 1049824176 /nfs/dbraw/zinc/82/41/76/1049824176.db2.gz ASPAXBUQGQVMHU-FQEVSTJZSA-N 2 0 338.495 4.098 20 0 EIADRP CC1(C)C[C@@H](n2ccc3cc(C[NH3+])cnc32)CC[N@@H+]1Cc1ccccc1 ZINC001171971362 1049834802 /nfs/dbraw/zinc/83/48/02/1049834802.db2.gz HCLIRKYLQIUHLV-FQEVSTJZSA-N 2 0 348.494 4.111 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1)c1ccc(O)cc1 ZINC001171971539 1049835043 /nfs/dbraw/zinc/83/50/43/1049835043.db2.gz JDRIVNBEWDAMGT-PXNSSMCTSA-N 2 0 338.495 4.486 20 0 EIADRP CC1(C)C[C@H](n2nc(C[NH3+])c3ccccc32)CC[N@@H+]1Cc1ccccc1 ZINC001171973398 1049835655 /nfs/dbraw/zinc/83/56/55/1049835655.db2.gz YMRCMNORKMWCGW-GOSISDBHSA-N 2 0 348.494 4.111 20 0 EIADRP CC1(C)C[C@H](n2c(C[NH3+])cc3ccncc32)CC[N@@H+]1Cc1ccccc1 ZINC001171974577 1049835765 /nfs/dbraw/zinc/83/57/65/1049835765.db2.gz HSSYHOBXOXGMRZ-LJQANCHMSA-N 2 0 348.494 4.111 20 0 EIADRP CC1(C)C[C@H](n2cnc3cccc(C[NH3+])c32)CC[N@@H+]1Cc1ccccc1 ZINC001171973879 1049836253 /nfs/dbraw/zinc/83/62/53/1049836253.db2.gz AEEBRLCQZHCHPF-LJQANCHMSA-N 2 0 348.494 4.111 20 0 EIADRP CC1(C)C[C@@H]([NH+]2CC[C@@]3(C2)CCCCO3)CC[N@@H+]1Cc1ccccc1 ZINC001171981733 1049838826 /nfs/dbraw/zinc/83/88/26/1049838826.db2.gz NGCUDPYJFMHABE-RBBKRZOGSA-N 2 0 342.527 4.075 20 0 EIADRP CC1(C)C[C@H](C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)CCO1 ZINC001171978676 1049839403 /nfs/dbraw/zinc/83/94/03/1049839403.db2.gz IJPMVEBTECYQFG-WOJBJXKFSA-N 2 0 344.543 4.224 20 0 EIADRP CCCN(CCC[NH+](C)C)[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171987395 1049840091 /nfs/dbraw/zinc/84/00/91/1049840091.db2.gz USAPMTIVLRHNHE-OAQYLSRUSA-N 2 0 345.575 4.093 20 0 EIADRP C[NH2+]Cc1cccc(N[C@@H]2CC[N@H+](Cc3ccccc3)C(C)(C)C2)c1 ZINC001171986267 1049840702 /nfs/dbraw/zinc/84/07/02/1049840702.db2.gz GJNIZFLXRAPSQO-OAQYLSRUSA-N 2 0 337.511 4.261 20 0 EIADRP C[N@H+](C1CC[NH+](C2CCCCC2)CC1)[C@H]1CCc2cccc(F)c2C1 ZINC001171014368 1049841589 /nfs/dbraw/zinc/84/15/89/1049841589.db2.gz YYMBIIVXFTWQNB-FQEVSTJZSA-N 2 0 344.518 4.412 20 0 EIADRP CCSCC[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000245737369 1049842082 /nfs/dbraw/zinc/84/20/82/1049842082.db2.gz QZQGFFKAEDZWGR-RSPOEFSDSA-N 2 0 332.557 4.303 20 0 EIADRP [NH3+]CCc1cccc(N[C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)c1 ZINC001172065171 1049850959 /nfs/dbraw/zinc/85/09/59/1049850959.db2.gz IONNYFPKDPKCCU-NUNAXRQHSA-N 2 0 349.522 4.185 20 0 EIADRP CO[C@H]1CC[C@H]([NH2+][C@@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172070026 1049853517 /nfs/dbraw/zinc/85/35/17/1049853517.db2.gz IXJKXAMNDOMHJC-HRMJIJJXSA-N 2 0 342.527 4.119 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@@H]([NH2+]CCCc1cccc(C(F)(F)F)c1)C2 ZINC001172104247 1049856730 /nfs/dbraw/zinc/85/67/30/1049856730.db2.gz BHIRKRBYNMGKED-BCDXTJNWSA-N 2 0 340.433 4.243 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]Cc1ccc(C(F)(F)F)c(Cl)c1)C2 ZINC001172105060 1049857105 /nfs/dbraw/zinc/85/71/05/1049857105.db2.gz FSXNUWOIJKQUEQ-ZSOGYDGISA-N 2 0 346.824 4.464 20 0 EIADRP C[C@@H]([NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)N2C)c1cccc(Br)c1 ZINC001172107399 1049857282 /nfs/dbraw/zinc/85/72/82/1049857282.db2.gz WUCHTIVLEJNIAG-YYQUZTFQSA-N 2 0 337.305 4.115 20 0 EIADRP C[C@@H]1C[C@H](C[C@@H]2CC[C@H]([NH2+][C@@H]3COC(C)(C)C3)[C@H](C)C2)CC[C@@H]1[NH3+] ZINC001172277476 1049870288 /nfs/dbraw/zinc/87/02/88/1049870288.db2.gz IRTPHJZRARPLHH-PHJNVHRLSA-N 2 0 336.564 4.102 20 0 EIADRP COCCC[NH+]1CCC([NH2+][C@H](CC2CCC2)c2ccc(F)cc2)CC1 ZINC001172248843 1049872427 /nfs/dbraw/zinc/87/24/27/1049872427.db2.gz QDIQQMDHZOQXAE-OAQYLSRUSA-N 2 0 348.506 4.148 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]12 ZINC001172319423 1049877191 /nfs/dbraw/zinc/87/71/91/1049877191.db2.gz QUNPRFHXWOVOBT-QHGDMDKLSA-N 2 0 344.543 4.080 20 0 EIADRP C[C@@H]1CC[C@@H]([NH+]2CCC3(CC[N@H+](Cc4ccoc4)C3)CC2)C[C@H]1C ZINC001172379936 1049885995 /nfs/dbraw/zinc/88/59/95/1049885995.db2.gz UJZIVSXLMXZTKI-QWFCFKBJSA-N 2 0 330.516 4.392 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[NH+]1CCC2(CC[N@H+](Cc3ccoc3)C2)CC1 ZINC001172339791 1049889282 /nfs/dbraw/zinc/88/92/82/1049889282.db2.gz QQODUWZMEHHNIH-OALUTQOASA-N 2 0 348.531 4.161 20 0 EIADRP CC[C@H](C)OCC[C@H](C)[NH2+]C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1C ZINC001172353459 1049893203 /nfs/dbraw/zinc/89/32/03/1049893203.db2.gz XAHPKWRBVBHRPK-AQCRLBJHSA-N 2 0 346.559 4.328 20 0 EIADRP COc1ccccc1CN1CCC([NH2+][C@@H]2CC[C@@H](C)[C@@H](C)C2)CC1 ZINC001172359711 1049894966 /nfs/dbraw/zinc/89/49/66/1049894966.db2.gz NHSAEIGPZTWBSO-FUHIMQAGSA-N 2 0 330.516 4.074 20 0 EIADRP CC[C@@H](CC(C)C)[NH+]1CCC2(C[C@H]([N@H+](C)Cc3ccco3)CO2)CC1 ZINC001172402921 1049898803 /nfs/dbraw/zinc/89/88/03/1049898803.db2.gz PSRIQKLDUMVNBS-OALUTQOASA-N 2 0 348.531 4.160 20 0 EIADRP c1ccc(-c2cccc(C[N@@H+]3CC[C@H]4[C@@H](CCC[NH+]4C4CC4)C3)c2)nc1 ZINC000246098467 1049908548 /nfs/dbraw/zinc/90/85/48/1049908548.db2.gz JCHQEAJKRRBCGZ-REWPJTCUSA-N 2 0 347.506 4.197 20 0 EIADRP CC(C)COCC[C@@H](C)[NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172455589 1049915761 /nfs/dbraw/zinc/91/57/61/1049915761.db2.gz UJBSFTWZEPADIM-PSWRPDDJSA-N 2 0 344.543 4.223 20 0 EIADRP Cc1c[nH+]ccc1N([C@@H]1CC[C@@H](c2ccccc2)C1)C1CC[NH2+]CC1 ZINC001172565766 1049936005 /nfs/dbraw/zinc/93/60/05/1049936005.db2.gz MVZZEUKCWGTPRD-TZIWHRDSSA-N 2 0 335.495 4.285 20 0 EIADRP Clc1ccc2c(c1)C[C@H]([NH2+]C1CC[NH+](C[C@H]3CC=CCC3)CC1)C2 ZINC001172716997 1049963694 /nfs/dbraw/zinc/96/36/94/1049963694.db2.gz VAZPHKHLLIUKTF-HRAATJIYSA-N 2 0 344.930 4.218 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1Cc2ccc(Cl)cc2C1 ZINC001172721644 1049964742 /nfs/dbraw/zinc/96/47/42/1049964742.db2.gz IIPPCFCULXSBKH-SLFFLAALSA-N 2 0 332.919 4.146 20 0 EIADRP Cc1nccn1CCCC[N@@H+](Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 ZINC000246381289 1049965401 /nfs/dbraw/zinc/96/54/01/1049965401.db2.gz ZPMBSVJLYIKFJS-DNVCBOLYSA-N 2 0 327.472 4.353 20 0 EIADRP C[NH+]1CCN(c2cccc(C[NH2+]C3CCC4(CCCC4)CC3)c2)CC1 ZINC001172725045 1049967116 /nfs/dbraw/zinc/96/71/16/1049967116.db2.gz MBFLGRYAEWRHKH-UHFFFAOYSA-N 2 0 341.543 4.031 20 0 EIADRP c1ccc(C[NH+]2CCC(C[NH2+]C3CCC4(CCCC4)CC3)CC2)nc1 ZINC001172727916 1049968231 /nfs/dbraw/zinc/96/82/31/1049968231.db2.gz SPIWUPTVQDITJT-UHFFFAOYSA-N 2 0 341.543 4.386 20 0 EIADRP Cc1c[nH+]ccc1N(C1CC[NH2+]CC1)C1CCC2(CCCC2)CC1 ZINC001172730534 1049969239 /nfs/dbraw/zinc/96/92/39/1049969239.db2.gz IOAXNUXKIUOBMX-UHFFFAOYSA-N 2 0 327.516 4.451 20 0 EIADRP Cc1nccn1-c1ccc(C[NH2+][C@@H]2C[C@H](c3ccccc3)C2(C)C)cn1 ZINC000181012213 1049977876 /nfs/dbraw/zinc/97/78/76/1049977876.db2.gz ONYHJGJCUAZPLE-WOJBJXKFSA-N 2 0 346.478 4.248 20 0 EIADRP C[C@H](c1ccc(C[NH+]2CCN(c3cc[nH+]cc3)CC2)cc1)C(F)(F)F ZINC000649351865 1049978844 /nfs/dbraw/zinc/97/88/44/1049978844.db2.gz CQLBININZPHSEK-OAHLLOKOSA-N 2 0 349.400 4.070 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]C[C@H]2CC[N@@H+](C3CC3)C2)c2cccc(Br)c21 ZINC000247003827 1050008851 /nfs/dbraw/zinc/00/88/51/1050008851.db2.gz KVIRHUJTDJHUEY-PBFPGSCMSA-N 2 0 349.316 4.071 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc2c(c1)OCCCO2 ZINC000247007955 1050010294 /nfs/dbraw/zinc/01/02/94/1050010294.db2.gz LBPMRJVUTZSQRU-QZTJIDSGSA-N 2 0 346.515 4.153 20 0 EIADRP CSCCCCC[NH2+][C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]12 ZINC000248575700 1050065666 /nfs/dbraw/zinc/06/56/66/1050065666.db2.gz SZBDANACFHFKGN-VAMGGRTRSA-N 2 0 332.557 4.020 20 0 EIADRP C[C@H](C[NH2+][C@@H]1C[C@H](C)[N@H+](C)C[C@@H]1C)c1ccc(C(F)(F)F)cc1 ZINC000249115240 1050092874 /nfs/dbraw/zinc/09/28/74/1050092874.db2.gz SEHWPXBTUMHCPE-XJIUQZFPSA-N 2 0 328.422 4.127 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000249188533 1050094213 /nfs/dbraw/zinc/09/42/13/1050094213.db2.gz MGBXCGXGFDUUGO-ZJIFWQFVSA-N 2 0 332.454 4.350 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@H](CC)c2cccc(F)c2)[C@H](C)C1 ZINC000249214412 1050095369 /nfs/dbraw/zinc/09/53/69/1050095369.db2.gz ZJIIEAWNBLZGIC-AHRSYUTCSA-N 2 0 336.495 4.003 20 0 EIADRP CCO[C@H]1CCC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCC(C)CC3)cc2)C1 ZINC001177180994 1050164684 /nfs/dbraw/zinc/16/46/84/1050164684.db2.gz SEPCJBOWFMRBKK-YADHBBJMSA-N 2 0 344.543 4.356 20 0 EIADRP CC[C@H]([NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1)c1cccc(Br)c1 ZINC000251335482 1050168842 /nfs/dbraw/zinc/16/88/42/1050168842.db2.gz YTXFOVKGNLZJLO-ULQDDVLXSA-N 2 0 337.305 4.117 20 0 EIADRP CCOc1cccc(F)c1C[NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001177290060 1050178548 /nfs/dbraw/zinc/17/85/48/1050178548.db2.gz LQDNFICWAQTSCP-CALCHBBNSA-N 2 0 336.495 4.072 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](CCCC[NH2+]Cc2cc(F)cc(Cl)c2)C1 ZINC001177289362 1050178652 /nfs/dbraw/zinc/17/86/52/1050178652.db2.gz FEIPOJLDYPWTBL-GJZGRUSLSA-N 2 0 326.887 4.327 20 0 EIADRP CC(C)c1nc(C[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)c2ccccn21 ZINC001177299493 1050179564 /nfs/dbraw/zinc/17/95/64/1050179564.db2.gz SIKJLBATCCSDFS-SFHVURJKSA-N 2 0 342.531 4.202 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1cccc(F)c1OC(F)F ZINC001177299554 1050181079 /nfs/dbraw/zinc/18/10/79/1050181079.db2.gz VJZFILAIVUSLGC-AWEZNQCLSA-N 2 0 344.421 4.171 20 0 EIADRP Cc1ccc2c(c1)C[C@@H]([NH+]1CCCC[C@@H]1C[C@@H]1CCC[N@H+]1C)CC2 ZINC001172843746 1050182768 /nfs/dbraw/zinc/18/27/68/1050182768.db2.gz OKODCFULFVWSGI-BDTNDASRSA-N 2 0 326.528 4.191 20 0 EIADRP C[C@@H](Cc1c(F)cccc1Cl)[NH2+]C1CCC(C[NH+](C)C)CC1 ZINC001172850003 1050188790 /nfs/dbraw/zinc/18/87/90/1050188790.db2.gz RTPIWBWVUCSMMP-NFOMZHRRSA-N 2 0 326.887 4.120 20 0 EIADRP CC(C)[N@H+]([C@H](C)Cc1ccc(F)cc1Cl)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172855882 1050192745 /nfs/dbraw/zinc/19/27/45/1050192745.db2.gz APZXMFPLDSWOSX-KBRIMQKVSA-N 2 0 326.887 4.390 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[N@@H+]1CCCC[C@@H](CCC[NH3+])C1 ZINC001172860342 1050198654 /nfs/dbraw/zinc/19/86/54/1050198654.db2.gz CMWHILMRNJKCCY-GJZGRUSLSA-N 2 0 326.887 4.251 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]CCCC1CC[NH+](C)CC1 ZINC001172860175 1050199104 /nfs/dbraw/zinc/19/91/04/1050199104.db2.gz YHGMKSUBKIVTGF-AWEZNQCLSA-N 2 0 326.887 4.122 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+]C[C@H](C)C[NH+]1CCCCC1 ZINC001177416612 1050210118 /nfs/dbraw/zinc/21/01/18/1050210118.db2.gz UDMOZXQARRXAQD-AWEZNQCLSA-N 2 0 328.422 4.225 20 0 EIADRP Cc1cc(F)c(C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c(F)c1 ZINC001177453530 1050212813 /nfs/dbraw/zinc/21/28/13/1050212813.db2.gz BBWOGRFYFDXJQZ-UHFFFAOYSA-N 2 0 344.449 4.275 20 0 EIADRP Fc1cccc(/C=C/C[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC001177454819 1050212907 /nfs/dbraw/zinc/21/29/07/1050212907.db2.gz ZCFXSQUCPWZLIG-WEVVVXLNSA-N 2 0 338.470 4.341 20 0 EIADRP C[C@@H]([NH2+]Cc1ccnc(OCC[NH+](C)C)c1)c1ccc2ccccc2c1 ZINC000090937249 1050217513 /nfs/dbraw/zinc/21/75/13/1050217513.db2.gz BVFSHYPOJULGCT-QGZVFWFLSA-N 2 0 349.478 4.026 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[N@@H+]1CCC2(C1)CC[NH+](C)CC2 ZINC001172881687 1050222617 /nfs/dbraw/zinc/22/26/17/1050222617.db2.gz KQYIXKUKCVQNQP-OAHLLOKOSA-N 2 0 338.948 4.238 20 0 EIADRP COc1ccc([C@@H]([NH2+]Cc2cccc(C[NH+](C)C)c2)C(C)C)cc1 ZINC000091281216 1050246495 /nfs/dbraw/zinc/24/64/95/1050246495.db2.gz SKAUFPPQXVRZND-NRFANRHFSA-N 2 0 326.484 4.244 20 0 EIADRP C[C@@H](CC[NH+](C)C)[NH2+]C/C=C/c1ccc(OCc2ccccc2)cc1 ZINC001177565847 1050253336 /nfs/dbraw/zinc/25/33/36/1050253336.db2.gz JZMOLFQHOIQYAO-VQFGERMISA-N 2 0 338.495 4.209 20 0 EIADRP CC[C@@H]1C[C@H](C[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)CCO1 ZINC001177743133 1050290986 /nfs/dbraw/zinc/29/09/86/1050290986.db2.gz LRVXUTJKWDYWLV-IFMALSPDSA-N 2 0 344.543 4.213 20 0 EIADRP CC[C@H]1C[C@H](C[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)CCO1 ZINC001177743134 1050291490 /nfs/dbraw/zinc/29/14/90/1050291490.db2.gz LRVXUTJKWDYWLV-IRLDBZIGSA-N 2 0 344.543 4.213 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCc2c(F)cccc2Cl)CC1 ZINC001173105181 1050305728 /nfs/dbraw/zinc/30/57/28/1050305728.db2.gz GSFIFSLTEATOBO-UHFFFAOYSA-N 2 0 326.887 4.264 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CC[C@H](c3ccc(OC)cc3)C2)CC1 ZINC001173113486 1050310308 /nfs/dbraw/zinc/31/03/08/1050310308.db2.gz QNIPKBWUMCEKAE-HDYDNRTBSA-N 2 0 330.516 4.138 20 0 EIADRP CC[NH+](CC)C1CCC([N@H+](C)Cc2cccc3cccnc32)CC1 ZINC001173114430 1050310717 /nfs/dbraw/zinc/31/07/17/1050310717.db2.gz JQIGWZZBMFBJTL-UHFFFAOYSA-N 2 0 325.500 4.320 20 0 EIADRP CC[NH+](CC)C1CCC([N@H+](Cc2ccccc2)C2CCOCC2)CC1 ZINC001173114345 1050311135 /nfs/dbraw/zinc/31/11/35/1050311135.db2.gz HPLDQAOTVJIBDP-UHFFFAOYSA-N 2 0 344.543 4.321 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@@H]2Cc2ccc(F)cc2)CC1 ZINC001173117469 1050315798 /nfs/dbraw/zinc/31/57/98/1050315798.db2.gz MVJVJSOQYJVSGR-XVAXZDLZSA-N 2 0 332.507 4.486 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]C1CCC(Oc2ccccc2)CC1 ZINC001173196711 1050340420 /nfs/dbraw/zinc/34/04/20/1050340420.db2.gz UNMNOHUBBBARKU-LWEYNCJUSA-N 2 0 332.532 4.477 20 0 EIADRP CC(C)[N@@H+]1CC[C@H]([NH2+]C2CCC(Oc3ccccc3)CC2)[C@@H](C)C1 ZINC001173202545 1050345400 /nfs/dbraw/zinc/34/54/00/1050345400.db2.gz UJNSJROBNXYYKF-CZOVOBHWSA-N 2 0 330.516 4.085 20 0 EIADRP CCCC[C@H](CC(C)C)[NH2+]CC1(O)CC[NH+](Cc2ccccc2)CC1 ZINC001173252541 1050375679 /nfs/dbraw/zinc/37/56/79/1050375679.db2.gz JMUIUKIDIUSPLH-OAQYLSRUSA-N 2 0 346.559 4.208 20 0 EIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2cccc(F)c2F)C[N@@H+]1Cc1ccccc1 ZINC001178208287 1050403807 /nfs/dbraw/zinc/40/38/07/1050403807.db2.gz KYQLEIDDVKHLAH-FUHWJXTLSA-N 2 0 344.449 4.355 20 0 EIADRP C[C@@H]1C[C@@H](CC[NH2+]Cc2ccc(F)cc2F)C[N@@H+]1Cc1ccccc1 ZINC001178207952 1050404240 /nfs/dbraw/zinc/40/42/40/1050404240.db2.gz JKLCUJDGELSWEZ-SJLPKXTDSA-N 2 0 344.449 4.355 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+]C[C@@H]3CCOc4ccccc43)CC2)CC1 ZINC001178280884 1050426193 /nfs/dbraw/zinc/42/61/93/1050426193.db2.gz YDFXUNLSDXCTPB-HDYDNRTBSA-N 2 0 342.527 4.185 20 0 EIADRP C1CCC2(CC1)CCC[C@@H]([NH2+][C@H]1CC[C@H]([NH+]3CCOCC3)CC1)C2 ZINC001173342830 1050432103 /nfs/dbraw/zinc/43/21/03/1050432103.db2.gz FLQQQUXVDDLVKU-VAMGGRTRSA-N 2 0 334.548 4.113 20 0 EIADRP COC(=O)CCCC[C@H](C)[N@H+](C1CCCCC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001173445649 1050462700 /nfs/dbraw/zinc/46/27/00/1050462700.db2.gz NPEUVRBXFQXUSA-LNLFQRSKSA-N 2 0 338.536 4.013 20 0 EIADRP CCOC(=O)C[C@H]1CC[C@H]([NH2+]CCCCCCCCCCC[NH3+])C1 ZINC001173654088 1050535448 /nfs/dbraw/zinc/53/54/48/1050535448.db2.gz RLVMMZGPRJMAIA-OALUTQOASA-N 2 0 340.552 4.168 20 0 EIADRP Cc1cc(C[N@@H+]2CC[C@@H]([NH3+])[C@H](F)CC2)ccc1Oc1ccccc1 ZINC001206209691 1050535498 /nfs/dbraw/zinc/53/54/98/1050535498.db2.gz IBHJEAWSWLQLRE-RTBURBONSA-N 2 0 328.431 4.049 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1C(=O)NCCC[PH+](C(C)(C)C)C(C)(C)C ZINC001178701278 1050535734 /nfs/dbraw/zinc/53/57/34/1050535734.db2.gz HOZCDCFYTDHOSK-OAHLLOKOSA-N 2 0 328.481 4.056 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)[C@H]1CCC[C@@H](C)C1 ZINC001178962038 1050598547 /nfs/dbraw/zinc/59/85/47/1050598547.db2.gz ATJNVBXWFARBJJ-DYXWJJEUSA-N 2 0 344.543 4.466 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc3nc(Cl)ccc3s2)C[C@H]1C ZINC001204236524 1050615897 /nfs/dbraw/zinc/61/58/97/1050615897.db2.gz HVJZJFPMJRXJAF-OLZOCXBDSA-N 2 0 337.920 4.254 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+](C)C)cc1)c1ccc(Cl)s1 ZINC000069673996 1050761809 /nfs/dbraw/zinc/76/18/09/1050761809.db2.gz WIIPKMYWHYLOLI-CYBMUJFWSA-N 2 0 338.904 4.193 20 0 EIADRP c1ccc(C[NH+]2CCC[C@@H]3C[N@H+](CC4CCSCC4)CC[C@H]32)cc1 ZINC001179918360 1050833866 /nfs/dbraw/zinc/83/38/66/1050833866.db2.gz BOCCNQXXYRCCIC-NHCUHLMSSA-N 2 0 344.568 4.116 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccc(F)cc2C(F)(F)F)CC1 ZINC001180051269 1050867084 /nfs/dbraw/zinc/86/70/84/1050867084.db2.gz FLCJCOCRCABYFV-UHFFFAOYSA-N 2 0 346.412 4.398 20 0 EIADRP COCC[N@H+](C)CCCC1CC[NH+](C[C@@H](C)c2ccc(C)cc2)CC1 ZINC001180077804 1050877807 /nfs/dbraw/zinc/87/78/07/1050877807.db2.gz VMKWEUXEBNCHNP-HXUWFJFHSA-N 2 0 346.559 4.169 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](C[C@H]2CCc3ccccc3C2)CC1 ZINC001180125401 1050892457 /nfs/dbraw/zinc/89/24/57/1050892457.db2.gz YEACTWANRZFUPT-FQEVSTJZSA-N 2 0 328.544 4.235 20 0 EIADRP C[C@H](CC1CCC1)[NH2+][C@@H]1CCC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]21 ZINC001180302566 1050945204 /nfs/dbraw/zinc/94/52/04/1050945204.db2.gz ZLYNMXDPUBINFN-HLRQEUIKSA-N 2 0 326.528 4.455 20 0 EIADRP C[NH+](C)C[C@H]1CC[N@H+](Cc2ccc(-c3ccc(Cl)cc3)cc2)C1 ZINC001180793783 1051076851 /nfs/dbraw/zinc/07/68/51/1051076851.db2.gz LSICUFGLZVUXTF-QGZVFWFLSA-N 2 0 328.887 4.391 20 0 EIADRP COc1ccc(SCC[NH2+][C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC001180795287 1051079483 /nfs/dbraw/zinc/07/94/83/1051079483.db2.gz UOTZOKJBQUHDPF-DLBZAZTESA-N 2 0 348.556 4.030 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2cncc(C)c2)ccc1OC ZINC000183402595 1051108031 /nfs/dbraw/zinc/10/80/31/1051108031.db2.gz TWWMWBDEOACFKO-KRWDZBQOSA-N 2 0 341.499 4.091 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CCc2cccs2)ccc1OC ZINC000775362122 1051128261 /nfs/dbraw/zinc/12/82/61/1051128261.db2.gz FMCOVMPTNBNZIA-MRXNPFEDSA-N 2 0 346.540 4.492 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]Cc2ccc(C)nc2)ccc1OC ZINC000775377071 1051157000 /nfs/dbraw/zinc/15/70/00/1051157000.db2.gz FZKKQEUTFMSUCI-KRWDZBQOSA-N 2 0 341.499 4.091 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H]2CCCc3cc(SC(F)F)ccc32)CC1 ZINC000775384789 1051176399 /nfs/dbraw/zinc/17/63/99/1051176399.db2.gz GNSPHZHVYGXWMQ-QGZVFWFLSA-N 2 0 340.483 4.310 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]CCC(F)(F)F)cc1C[NH+]1CCCCC1 ZINC000775397729 1051215833 /nfs/dbraw/zinc/21/58/33/1051215833.db2.gz VQMQRPXPEBHITQ-CQSZACIVSA-N 2 0 344.421 4.284 20 0 EIADRP CN(CCC[NH+]1CCC(Cc2ccccc2)CC1)CCC(F)(F)F ZINC001190690616 1051258115 /nfs/dbraw/zinc/25/81/15/1051258115.db2.gz HDXQZSZHZISKSP-UHFFFAOYSA-N 2 0 342.449 4.215 20 0 EIADRP C([C@@H]1CCCC12CCOCC2)[N@@H+]1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC001190827426 1051285324 /nfs/dbraw/zinc/28/53/24/1051285324.db2.gz PJTAUJRJEHNSQW-RTWAWAEBSA-N 2 0 348.575 4.171 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2sc(-c3ccccc3F)nc2C)C1 ZINC000163230731 1051292169 /nfs/dbraw/zinc/29/21/69/1051292169.db2.gz CWXYCSHDNGMBCU-ZFWWWQNUSA-N 2 0 347.503 4.250 20 0 EIADRP C([C@H]1CC[N@@H+](C[C@@H]2CCC3(CCCCCC3)O2)C1)[NH+]1CCCCC1 ZINC001191069966 1051339807 /nfs/dbraw/zinc/33/98/07/1051339807.db2.gz JDXLWRBGTDZLKN-UXHICEINSA-N 2 0 334.548 4.066 20 0 EIADRP COc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000154856433 1051344962 /nfs/dbraw/zinc/34/49/62/1051344962.db2.gz DEXWLNLGMTVGHE-QGZVFWFLSA-N 2 0 326.484 4.386 20 0 EIADRP CCO[C@H]1C[C@H]([N@H+](C)Cc2ccc(C[NH+]3CCCCC3)cc2)C1(C)C ZINC001191164595 1051371528 /nfs/dbraw/zinc/37/15/28/1051371528.db2.gz GXDZCEVPIBNRIG-SFTDATJTSA-N 2 0 344.543 4.308 20 0 EIADRP COc1cc([C@@H](C)[NH2+]C[C@H]2CCC[N@@H+](C(C)C)C2)ccc1SC ZINC000268843482 1051396318 /nfs/dbraw/zinc/39/63/18/1051396318.db2.gz DHNDXJXUWVLVFG-HZPDHXFCSA-N 2 0 336.545 4.188 20 0 EIADRP FC1(F)CCC([NH2+]CCC2CC[NH+](Cc3ccccc3)CC2)CC1 ZINC001203289652 1051520028 /nfs/dbraw/zinc/52/00/28/1051520028.db2.gz RWBHPIZSLXDLLB-UHFFFAOYSA-N 2 0 336.470 4.456 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@@H]2CCc3[nH]c4ccc(Cl)cc4c3C2)CC1 ZINC001182555816 1051629193 /nfs/dbraw/zinc/62/91/93/1051629193.db2.gz RYUSPXTULILRGR-MRXNPFEDSA-N 2 0 345.918 4.000 20 0 EIADRP C[C@@H]1[C@@H](c2ccccc2)c2ccccc2CC[N@@H+]1CCCn1ccnc1 ZINC001192334257 1051691117 /nfs/dbraw/zinc/69/11/17/1051691117.db2.gz GKCQQYDYDSECCJ-XXBNENTESA-N 2 0 345.490 4.352 20 0 EIADRP C[C@H]1c2ccccc2C[C@H]1[NH2+]C1CC[NH+]([C@H]2CCCC[C@H]2C)CC1 ZINC001182805611 1051702477 /nfs/dbraw/zinc/70/24/77/1051702477.db2.gz FGOPHISSJHJAOS-XQTRSNPVSA-N 2 0 326.528 4.348 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(C)c(F)c2)CC1)CC1CC1 ZINC001192501664 1051748303 /nfs/dbraw/zinc/74/83/03/1051748303.db2.gz PKBOKCGBHVYXGX-UHFFFAOYSA-N 2 0 332.507 4.468 20 0 EIADRP CC(C)c1cccc(C[NH+]2CCC(CCC[NH+]3CCOCC3)CC2)c1 ZINC001192482305 1051753807 /nfs/dbraw/zinc/75/38/07/1051753807.db2.gz WRQCXKNOQAVHEV-UHFFFAOYSA-N 2 0 344.543 4.134 20 0 EIADRP Cc1cc([C@H]([NH2+]Cc2ccc(C[NH+](C)C)cc2)C2CC2)ccc1F ZINC000158702490 1051777676 /nfs/dbraw/zinc/77/76/76/1051777676.db2.gz ILPUERVRJZGDTC-OAQYLSRUSA-N 2 0 326.459 4.437 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+][C@@H]3CCO[C@H]3c3ccccc3)CC2)C1 ZINC001183312250 1051825156 /nfs/dbraw/zinc/82/51/56/1051825156.db2.gz HDCXIZBFLRTFFU-CIQXWFTPSA-N 2 0 342.527 4.149 20 0 EIADRP Cc1nc(-c2ccccc2)oc1C[N@@H+](C)Cc1ccc(C[NH+](C)C)cc1 ZINC001192918349 1051831618 /nfs/dbraw/zinc/83/16/18/1051831618.db2.gz LWASVZXTSZJYJR-UHFFFAOYSA-N 2 0 349.478 4.344 20 0 EIADRP C[C@H]1CC[N@H+](Cc2ccc(SC(F)(F)F)cc2)CC[C@H]1C[NH3+] ZINC001205618043 1051843257 /nfs/dbraw/zinc/84/32/57/1051843257.db2.gz QWIXBGCGQDSBAQ-JSGCOSHPSA-N 2 0 332.435 4.105 20 0 EIADRP C[C@H]1CCC[C@@H]([NH+]2CCC([NH2+]CC(C)(C)C3CCOCC3)CC2)C1 ZINC001184046471 1051945280 /nfs/dbraw/zinc/94/52/80/1051945280.db2.gz VVWBLVSLFKLBMU-FXAWDEMLSA-N 2 0 336.564 4.072 20 0 EIADRP C[C@@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CC[C@@H]2CCC(F)(F)C2)CC1 ZINC001184238701 1051976887 /nfs/dbraw/zinc/97/68/87/1051976887.db2.gz FANRHIHDPDPSER-SOLBZPMBSA-N 2 0 328.491 4.445 20 0 EIADRP CC(C)C[C@@H](C)C[C@@H](C)[NH2+]CCc1ccc(N2CC[NH+](C)CC2)cc1 ZINC001184417527 1052010229 /nfs/dbraw/zinc/01/02/29/1052010229.db2.gz FJAXIIRAMSJWNT-WOJBJXKFSA-N 2 0 345.575 4.031 20 0 EIADRP CC(C)[C@@H](C[NH2+]C1CC[NH+](C2CCCCC2)CC1)c1cccnc1 ZINC000164121454 1052018039 /nfs/dbraw/zinc/01/80/39/1052018039.db2.gz NQBUZTMWVUAEOX-OAQYLSRUSA-N 2 0 329.532 4.208 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000339066071 1052551903 /nfs/dbraw/zinc/55/19/03/1052551903.db2.gz FCEQNTHQKQVAJG-KCZVDYSFSA-N 2 0 344.543 4.399 20 0 EIADRP C[C@H](CCc1ccco1)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000379903741 1052565116 /nfs/dbraw/zinc/56/51/16/1052565116.db2.gz IIFFGIZEADSVOW-WSTZPKSXSA-N 2 0 326.484 4.101 20 0 EIADRP CCOc1ccc([C@H](C)N[C@@H]2CC[N@H+](C)C(C)(C)C2)cc1OCC ZINC000623339359 1052627060 /nfs/dbraw/zinc/62/70/60/1052627060.db2.gz WNGHTURHUOWGAX-DOTOQJQBSA-N 2 0 334.504 4.007 20 0 EIADRP C[C@@H]1CCC[N@H+](Cc2ccc(C[NH2+]Cc3cccc4n[nH]cc43)cc2)C1 ZINC000623357429 1052631990 /nfs/dbraw/zinc/63/19/90/1052631990.db2.gz OKRDFVYEOVMQGM-QGZVFWFLSA-N 2 0 348.494 4.085 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1)c1ccc(Oc2cccnc2)cc1 ZINC000623526034 1052672350 /nfs/dbraw/zinc/67/23/50/1052672350.db2.gz HTSDRMDCLTWKJB-SJLPKXTDSA-N 2 0 339.483 4.397 20 0 EIADRP C[C@@H]([NH2+]Cc1cccc(C[NH+](C)C)c1)c1ccc(Br)cc1 ZINC000177199419 1052674970 /nfs/dbraw/zinc/67/49/70/1052674970.db2.gz STLHGYRENOKRCV-CQSZACIVSA-N 2 0 347.300 4.362 20 0 EIADRP C[C@H]([NH2+][C@H]1CCCc2ccccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000178094113 1052699678 /nfs/dbraw/zinc/69/96/78/1052699678.db2.gz NWFGJEJPICMCCM-JTSKRJEESA-N 2 0 338.495 4.355 20 0 EIADRP C[C@H]1C[C@@H](NC(c2ccc(F)cc2)c2ccc(F)cc2)CC[N@@H+]1C ZINC000178606567 1052710065 /nfs/dbraw/zinc/71/00/65/1052710065.db2.gz BVCFPAQWUIFOCA-LIRRHRJNSA-N 2 0 330.422 4.127 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cc(-c3ccccc3)n[nH]2)c1 ZINC000178619395 1052710435 /nfs/dbraw/zinc/71/04/35/1052710435.db2.gz HINAUQBELOTSIG-UHFFFAOYSA-N 2 0 348.494 4.207 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1cc(-c2ccccc2)n(C)n1 ZINC000623849094 1052822253 /nfs/dbraw/zinc/82/22/53/1052822253.db2.gz VTTBUGXPEKVLRC-ROUUACIJSA-N 2 0 342.531 4.248 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H]2CCCc3c4cc(Cl)ccc4[nH]c32)CC1 ZINC000623927977 1052837096 /nfs/dbraw/zinc/83/70/96/1052837096.db2.gz AGABNKNWSRUFHS-SFHVURJKSA-N 2 0 329.875 4.050 20 0 EIADRP c1ccc(C[C@@H]2CCC[C@@H]2[NH2+]C2CC[NH+](C3CCCCC3)CC2)nc1 ZINC000850387295 1053158110 /nfs/dbraw/zinc/15/81/10/1053158110.db2.gz QQGGLMOQBNZEKR-AVRDEDQJSA-N 2 0 341.543 4.180 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH+]2CCCCC2)CC1)c1ccc(C(F)F)nc1 ZINC000850438646 1053208823 /nfs/dbraw/zinc/20/88/23/1053208823.db2.gz BYIKHYHAYWNLFS-OOHWJJMZSA-N 2 0 337.458 4.467 20 0 EIADRP c1ccc(CC2CC[NH+](CCCC[NH2+]C3CCSCC3)CC2)cc1 ZINC000109350699 1053231141 /nfs/dbraw/zinc/23/11/41/1053231141.db2.gz SJGGYIHZIMCBAW-UHFFFAOYSA-N 2 0 346.584 4.207 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc2c(c1)CCCO2 ZINC000850457048 1053234932 /nfs/dbraw/zinc/23/49/32/1053234932.db2.gz FPPOJNVWOYMCJC-ZWOKBUDYSA-N 2 0 342.527 4.315 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CC2SCCS2)CC1 ZINC000850561280 1053317218 /nfs/dbraw/zinc/31/72/18/1053317218.db2.gz MZAOSKGLLOWQHH-UHFFFAOYSA-N 2 0 330.607 4.061 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]CCC2SCCS2)CC1 ZINC000850568963 1053321732 /nfs/dbraw/zinc/32/17/32/1053321732.db2.gz OMMVESGRSODMLN-UHFFFAOYSA-N 2 0 344.634 4.451 20 0 EIADRP COc1ccc(CC[C@H](C)[NH2+]CCCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000764963358 1053398684 /nfs/dbraw/zinc/39/86/84/1053398684.db2.gz NRHJYGAQVXGWIT-OALUTQOASA-N 2 0 332.532 4.261 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@@H]1C)c1cnn(-c2ccccc2)c1 ZINC000764965137 1053403235 /nfs/dbraw/zinc/40/32/35/1053403235.db2.gz URPKBSGTXBHZTN-OALUTQOASA-N 2 0 340.515 4.178 20 0 EIADRP CCCCOCC[NH+]1CCC2(CC1)CC[NH+](Cc1ccccc1)CC2 ZINC001195649619 1053453671 /nfs/dbraw/zinc/45/36/71/1053453671.db2.gz KLHBAHUIVATXGH-UHFFFAOYSA-N 2 0 344.543 4.181 20 0 EIADRP CC[NH+](CC)Cc1ccc(C[NH2+]Cc2cnc(Cl)c(F)c2)cc1 ZINC000865405577 1053492340 /nfs/dbraw/zinc/49/23/40/1053492340.db2.gz MPOWSTPFIIRSET-UHFFFAOYSA-N 2 0 335.854 4.006 20 0 EIADRP C[C@H](C[NH2+][C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1C)c1cccc(F)c1 ZINC000765361055 1053516258 /nfs/dbraw/zinc/51/62/58/1053516258.db2.gz VDLWRZFSXBFLNH-HMFYCAOWSA-N 2 0 340.486 4.429 20 0 EIADRP Cc1ccc2c(c1)CC[C@H]2[NH2+]C1CCN(c2ccc(N(C)C)cc2)CC1 ZINC000765429523 1053547667 /nfs/dbraw/zinc/54/76/67/1053547667.db2.gz WGUPWLBIYYYQRG-HSZRJFAPSA-N 2 0 349.522 4.307 20 0 EIADRP CCOc1cccc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000385805308 1053551043 /nfs/dbraw/zinc/55/10/43/1053551043.db2.gz NHLNJVUOKPDENL-RXVVDRJESA-N 2 0 338.495 4.086 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)CC1 ZINC000865717329 1053578675 /nfs/dbraw/zinc/57/86/75/1053578675.db2.gz WSVITYJDLIFLTJ-TZIWHRDSSA-N 2 0 329.532 4.208 20 0 EIADRP Clc1nc2ccccc2cc1C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000852754086 1053610769 /nfs/dbraw/zinc/61/07/69/1053610769.db2.gz ONSJDEYCIBUDEF-QGZVFWFLSA-N 2 0 343.902 4.100 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc2c(c1)CCO2 ZINC000120876467 1053632028 /nfs/dbraw/zinc/63/20/28/1053632028.db2.gz JPHNSLDWAFWLTC-HXUWFJFHSA-N 2 0 342.458 4.063 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@H](c1ccccn1)C(C)C ZINC000866218886 1053654443 /nfs/dbraw/zinc/65/44/43/1053654443.db2.gz AQSPITXNTSIETD-NRFANRHFSA-N 2 0 325.500 4.410 20 0 EIADRP CC(C)[N@@H+](C)Cc1cccc(C[NH2+][C@@H](C)CCc2cccnc2)c1 ZINC000866245830 1053662949 /nfs/dbraw/zinc/66/29/49/1053662949.db2.gz BZVOZIGAEMGIFF-SFHVURJKSA-N 2 0 325.500 4.033 20 0 EIADRP CC(C)[C@H]([NH2+]CC1CC[NH+](Cc2cccs2)CC1)c1ccccn1 ZINC000866251423 1053665699 /nfs/dbraw/zinc/66/56/99/1053665699.db2.gz SASRFNQJNRROFC-FQEVSTJZSA-N 2 0 343.540 4.342 20 0 EIADRP CC[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(OC)cc1 ZINC000386441156 1053728868 /nfs/dbraw/zinc/72/88/68/1053728868.db2.gz PULPQTXNCZANRX-DENIHFKCSA-N 2 0 338.495 4.258 20 0 EIADRP C[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1cccc(OC(F)F)c1 ZINC000866517121 1053763595 /nfs/dbraw/zinc/76/35/95/1053763595.db2.gz XBQABZQXRZGKSO-MJJDPTRDSA-N 2 0 326.431 4.202 20 0 EIADRP C[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ccc(OC(F)F)cc1 ZINC000866515245 1053764460 /nfs/dbraw/zinc/76/44/60/1053764460.db2.gz DWQNWKDBIDQWNY-MJJDPTRDSA-N 2 0 326.431 4.202 20 0 EIADRP C[C@H](CCc1cncc2ccccc21)[NH2+]C1CCC(C)([NH+](C)C)CC1 ZINC000866518045 1053765147 /nfs/dbraw/zinc/76/51/47/1053765147.db2.gz RQKCGSHJBSNHGX-FEPNQTLGSA-N 2 0 339.527 4.408 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@H]2CCOC(C)(C)C2)ccc1OC ZINC000121109840 1053768160 /nfs/dbraw/zinc/76/81/60/1053768160.db2.gz HHLRBCFUCMNSMK-APWZRJJASA-N 2 0 348.531 4.145 20 0 EIADRP COC1(CC[NH+]2CCC(c3ccccc3)([NH+]3CCCC3)CC2)CCC1 ZINC001198202199 1054093723 /nfs/dbraw/zinc/09/37/23/1054093723.db2.gz LLJOFQZTKRILJE-UHFFFAOYSA-N 2 0 342.527 4.033 20 0 EIADRP FC(F)(F)Cc1ccccc1C[NH2+]C1CC[NH+](C2CCCC2)CC1 ZINC000624307204 1054145194 /nfs/dbraw/zinc/14/51/94/1054145194.db2.gz CNKULGXRNOPYSY-UHFFFAOYSA-N 2 0 340.433 4.288 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+]CC[C@H]2CC2(F)F)ccc1OC ZINC000857082522 1054175572 /nfs/dbraw/zinc/17/55/72/1054175572.db2.gz WUHINHLAGAPSJR-YOEHRIQHSA-N 2 0 340.458 4.233 20 0 EIADRP CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)CCO1 ZINC001199275047 1054371725 /nfs/dbraw/zinc/37/17/25/1054371725.db2.gz CGUXRPGAJZDKRD-COPCDDAFSA-N 2 0 344.543 4.354 20 0 EIADRP CC1([NH+]2CCCC2)CC[NH+](Cn2ccc(=S)c3ccccc32)CC1 ZINC000872645017 1054457517 /nfs/dbraw/zinc/45/75/17/1054457517.db2.gz NFEHDLMZNNMZCB-UHFFFAOYSA-N 2 0 341.524 4.279 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(-n2ccnc2C)nc1)c1cc(C)ccc1C ZINC000858353471 1054471103 /nfs/dbraw/zinc/47/11/03/1054471103.db2.gz HZVYDEYRZXOEHO-HXUWFJFHSA-N 2 0 334.467 4.433 20 0 EIADRP CCOc1ccc(CNCc2cccc(C[NH+]3CCCCCC3)c2)o1 ZINC001199897126 1054483947 /nfs/dbraw/zinc/48/39/47/1054483947.db2.gz TUHGJGBJWLTCLW-UHFFFAOYSA-N 2 0 342.483 4.344 20 0 EIADRP CCC[C@@H](C)CCC[C@H](C)[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000858430854 1054489575 /nfs/dbraw/zinc/48/95/75/1054489575.db2.gz IDZQOQKGRFSYCS-MOPGFXCFSA-N 2 0 338.580 4.462 20 0 EIADRP [NH3+][C@@H](C[C@H]1CCC[N@H+](Cc2cnc(C3CC3)s2)C1)C1CCCC1 ZINC000873232527 1054509102 /nfs/dbraw/zinc/50/91/02/1054509102.db2.gz SDZZWXWQRPDLKB-KDOFPFPSSA-N 2 0 333.545 4.140 20 0 EIADRP c1cc(-c2nc(C[NH2+][C@H]3CCCCC34CC[NH2+]CC4)cs2)cs1 ZINC000873232596 1054509695 /nfs/dbraw/zinc/50/96/95/1054509695.db2.gz IEKUEMJXAACJLL-INIZCTEOSA-N 2 0 347.553 4.274 20 0 EIADRP FC(F)(F)[C@@H]1CC=CC[C@H]1C[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000873250236 1054514852 /nfs/dbraw/zinc/51/48/52/1054514852.db2.gz FIAPMMLKTBVFGY-FIDHJVLJSA-N 2 0 330.438 4.032 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccns2)ccc1OC ZINC000858577435 1054525263 /nfs/dbraw/zinc/52/52/63/1054525263.db2.gz PWPNVXZKHVHODR-CABCVRRESA-N 2 0 347.528 4.405 20 0 EIADRP COc1cccc2c(C[NH2+]CCC[NH+](C(C)C)C(C)C)cccc12 ZINC001200923588 1054577530 /nfs/dbraw/zinc/57/75/30/1054577530.db2.gz TYQTYMSGTVXMMF-UHFFFAOYSA-N 2 0 328.500 4.447 20 0 EIADRP C[C@H]1C[C@@H](CC[NH2+]Cc2cc(F)ccc2F)C[N@@H+]1Cc1ccccc1 ZINC001201492024 1054818378 /nfs/dbraw/zinc/81/83/78/1054818378.db2.gz PANQHTNAIMUPLH-FUHWJXTLSA-N 2 0 344.449 4.355 20 0 EIADRP CCCCOc1ccc(C[N@H+](C)CC2CC[NH+](C(C)C)CC2)cc1 ZINC001203970266 1054838141 /nfs/dbraw/zinc/83/81/41/1054838141.db2.gz KNTBMNOUCVUUEB-UHFFFAOYSA-N 2 0 332.532 4.418 20 0 EIADRP c1csc(C[N@H+]2CCC3(C2)CC[NH+](CCc2ccccc2)CC3)c1 ZINC001201596320 1054847146 /nfs/dbraw/zinc/84/71/46/1054847146.db2.gz DPLYJZUGOLDTQM-UHFFFAOYSA-N 2 0 340.536 4.279 20 0 EIADRP CCCC[C@H](CC)C[NH+]1CCC2(CCCN2Cc2ccn(C)n2)CC1 ZINC001201566412 1054850098 /nfs/dbraw/zinc/85/00/98/1054850098.db2.gz TWHVXGFFACADJS-IBGZPJMESA-N 2 0 346.563 4.067 20 0 EIADRP CSCCC[N@@H+]1C[C@@H]2CCC[C@H]([NH+](C)Cc3cccs3)[C@@H]2C1 ZINC001201680822 1054874250 /nfs/dbraw/zinc/87/42/50/1054874250.db2.gz ODLXIDZCYDFOOY-JQHSSLGASA-N 2 0 338.586 4.034 20 0 EIADRP CSCCC[NH+]1CCC2(CC1)CC[NH+](Cc1ccc(C)cc1)CC2 ZINC001201681567 1054874734 /nfs/dbraw/zinc/87/47/34/1054874734.db2.gz ZMFNJLCRMSVLTJ-UHFFFAOYSA-N 2 0 346.584 4.426 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](C[C@@H]2CCOC2)CC1)c1ccc(C(C)(C)C)cc1 ZINC000173427948 1054944695 /nfs/dbraw/zinc/94/46/95/1054944695.db2.gz UNILHGHLMYOJJQ-ROUUACIJSA-N 2 0 344.543 4.136 20 0 EIADRP Cc1c(C[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)ccnc1F ZINC000862278724 1055045197 /nfs/dbraw/zinc/04/51/97/1055045197.db2.gz JRYDAHCCLFIXNK-UHFFFAOYSA-N 2 0 341.474 4.195 20 0 EIADRP C[C@@H]([NH2+]CC1(c2ccccc2)CC[NH+](C)CC1)c1cc2cnccc2o1 ZINC000877718580 1055111167 /nfs/dbraw/zinc/11/11/67/1055111167.db2.gz NATLYMPONMPCQI-QGZVFWFLSA-N 2 0 349.478 4.142 20 0 EIADRP CNc1ccccc1C[NH2+]Cc1ccccc1C[NH+]1CCC(C)CC1 ZINC001202289443 1055126762 /nfs/dbraw/zinc/12/67/62/1055126762.db2.gz RZQLZEZFXQJHAT-UHFFFAOYSA-N 2 0 337.511 4.250 20 0 EIADRP C[NH+]1CCC(Oc2ccc(C[NH2+]CC3CCCCCC3)cc2)CC1 ZINC001202367333 1055154147 /nfs/dbraw/zinc/15/41/47/1055154147.db2.gz ZUXODWUPGHXPEN-UHFFFAOYSA-N 2 0 330.516 4.220 20 0 EIADRP C[N@H+](Cc1ccco1)[C@H]1CCC12CC[NH+](CCCC(F)(F)F)CC2 ZINC001202395586 1055170335 /nfs/dbraw/zinc/17/03/35/1055170335.db2.gz NQIVOYYEHSQCMP-INIZCTEOSA-N 2 0 344.421 4.299 20 0 EIADRP C[N@H+](Cc1ccccc1)CC(C)(C)C[NH2+]CC(C)(C)c1ccccn1 ZINC001202465686 1055181655 /nfs/dbraw/zinc/18/16/55/1055181655.db2.gz GSUOEUDQCWXBGA-UHFFFAOYSA-N 2 0 339.527 4.107 20 0 EIADRP FC(F)n1cc(C[NH2+][C@@H]2CCC[C@@H]2[C@H]2CCC[NH2+]2)c2ccccc21 ZINC000863548079 1055225901 /nfs/dbraw/zinc/22/59/01/1055225901.db2.gz USDQNPYWSMIJRP-BRWVUGGUSA-N 2 0 333.426 4.047 20 0 EIADRP C[C@H](NCc1cc(C(F)(F)F)co1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000878411521 1055295319 /nfs/dbraw/zinc/29/53/19/1055295319.db2.gz LHUJNKKRVBAIKM-QWHCGFSZSA-N 2 0 330.394 4.041 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CC[C@@H](c2ccccc2)O1)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000878412322 1055300279 /nfs/dbraw/zinc/30/02/79/1055300279.db2.gz VTUBIBLKFRGRRY-UDDWMFPDSA-N 2 0 342.527 4.149 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)C2CCC(C(F)(F)F)CC2)C1 ZINC000474710955 1055997632 /nfs/dbraw/zinc/99/76/32/1055997632.db2.gz JZUPHWQZICZLLK-JUVOFCAFSA-N 2 0 334.470 4.454 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)C1CCC(C(F)(F)F)CC1 ZINC000475197068 1056238426 /nfs/dbraw/zinc/23/84/26/1056238426.db2.gz XARTYZPWWOZGJO-JEYLPNPQSA-N 2 0 332.454 4.208 20 0 EIADRP c1cc2cc(C[NH2+]CCCCCCC[NH+]3CCCC3)ccc2cn1 ZINC000785454847 1056597728 /nfs/dbraw/zinc/59/77/28/1056597728.db2.gz DJDYHPRPFOQPCU-UHFFFAOYSA-N 2 0 325.500 4.371 20 0 EIADRP Cc1n[nH]cc1[C@H](C)[NH2+]Cc1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1 ZINC000180137965 1058369274 /nfs/dbraw/zinc/36/92/74/1058369274.db2.gz LZOGSTFYARKRAZ-ULQDDVLXSA-N 2 0 340.515 4.047 20 0 EIADRP c1cc2cnccc2c(C[N@H+]2CCC[C@H](C[NH+]3CCCCCC3)C2)c1 ZINC000183252237 1059962095 /nfs/dbraw/zinc/96/20/95/1059962095.db2.gz ZFRZTBFKYPXKPJ-LJQANCHMSA-N 2 0 337.511 4.323 20 0 EIADRP CCC[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1cccnc1 ZINC000185137262 1060094187 /nfs/dbraw/zinc/09/41/87/1060094187.db2.gz RTRHERQTXSSRJB-JOCHJYFZSA-N 2 0 337.511 4.425 20 0 EIADRP Cc1nc(C)c([C@H](C)[NH2+]C[C@]2(C)CC[N@H+](Cc3ccccc3)C2)s1 ZINC000379737957 1060257687 /nfs/dbraw/zinc/25/76/87/1060257687.db2.gz CRMVDNLARQSITM-YWZLYKJASA-N 2 0 343.540 4.323 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2cnccc2c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000388982823 1060281761 /nfs/dbraw/zinc/28/17/61/1060281761.db2.gz RCJPPVGROIXVEJ-FDDCHVKYSA-N 2 0 345.490 4.235 20 0 EIADRP CC[NH+]1CCN(c2ccc(F)cc2[C@@H](C)[NH2+]C[C@H](C)CC(C)C)CC1 ZINC001168813920 1060419306 /nfs/dbraw/zinc/41/93/06/1060419306.db2.gz UEBDFBMEYNUMEX-QZTJIDSGSA-N 2 0 349.538 4.300 20 0 EIADRP c1ccc2c(c1)OCCC[C@H]2[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000766512764 1060488380 /nfs/dbraw/zinc/48/83/80/1060488380.db2.gz MNGLFQPIVBMKNQ-AFMYVXGZSA-N 2 0 328.500 4.287 20 0 EIADRP CC(C)C[C@H](Cc1ccccc1)[NH2+]CC1CC[NH+](C2CCC2)CC1 ZINC001169068855 1060626875 /nfs/dbraw/zinc/62/68/75/1060626875.db2.gz XHSATDYRUVHUAV-OAQYLSRUSA-N 2 0 328.544 4.498 20 0 EIADRP CC(C)C[C@@H](Cc1ccccc1)[NH+]1CC2(C1)CC[N@H+](CC1CC1)C2 ZINC001169071044 1060628753 /nfs/dbraw/zinc/62/87/53/1060628753.db2.gz UCQVXYPOOQFBRT-NRFANRHFSA-N 2 0 326.528 4.062 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C(C)(C)c1cccc(C(F)(F)F)c1)C2 ZINC001169101582 1060635321 /nfs/dbraw/zinc/63/53/21/1060635321.db2.gz UJPMLCZMELOBPD-MUJYYYPQSA-N 2 0 326.406 4.155 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H]1CCCc3ccc(Br)cc31)C2 ZINC001169082344 1060641780 /nfs/dbraw/zinc/64/17/80/1060641780.db2.gz YRWLNMBMBHGLDI-DFGXFYAUSA-N 2 0 349.316 4.041 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C(C)(C)Cc1cccc(C(F)(F)F)c1)C2 ZINC001169117087 1060647663 /nfs/dbraw/zinc/64/76/63/1060647663.db2.gz VQNPHJXISQCSPG-OSYLJGHBSA-N 2 0 340.433 4.241 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]CC1c3ccccc3CCc3ccccc31)C2 ZINC001169108366 1060658393 /nfs/dbraw/zinc/65/83/93/1060658393.db2.gz SABCGTXHFLBFIK-WKCHPHFGSA-N 2 0 346.518 4.132 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CC[C@@H](c3ccc(OC(C)(C)C)cc3)C1)C2 ZINC001169160428 1060673434 /nfs/dbraw/zinc/67/34/34/1060673434.db2.gz FBUZOQODHKRDRY-YSTOQKLRSA-N 2 0 342.527 4.278 20 0 EIADRP C[C@H]1C[N@H+](Cc2sccc2Oc2ccccc2)CCC[C@H]1C[NH3+] ZINC001206003735 1060686829 /nfs/dbraw/zinc/68/68/29/1060686829.db2.gz LYSYUHUFUGITRA-HOTGVXAUSA-N 2 0 330.497 4.347 20 0 EIADRP CCOCCC[N@@H+]1CC[C@@H]([NH2+]Cc2cccc(C(C)(C)C)c2)[C@H](C)C1 ZINC001169555162 1060856259 /nfs/dbraw/zinc/85/62/59/1060856259.db2.gz NQRBEKGDIJDOAC-WIYYLYMNSA-N 2 0 346.559 4.211 20 0 EIADRP c1ccc([C@H]2OCC[C@@H]2C[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1 ZINC000328619945 258036017 /nfs/dbraw/zinc/03/60/17/258036017.db2.gz GNASTVXSULYUEZ-DENIHFKCSA-N 2 0 342.527 4.151 20 0 EIADRP C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1[NH2+]CCc1c[nH]c2ccccc12 ZINC000532188301 1032077374 /nfs/dbraw/zinc/07/73/74/1032077374.db2.gz CTDPQNUXXFUXKW-GCJKJVERSA-N 2 0 347.506 4.211 20 0 EIADRP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1ccc(C[NH+](C)C)cc1 ZINC000532200566 1032086263 /nfs/dbraw/zinc/08/62/63/1032086263.db2.gz WJXSAWZZSQXBMM-QVKFZJNVSA-N 2 0 326.459 4.301 20 0 EIADRP CC[C@@H]([NH2+][C@H](C)C1CC[NH+](C)CC1)c1ccccc1OC(F)F ZINC000151935563 1032136498 /nfs/dbraw/zinc/13/64/98/1032136498.db2.gz LJDYYPQBPBGPPQ-CZUORRHYSA-N 2 0 326.431 4.059 20 0 EIADRP CSC1(C[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCC1 ZINC000193800320 1032181685 /nfs/dbraw/zinc/18/16/85/1032181685.db2.gz KGPNXZIBTZZEPT-YQQQUEKLSA-N 2 0 330.541 4.057 20 0 EIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]Cc1cccc2cc[nH]c21 ZINC000532374318 1032213270 /nfs/dbraw/zinc/21/32/70/1032213270.db2.gz FPAPDCFIMMKZTG-ROUUACIJSA-N 2 0 347.506 4.414 20 0 EIADRP CSC1(C[N@H+](C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)CCC1 ZINC000514697401 1032410592 /nfs/dbraw/zinc/41/05/92/1032410592.db2.gz OOOXJCLXFBHTAQ-IEBWSBKVSA-N 2 0 332.557 4.257 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)cc1 ZINC000120743301 1032413030 /nfs/dbraw/zinc/41/30/30/1032413030.db2.gz NETRYIDIIARNPJ-IRLDBZIGSA-N 2 0 338.495 4.006 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1)C1CC(F)(F)C1 ZINC000529543741 1032434239 /nfs/dbraw/zinc/43/42/39/1032434239.db2.gz NDWNDUSWBSNAGA-SOLBZPMBSA-N 2 0 336.470 4.311 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1cccc(OC)c1 ZINC000120852373 1032449445 /nfs/dbraw/zinc/44/94/45/1032449445.db2.gz BGHVTDYMLFGGQQ-FQEVSTJZSA-N 2 0 330.447 4.137 20 0 EIADRP CC[N@H+](C)C[C@H]1CCN(Cc2ccc([C@H](C)C(F)(F)F)cc2)C1 ZINC000450475823 1032520490 /nfs/dbraw/zinc/52/04/90/1032520490.db2.gz ZYOYMCQNFCPKTR-GOEBONIOSA-N 2 0 328.422 4.126 20 0 EIADRP CC(C)C1CCC([NH+]2CCN(C[C@@H]3CCCC[N@@H+]3C(C)C)CC2)CC1 ZINC000450485703 1032527920 /nfs/dbraw/zinc/52/79/20/1032527920.db2.gz KAPCNXWYAVYFAG-HRTMPFAESA-N 2 0 349.607 4.082 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1ccccc1F ZINC000180330757 1032606796 /nfs/dbraw/zinc/60/67/96/1032606796.db2.gz BTTHGCSMTREDEB-LJQANCHMSA-N 2 0 330.447 4.007 20 0 EIADRP C[C@H]1CCN(Cc2ccc(C(F)(F)F)s2)C[C@H]1n1ccnc1 ZINC000432732335 1032620201 /nfs/dbraw/zinc/62/02/01/1032620201.db2.gz ULUNTBFRAKJAHD-WCQYABFASA-N 2 0 329.391 4.047 20 0 EIADRP CCCC[C@H](CC)CC[NH+]1CCN(C2CC[NH+](C(C)C)CC2)CC1 ZINC000438090636 1032728684 /nfs/dbraw/zinc/72/86/84/1032728684.db2.gz BIMATIBVBGFPBU-FQEVSTJZSA-N 2 0 337.596 4.083 20 0 EIADRP C[NH+](C)CC1CCC([NH2+]Cc2ccc(-c3ccc(F)cc3)o2)CC1 ZINC000533392322 1032729109 /nfs/dbraw/zinc/72/91/09/1032729109.db2.gz PSKICSQOQMQBDV-UHFFFAOYSA-N 2 0 330.447 4.296 20 0 EIADRP CCCC[C@@H](CC)CC[NH+]1CCN(C2CC[NH+](C(C)C)CC2)CC1 ZINC000438090637 1032729720 /nfs/dbraw/zinc/72/97/20/1032729720.db2.gz BIMATIBVBGFPBU-HXUWFJFHSA-N 2 0 337.596 4.083 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccc(SCC(F)(F)F)cc1 ZINC000925875236 1032794478 /nfs/dbraw/zinc/79/44/78/1032794478.db2.gz DDSAWTBCXUMOGA-BZPMIXESSA-N 2 0 332.435 4.119 20 0 EIADRP Cc1ccc(-c2ncc(C[NH2+]CCCCC[NH+]3CCCC3)s2)o1 ZINC000339501666 1019003408 /nfs/dbraw/zinc/00/34/08/1019003408.db2.gz YHQAPSLOJQCRRZ-UHFFFAOYSA-N 2 0 333.501 4.067 20 0 EIADRP CC[N@@H+]1CCC[C@H](C[NH2+][C@H](C)c2cc(C)c(Br)s2)C1 ZINC001345412317 1019782851 /nfs/dbraw/zinc/78/28/51/1019782851.db2.gz QBHJNYXOAXMQRZ-CHWSQXEVSA-N 2 0 345.350 4.202 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1ccc(CSC(F)F)o1 ZINC000120620218 1019897956 /nfs/dbraw/zinc/89/79/56/1019897956.db2.gz CGAZTZKONSVHGM-AWEZNQCLSA-N 2 0 346.487 4.480 20 0 EIADRP Cc1nc2c(s1)[C@@H]([NH2+]Cc1ccccc1C[N@@H+](C)C(C)C)CCC2 ZINC000154869919 1020078735 /nfs/dbraw/zinc/07/87/35/1020078735.db2.gz DYPQZCLJUYDUAH-SFHVURJKSA-N 2 0 343.540 4.459 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2Cl)CC1)c1cncs1 ZINC000155212649 1020356158 /nfs/dbraw/zinc/35/61/58/1020356158.db2.gz DYFRUYSJXFXXQE-CQSZACIVSA-N 2 0 349.931 4.359 20 0 EIADRP CCC[NH+]1CCC([N@H+](C)Cc2ccc(Cl)c3cccnc23)CC1 ZINC000109788200 1020415807 /nfs/dbraw/zinc/41/58/07/1020415807.db2.gz MIVGXUUIVQFIAN-UHFFFAOYSA-N 2 0 331.891 4.194 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H](COC)c2cccc(Cl)c2)c1 ZINC000579891510 1020490201 /nfs/dbraw/zinc/49/02/01/1020490201.db2.gz VGLVKKGHXZRKOS-FQEVSTJZSA-N 2 0 346.902 4.269 20 0 EIADRP C[C@@H]([NH2+]C1CCN(c2cc[nH+]cc2)CC1)c1ccc2c(c1)CCCC2 ZINC000326779907 1020664192 /nfs/dbraw/zinc/66/41/92/1020664192.db2.gz OLZNFDAWVPXIGD-QGZVFWFLSA-N 2 0 335.495 4.280 20 0 EIADRP CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000547831562 1020779219 /nfs/dbraw/zinc/77/92/19/1020779219.db2.gz ACPRCCVYUZNZTO-QESAQDPVSA-N 2 0 344.543 4.080 20 0 EIADRP CC(C)(C)C[C@@H]([NH2+]C1CCN([C@@H]2CCOC2)CC1)c1ccc(F)cc1 ZINC000655693914 1020900355 /nfs/dbraw/zinc/90/03/55/1020900355.db2.gz ARCIPTCGQCHSPN-WOJBJXKFSA-N 2 0 348.506 4.146 20 0 EIADRP CC(C)[C@H]1CC[C@H]1[NH2+]CCCOC1CC[NH+](Cc2ccccc2)CC1 ZINC000579939187 1020906006 /nfs/dbraw/zinc/90/60/06/1020906006.db2.gz ORECVWPARJEOEJ-FGZHOGPDSA-N 2 0 344.543 4.082 20 0 EIADRP Cc1nn(-c2ccccc2Cl)cc1C[NH2+]C(C)(C)CCC[NH+](C)C ZINC000655778442 1020953137 /nfs/dbraw/zinc/95/31/37/1020953137.db2.gz LMQXWGMUENIGBJ-UHFFFAOYSA-N 2 0 348.922 4.044 20 0 EIADRP Cc1ccsc1[C@H](Cc1ccccc1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1 ZINC000655804895 1020972189 /nfs/dbraw/zinc/97/21/89/1020972189.db2.gz FIMKTEUHPVYZJL-OTWHNJEPSA-N 2 0 328.525 4.270 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc(SCC(F)(F)F)cc1 ZINC000655806563 1020975364 /nfs/dbraw/zinc/97/53/64/1020975364.db2.gz YNQXPHSQEBWJOT-NFAWXSAZSA-N 2 0 346.462 4.332 20 0 EIADRP COCCCC1(C[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)CCC1 ZINC001204496334 1020977174 /nfs/dbraw/zinc/97/71/74/1020977174.db2.gz FWDKMAUAYGNQNF-HXUWFJFHSA-N 2 0 336.564 4.027 20 0 EIADRP C[NH+](C)[C@H]1C[C@@H](C[NH2+]Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000655824936 1020992926 /nfs/dbraw/zinc/99/29/26/1020992926.db2.gz RBNBQGSCUNNDHO-MAEOIBBWSA-N 2 0 328.431 4.048 20 0 EIADRP CC[C@H]([NH2+][C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)[C@H]1CCCCO1 ZINC000655850675 1021015909 /nfs/dbraw/zinc/01/59/09/1021015909.db2.gz YJJVKOVFKAMJNS-LILSUDLASA-N 2 0 342.527 4.119 20 0 EIADRP CC(C)[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccc2[nH]c(=O)oc2c1 ZINC000340475138 1021096882 /nfs/dbraw/zinc/09/68/82/1021096882.db2.gz KMSFHBHSKUPHCC-IBGZPJMESA-N 2 0 345.487 4.086 20 0 EIADRP c1ccc2c(c1)OC1(CCC1)C[C@@H]2[NH2+]CCCCC[NH+]1CCCC1 ZINC000340480144 1021103219 /nfs/dbraw/zinc/10/32/19/1021103219.db2.gz OQCVZKIABWUNHX-IBGZPJMESA-N 2 0 328.500 4.289 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ccc3cnccc3c2)C1 ZINC000683765175 1021377457 /nfs/dbraw/zinc/37/74/57/1021377457.db2.gz FOPYSRJGTKNCJB-QZTJIDSGSA-N 2 0 325.500 4.083 20 0 EIADRP Cc1nc(C)c([C@H](C)[NH2+]C[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)s1 ZINC000376165586 1021639149 /nfs/dbraw/zinc/63/91/49/1021639149.db2.gz ZQUICPWTRUDVGG-DOPJRALCSA-N 2 0 329.513 4.104 20 0 EIADRP c1ccc([C@@H]2CC[C@H](C[NH2+]C3CC[NH+](C4CCCCC4)CC3)O2)cc1 ZINC000580132810 1021701303 /nfs/dbraw/zinc/70/13/03/1021701303.db2.gz FBDDKFXUTHDFGX-YADHBBJMSA-N 2 0 342.527 4.293 20 0 EIADRP C[C@@H]1CCC[N@H+](CCCC[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)C1 ZINC000580225599 1021778777 /nfs/dbraw/zinc/77/87/77/1021778777.db2.gz UTMDEGDQYQEHMI-MJGOQNOKSA-N 2 0 332.536 4.133 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2ccc(-c3ncco3)cc2F)CC1 ZINC000580286717 1021821587 /nfs/dbraw/zinc/82/15/87/1021821587.db2.gz PLJCRELBVRSAPU-UHFFFAOYSA-N 2 0 345.462 4.033 20 0 EIADRP C[C@H](CSC(C)(C)C)[NH2+]C1CCN(CCc2ccccc2)CC1 ZINC000177969287 1021834943 /nfs/dbraw/zinc/83/49/43/1021834943.db2.gz NHZSCGVEQDWZIR-QGZVFWFLSA-N 2 0 334.573 4.203 20 0 EIADRP C[C@@H]([NH2+]CCC1CC[NH+](C)CC1)c1csc(-c2ccccc2)n1 ZINC000414127754 1021894595 /nfs/dbraw/zinc/89/45/95/1021894595.db2.gz SOWDUZGBMRLIIU-OAHLLOKOSA-N 2 0 329.513 4.193 20 0 EIADRP [NH3+][C@H]1C[C@@H](NC2(c3cccc(OC(F)(F)F)c3)CC2)c2ccccc21 ZINC000656201288 1021932420 /nfs/dbraw/zinc/93/24/20/1021932420.db2.gz ODMXMFSNMUFERF-DLBZAZTESA-N 2 0 348.368 4.309 20 0 EIADRP C[C@H](N[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)c1cncc(F)c1 ZINC000414148612 1021976556 /nfs/dbraw/zinc/97/65/56/1021976556.db2.gz RYMPYPDTYWCBKA-KQLYMOGASA-N 2 0 339.458 4.067 20 0 EIADRP C[C@H](c1ccccc1)[NH+]1CCC([NH2+]Cc2cc3ccccc3[nH]2)CC1 ZINC000683929463 1021996934 /nfs/dbraw/zinc/99/69/34/1021996934.db2.gz LRYUMBZXYBLXQA-QGZVFWFLSA-N 2 0 333.479 4.483 20 0 EIADRP Cc1ccc(OC(F)F)c([C@H](C)[NH2+]Cc2ccc3c[nH+]cn3c2)c1 ZINC000414162737 1022001710 /nfs/dbraw/zinc/00/17/10/1022001710.db2.gz FAGXZVFHWDYKNJ-ZDUSSCGKSA-N 2 0 331.366 4.095 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc2c[nH+]cn2c1)c1ccccc1OC(F)F ZINC000414181315 1022049134 /nfs/dbraw/zinc/04/91/34/1022049134.db2.gz LYQCXZLBBQTMFJ-INIZCTEOSA-N 2 0 331.366 4.177 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H](NCc2noc4ccccc24)C3)cc1 ZINC000580465626 1022054880 /nfs/dbraw/zinc/05/48/80/1022054880.db2.gz PUBDOXUXIGWSPG-LDLYASANSA-N 2 0 347.462 4.113 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](NCc2noc4ccccc24)C3)cc1 ZINC000580465627 1022055807 /nfs/dbraw/zinc/05/58/07/1022055807.db2.gz PUBDOXUXIGWSPG-REPLKXPHSA-N 2 0 347.462 4.113 20 0 EIADRP Cc1cc([C@H](C)[NH2+]CC[C@H]2CCC[N@H+](C)C2)sc1Br ZINC000414193285 1022085610 /nfs/dbraw/zinc/08/56/10/1022085610.db2.gz SYLISOSGWOFARE-QWHCGFSZSA-N 2 0 345.350 4.202 20 0 EIADRP C[C@@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1csc(-c2ccccc2F)n1 ZINC000414193956 1022089319 /nfs/dbraw/zinc/08/93/19/1022089319.db2.gz UCIIGDPNIDCMKY-CABCVRRESA-N 2 0 347.503 4.332 20 0 EIADRP CC(C)c1cccc2c1OCCC[C@@H]2[NH2+]Cc1ccc2c[nH+]cn2c1 ZINC000414197231 1022097599 /nfs/dbraw/zinc/09/75/99/1022097599.db2.gz XUVZLBLXYRBADR-FQEVSTJZSA-N 2 0 335.451 4.461 20 0 EIADRP Cc1cc(C[NH2+]Cc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)cnc1F ZINC000892572154 1022236359 /nfs/dbraw/zinc/23/63/59/1022236359.db2.gz UKLKAIVBOOMIFV-KRWDZBQOSA-N 2 0 341.474 4.193 20 0 EIADRP CC1CC[NH+](CCCC[NH2+][C@H](c2ccccc2)C2CCOCC2)CC1 ZINC000782757330 1022353939 /nfs/dbraw/zinc/35/39/39/1022353939.db2.gz OFJZFFBYJBMNOV-JOCHJYFZSA-N 2 0 344.543 4.256 20 0 EIADRP Cc1cccc([C@H](C)[NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC000581034495 1022807657 /nfs/dbraw/zinc/80/76/57/1022807657.db2.gz YSKGFGLKQDZHBE-IBGZPJMESA-N 2 0 338.495 4.320 20 0 EIADRP Cc1cc([C@H](C)[NH2+][C@@H]2CC[N@@H+]3CCC[C@H]3C2)ccc1Br ZINC000378489594 1022843427 /nfs/dbraw/zinc/84/34/27/1022843427.db2.gz CTXBTYNBLSYSPU-IMJJTQAJSA-N 2 0 337.305 4.035 20 0 EIADRP COc1c(C)cc(C[NH2+]Cc2cccc(C[N@H+](C)C(C)C)c2)cc1C ZINC000065976464 1022873258 /nfs/dbraw/zinc/87/32/58/1022873258.db2.gz ADGPRMZCJZHVLQ-UHFFFAOYSA-N 2 0 340.511 4.442 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+]C[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000311193167 1022876392 /nfs/dbraw/zinc/87/63/92/1022876392.db2.gz GPZLAMUKBSTGMA-UYAOXDASSA-N 2 0 340.486 4.259 20 0 EIADRP Cc1cn2c(n1)[C@H](C[NH2+]Cc1ccc(Oc3ccccc3)o1)CCC2 ZINC000378603757 1022888077 /nfs/dbraw/zinc/88/80/77/1022888077.db2.gz AEHVUIXCVLZRAG-INIZCTEOSA-N 2 0 337.423 4.244 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+]C/C=C/c2ccccc2OC)c1 ZINC000588177808 1023012308 /nfs/dbraw/zinc/01/23/08/1023012308.db2.gz KLLWDBZWDUYXTA-UKTHLTGXSA-N 2 0 338.495 4.340 20 0 EIADRP Cn1ccnc1C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1ccccc1 ZINC000656503613 1023074638 /nfs/dbraw/zinc/07/46/38/1023074638.db2.gz QMERIHDIAKUKIA-ACRUOGEOSA-N 2 0 331.463 4.097 20 0 EIADRP Cc1ccccc1SC[C@H](C)C[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1 ZINC001167457587 1023100090 /nfs/dbraw/zinc/10/00/90/1023100090.db2.gz FXWIEXUNKHSYHR-IEBWSBKVSA-N 2 0 332.557 4.141 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1)c1cncs1 ZINC000156186667 1023116833 /nfs/dbraw/zinc/11/68/33/1023116833.db2.gz SFOQRWXVGBYLHK-HOTGVXAUSA-N 2 0 329.513 4.368 20 0 EIADRP CC[C@H](CC(F)F)C[N@H+](C)CCC1CCN(c2cc[nH+]cc2)CC1 ZINC000660167147 1023191407 /nfs/dbraw/zinc/19/14/07/1023191407.db2.gz ZMKBGHLEUACPRT-MRXNPFEDSA-N 2 0 339.474 4.301 20 0 EIADRP C/C(=C\c1ccccc1)C[N@@H+](C)C[C@@H]1CCN(C)[C@H]1c1cccnc1 ZINC000376682547 1023254441 /nfs/dbraw/zinc/25/44/41/1023254441.db2.gz UWUJGYWZQDHCMX-UMKIKXNYSA-N 2 0 335.495 4.110 20 0 EIADRP Cc1cc(C[NH2+][C@@H](CCC[NH3+])c2ccccc2)ccc1Br ZINC000415045427 1023409527 /nfs/dbraw/zinc/40/95/27/1023409527.db2.gz BRBKCBKHHAUXCU-SFHVURJKSA-N 2 0 347.300 4.327 20 0 EIADRP CCOCc1ccccc1C[NH2+][C@@H](C)c1ccc(-n2ccnc2)cc1 ZINC000119553532 1023410798 /nfs/dbraw/zinc/41/07/98/1023410798.db2.gz PVXJFELXKLIIBS-KRWDZBQOSA-N 2 0 335.451 4.260 20 0 EIADRP Cc1nc2ccc(C[NH2+][C@@H](CCC[NH3+])c3ccccc3)cc2s1 ZINC000415054454 1023411014 /nfs/dbraw/zinc/41/10/14/1023411014.db2.gz NMJNZLOHXWESGJ-KRWDZBQOSA-N 2 0 325.481 4.175 20 0 EIADRP Cc1cc(Br)ccc1C[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000415059018 1023411063 /nfs/dbraw/zinc/41/10/63/1023411063.db2.gz UJYXPASUSJUVJO-SFHVURJKSA-N 2 0 347.300 4.327 20 0 EIADRP [NH3+]CCC[C@@H]([NH2+]Cc1cnc(-c2cccs2)s1)c1ccccc1 ZINC000415061130 1023414137 /nfs/dbraw/zinc/41/41/37/1023414137.db2.gz XZJUCAJXDAEWPR-MRXNPFEDSA-N 2 0 343.521 4.441 20 0 EIADRP C[C@@H](C[C@@H]1CCC[NH2+]1)[NH2+]Cc1ccccc1COCc1ccccc1 ZINC000415076802 1023422584 /nfs/dbraw/zinc/42/25/84/1023422584.db2.gz GQXOJWLFUVRHGI-AVRDEDQJSA-N 2 0 338.495 4.024 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)[NH2+]C[C@@H]1CCC[NH2+]C1 ZINC000415073213 1023425148 /nfs/dbraw/zinc/42/51/48/1023425148.db2.gz ARHFEDUGPLIBPD-GXTWGEPZSA-N 2 0 349.931 4.422 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 ZINC000415073795 1023427566 /nfs/dbraw/zinc/42/75/66/1023427566.db2.gz BNUZYWKHMHFFSF-RJYAGPCLSA-N 2 0 332.850 4.428 20 0 EIADRP COc1cccc([C@@H](N[C@@H]2CCC[NH2+]CC2)c2ccccc2Cl)c1 ZINC000415081244 1023430451 /nfs/dbraw/zinc/43/04/51/1023430451.db2.gz KMPMLBIQVCXSGS-OXQOHEQNSA-N 2 0 344.886 4.170 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccc(Cl)cc1 ZINC000656683486 1023431766 /nfs/dbraw/zinc/43/17/66/1023431766.db2.gz MCMFIKVCUAORCP-MRXNPFEDSA-N 2 0 343.902 4.298 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@@H](C)[C@@H]1CCC[NH2+]C1 ZINC000415089949 1023434413 /nfs/dbraw/zinc/43/44/13/1023434413.db2.gz ZJKNXLXKIQGKLN-RLFYNMQTSA-N 2 0 343.540 4.466 20 0 EIADRP C[C@H](C[N@H+](C)[C@H]1CCN(C)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000500097672 1023499436 /nfs/dbraw/zinc/49/94/36/1023499436.db2.gz MWQQZHXQQMZTDO-KEYYUXOJSA-N 2 0 328.422 4.223 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+]C(C3CCC3)C3CCC3)C2)cc1 ZINC000549237398 1023515746 /nfs/dbraw/zinc/51/57/46/1023515746.db2.gz OMFZOSGKFQEAEF-LJQANCHMSA-N 2 0 326.528 4.109 20 0 EIADRP CC(C)c1ccc(-c2ncc(CN3CCC[C@@H](C[NH3+])C3)s2)cc1 ZINC000430633895 1023539091 /nfs/dbraw/zinc/53/90/91/1023539091.db2.gz CJLKDBBSGNGMEJ-HNNXBMFYSA-N 2 0 329.513 4.104 20 0 EIADRP CO[C@H]1CCC[C@H]([NH2+]Cc2ccc(C[NH+]3CCCCCC3)cc2)C1 ZINC000684370756 1023542675 /nfs/dbraw/zinc/54/26/75/1023542675.db2.gz BBCMQYGSETWIEE-SFTDATJTSA-N 2 0 330.516 4.110 20 0 EIADRP Cc1cc(C[NH2+]Cc2cccc(C[NH+]3CCC(C)CC3)c2)cnc1F ZINC000892943436 1023552899 /nfs/dbraw/zinc/55/28/99/1023552899.db2.gz GXBHQLJYDMHAIN-UHFFFAOYSA-N 2 0 341.474 4.051 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCNc1ccc(SC2CC[NH2+]CC2)cc1 ZINC001167755033 1023641145 /nfs/dbraw/zinc/64/11/45/1023641145.db2.gz YZGHKSBOAQRRKD-QGZVFWFLSA-N 2 0 347.572 4.207 20 0 EIADRP CCC[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]CC2)c1ccc(F)cc1F ZINC000584535162 1023664190 /nfs/dbraw/zinc/66/41/90/1023664190.db2.gz UUERKRFQEDRACW-HXUWFJFHSA-N 2 0 330.422 4.242 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CC2(SC)CC2)ccc1OC ZINC000193830371 1023729282 /nfs/dbraw/zinc/72/92/82/1023729282.db2.gz DKDUTXUFXCETKS-OAHLLOKOSA-N 2 0 336.545 4.083 20 0 EIADRP c1cncc([C@@H]2CCC[C@@H]([NH2+]C[C@@H]3CCC[N@@H+]3C3CCCCC3)C2)c1 ZINC000500377309 1023765281 /nfs/dbraw/zinc/76/52/81/1023765281.db2.gz NZERMFBRINYJGQ-UZKOGDIHSA-N 2 0 341.543 4.495 20 0 EIADRP CCn1cc([C@H](C)[NH2+]Cc2ccccc2C[NH+]2CCCCCC2)cn1 ZINC000164182644 1023788219 /nfs/dbraw/zinc/78/82/19/1023788219.db2.gz MBLOGYRJZMOGBX-SFHVURJKSA-N 2 0 340.515 4.130 20 0 EIADRP CC[N@@H+]1CCC[C@H](C[NH2+]C/C(C)=C\c2ccccc2C(F)(F)F)C1 ZINC000500420902 1023814956 /nfs/dbraw/zinc/81/49/56/1023814956.db2.gz LYNUFAJNEXCBOS-UVQBRAAOSA-N 2 0 340.433 4.430 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)C1 ZINC000500426891 1023822001 /nfs/dbraw/zinc/82/20/01/1023822001.db2.gz HEAJOVMDEXPFDW-SFHLNBCPSA-N 2 0 329.532 4.065 20 0 EIADRP C[C@H]1C[C@@H](CC[NH2+]C2CCC(F)(F)CC2)C[N@@H+]1Cc1ccccc1 ZINC000647196189 1023851071 /nfs/dbraw/zinc/85/10/71/1023851071.db2.gz RSAXFDRKKHQWMB-FUHWJXTLSA-N 2 0 336.470 4.455 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000511741924 1023854077 /nfs/dbraw/zinc/85/40/77/1023854077.db2.gz XSRDEEXCKRQMCP-NURJGKTBSA-N 2 0 344.543 4.194 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000511741925 1023854360 /nfs/dbraw/zinc/85/43/60/1023854360.db2.gz XSRDEEXCKRQMCP-QDDTUJKSSA-N 2 0 344.543 4.194 20 0 EIADRP c1cnc2c(c1)cccc2C[NH+]1CCC(C[NH+]2CCCCCC2)CC1 ZINC000045807125 1024160848 /nfs/dbraw/zinc/16/08/48/1024160848.db2.gz VGKMMNRHQZYVKG-UHFFFAOYSA-N 2 0 337.511 4.323 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]Cc2cccc3ccsc32)[C@H](C)C1 ZINC000652219679 1024389574 /nfs/dbraw/zinc/38/95/74/1024389574.db2.gz IJVSXDVMIVFHGP-APWZRJJASA-N 2 0 346.540 4.128 20 0 EIADRP CCC[NH+]1CCC(NC2(c3ccc(C(F)(F)F)cc3)CC2)CC1 ZINC000652330034 1024616501 /nfs/dbraw/zinc/61/65/01/1024616501.db2.gz RSOPXLJHFDGMLN-UHFFFAOYSA-N 2 0 326.406 4.159 20 0 EIADRP C[C@H](c1ccc(C(C)(C)C)cc1)[N@@H+]1CCC[C@H]([C@H]2C[C@H]([NH3+])CCO2)C1 ZINC000652348184 1024686436 /nfs/dbraw/zinc/68/64/36/1024686436.db2.gz WRFQCAVUBLBMSA-XRULBBBTSA-N 2 0 344.543 4.263 20 0 EIADRP CC(C)c1ccc([C@H](C)[N@@H+]2CCC[C@H]([C@@H]3C[C@@H]([NH3+])CCO3)C2)cc1 ZINC000652350437 1024703462 /nfs/dbraw/zinc/70/34/62/1024703462.db2.gz YMHSDDVBIKOYEF-FIRPJDEBSA-N 2 0 330.516 4.089 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(c2cc[nH+]c3c(O)cccc23)C1 ZINC000684575023 1024827534 /nfs/dbraw/zinc/82/75/34/1024827534.db2.gz IZRMWAWKYAIKLM-SJORKVTESA-N 2 0 339.483 4.031 20 0 EIADRP CS[C@H](C[NH2+][C@H](C)[C@H]1CC[N@H+](Cc2ccccc2)C1)C(C)(C)C ZINC000548486106 1024836692 /nfs/dbraw/zinc/83/66/92/1024836692.db2.gz NUSRTGGYACPLJY-NZSAHSFTSA-N 2 0 334.573 4.264 20 0 EIADRP Cc1ccsc1[C@H](C)[NH2+]Cc1ccc(OCCC[NH+](C)C)cc1 ZINC000165176348 1025033231 /nfs/dbraw/zinc/03/32/31/1025033231.db2.gz IQNMLSPDBXWKPD-INIZCTEOSA-N 2 0 332.513 4.238 20 0 EIADRP CCC[C@@H]([NH2+]Cc1cccc2c1CC[NH2+]C2)c1ccc(F)cc1F ZINC000662283846 1025034324 /nfs/dbraw/zinc/03/43/24/1025034324.db2.gz VQUMGOAVYAXLIU-HXUWFJFHSA-N 2 0 330.422 4.242 20 0 EIADRP C[C@@H](c1ncc(-c2ccccc2)o1)[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662295631 1025048182 /nfs/dbraw/zinc/04/81/82/1025048182.db2.gz VYYDMTBTTWHOLV-QFBILLFUSA-N 2 0 339.483 4.114 20 0 EIADRP COc1ccc(C[NH+]2CCC(C[NH2+]C3CCCCCC3)CC2)cc1 ZINC000063319652 1025084076 /nfs/dbraw/zinc/08/40/76/1025084076.db2.gz BRBLGXGCDBGRBX-UHFFFAOYSA-N 2 0 330.516 4.220 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH2+]CCCc2c(Cl)cccc2Cl)[C@H](C)C1 ZINC000684613736 1025087916 /nfs/dbraw/zinc/08/79/16/1025087916.db2.gz KWQZEZWWMMSKHA-CXAGYDPISA-N 2 0 329.315 4.246 20 0 EIADRP Clc1ccc(C[NH2+]C[C@H]2CCC[N@H+](CC3CC3)C2)c2ncccc12 ZINC000663346534 1025145518 /nfs/dbraw/zinc/14/55/18/1025145518.db2.gz TWLXQMGPPTVWEF-MRXNPFEDSA-N 2 0 343.902 4.100 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]C[C@@H]2CCC[N@H+](CC3CC3)C2)C1 ZINC000663466306 1025391499 /nfs/dbraw/zinc/39/14/99/1025391499.db2.gz QWSPOIUYEAHDQO-HBMCJLEFSA-N 2 0 341.543 4.128 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1CCC[N@H+](CC2CC2)C1)c1cc2ccncc2s1 ZINC000663463803 1025392875 /nfs/dbraw/zinc/39/28/75/1025392875.db2.gz BRZVAFHGHKPBGD-HOCLYGCPSA-N 2 0 329.513 4.069 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+]Cc1nc2c(s1)C[C@@H](c1ccccc1)CC2 ZINC000415006895 1025492863 /nfs/dbraw/zinc/49/28/63/1025492863.db2.gz AQOCIQHWVKGXGN-RDJZCZTQSA-N 2 0 343.540 4.023 20 0 EIADRP Cc1cccc(C)c1OC[C@@H](C)[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167965883 1025545677 /nfs/dbraw/zinc/54/56/77/1025545677.db2.gz PFJXIDPOGINIQG-LBFURVHYSA-N 2 0 342.527 4.066 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH+]1CCC(OCc2ccccc2)CC1 ZINC001167824174 1025570531 /nfs/dbraw/zinc/57/05/31/1025570531.db2.gz CLBCORSVWYINKU-IBGZPJMESA-N 2 0 332.532 4.178 20 0 EIADRP CCN1CCC[C@H]1C[NH2+][C@H](Cc1cccnc1)c1ccc(Cl)cc1 ZINC000546164908 1025580595 /nfs/dbraw/zinc/58/05/95/1025580595.db2.gz VRAPUAJVFKFDFX-VQTJNVASSA-N 2 0 343.902 4.093 20 0 EIADRP COc1cccc(CCC[N@@H+]2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000303939287 1025588938 /nfs/dbraw/zinc/58/89/38/1025588938.db2.gz SIYIDRPZKPZNRG-NRFANRHFSA-N 2 0 344.543 4.072 20 0 EIADRP CC[C@H](CC(F)(F)F)[NH2+]C1CCN(CCc2ccccc2)CC1 ZINC000546165262 1025597587 /nfs/dbraw/zinc/59/75/87/1025597587.db2.gz BEINYOYJCRZTMT-MRXNPFEDSA-N 2 0 328.422 4.014 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[N@@H+]1CCC[C@H](Sc2ccncc2)C1 ZINC001167826941 1025629489 /nfs/dbraw/zinc/62/94/89/1025629489.db2.gz SDMRAAGPEFDRGV-MJGOQNOKSA-N 2 0 335.561 4.149 20 0 EIADRP COCc1csc(C[NH2+]Cc2ccccc2C[NH+]2CCCCC2)c1 ZINC000657296311 1025753946 /nfs/dbraw/zinc/75/39/46/1025753946.db2.gz HIOXOGOMNXLRPK-UHFFFAOYSA-N 2 0 344.524 4.170 20 0 EIADRP CN1CC[C@H](C[NH2+][C@H]2CCc3cc(F)ccc32)[C@@H]1c1cccs1 ZINC000363785480 1025827034 /nfs/dbraw/zinc/82/70/34/1025827034.db2.gz FIXFSLZQIIQZAQ-DKSSEZFCSA-N 2 0 330.472 4.157 20 0 EIADRP CCc1ccc(C[NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)cn1 ZINC000512047147 1025842631 /nfs/dbraw/zinc/84/26/31/1025842631.db2.gz XRMRDKQSQYBOHP-ICSRJNTNSA-N 2 0 337.511 4.034 20 0 EIADRP C[C@@H](C[NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccc(F)cc1 ZINC000415012432 1025846844 /nfs/dbraw/zinc/84/68/44/1025846844.db2.gz XEDPCEAYMDKVOH-UQASEVPWSA-N 2 0 344.449 4.051 20 0 EIADRP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@@H]1C)c1ccc(OC(F)F)cc1 ZINC000319773496 1025858515 /nfs/dbraw/zinc/85/85/15/1025858515.db2.gz FKIHICHZNXZGPQ-LSDHHAIUSA-N 2 0 326.431 4.203 20 0 EIADRP C[C@@H]([NH2+]CCC[N@@H+]1CCCC[C@H]1C)c1ccc(OC(F)F)cc1 ZINC000319773493 1025859558 /nfs/dbraw/zinc/85/95/58/1025859558.db2.gz FKIHICHZNXZGPQ-HUUCEWRRSA-N 2 0 326.431 4.203 20 0 EIADRP C[C@@H]1C[N@H+](CCC[NH2+][C@@H](c2ccccc2)C2CCCC2)CCCO1 ZINC000432404667 1025871674 /nfs/dbraw/zinc/87/16/74/1025871674.db2.gz FFCPEKVNRQKPJN-NQIIRXRSSA-N 2 0 330.516 4.008 20 0 EIADRP CCO[C@H]1C[C@@H]([NH2+]Cc2ccc(Cn3ccnc3)cc2)C1(CC)CC ZINC000344033678 1025889809 /nfs/dbraw/zinc/88/98/09/1025889809.db2.gz LPXHNRVSHVIAFV-UXHICEINSA-N 2 0 341.499 4.005 20 0 EIADRP CCC[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1ccsc1 ZINC000187766265 1025890572 /nfs/dbraw/zinc/89/05/72/1025890572.db2.gz HYQYIAKVDWYVCZ-LJQANCHMSA-N 2 0 329.513 4.491 20 0 EIADRP C[C@H]([NH2+]CCCN1CCCO[C@H](C)C1)c1cc(Cl)cc(Cl)c1 ZINC000432418146 1025896550 /nfs/dbraw/zinc/89/65/50/1025896550.db2.gz QJONPYUMIPQMEU-KGLIPLIRSA-N 2 0 345.314 4.145 20 0 EIADRP Clc1cccc([C@H]2C[C@@H]2[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167968566 1025906038 /nfs/dbraw/zinc/90/60/38/1025906038.db2.gz RNEQODQCZMQXSI-NOSIKRSBSA-N 2 0 330.903 4.191 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H]2CCCOc3cc4c(cc32)CCC4)C1 ZINC000431333173 1025922105 /nfs/dbraw/zinc/92/21/05/1025922105.db2.gz MWJLVVBLPPQEQJ-LAUBAEHRSA-N 2 0 342.527 4.099 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2cc3ccncc3s2)C1 ZINC000657313477 1025965511 /nfs/dbraw/zinc/96/55/11/1025965511.db2.gz SEXQQMPDWLDHMV-IYBDPMFKSA-N 2 0 331.529 4.144 20 0 EIADRP CCOc1cccc([C@@H](C)[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)c1 ZINC001167971509 1026074304 /nfs/dbraw/zinc/07/43/04/1026074304.db2.gz WSZYWHUJVGWXGI-MIJOPJBOSA-N 2 0 328.500 4.141 20 0 EIADRP CCC[N@@H+]1CC[C@H](C[NH2+][C@H]2CCCOc3c(C)cc(Cl)cc32)C1 ZINC000431347650 1026085006 /nfs/dbraw/zinc/08/50/06/1026085006.db2.gz GGIVQORIIKOZFS-QAPCUYQASA-N 2 0 336.907 4.184 20 0 EIADRP CCC[N@@H+]1CC[C@@H](C[NH2+][C@@H]2CCCOc3c(C)cc(Cl)cc32)C1 ZINC000431347649 1026085447 /nfs/dbraw/zinc/08/54/47/1026085447.db2.gz GGIVQORIIKOZFS-MAUKXSAKSA-N 2 0 336.907 4.184 20 0 EIADRP CC(C)SCC[N@H+](C)[C@H]1CCC[NH+](CCSC(C)C)CC1 ZINC000514096016 1026134541 /nfs/dbraw/zinc/13/45/41/1026134541.db2.gz RDIIMZRSETXYSV-KRWDZBQOSA-N 2 0 332.623 4.056 20 0 EIADRP CC(C)c1ccc(CC[NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)cc1 ZINC001167974370 1026174665 /nfs/dbraw/zinc/17/46/65/1026174665.db2.gz YFJMFCGIDVDOPL-FRIKZZABSA-N 2 0 326.528 4.348 20 0 EIADRP CC(C)(C)C[N@@H+](C1C[C@H]2CC[C@@H](C1)[NH+]2CC1CC1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001167975073 1026222192 /nfs/dbraw/zinc/22/21/92/1026222192.db2.gz GMXDVAWGIHJANC-UKVDTYTHSA-N 2 0 347.591 4.010 20 0 EIADRP Fc1cccc(CC2([NH2+]C3C[C@H]4CC[C@@H](C3)[N@H+]4CC3CC3)CCC2)c1 ZINC001167975155 1026224146 /nfs/dbraw/zinc/22/41/46/1026224146.db2.gz JIDSWUOEAPDLSN-SEJPIABJSA-N 2 0 342.502 4.286 20 0 EIADRP COc1ccc([C@H](C)[NH2+]CCCC[NH+]2C[C@H](C)C[C@@H](C)C2)cc1OC ZINC000467834283 1026292133 /nfs/dbraw/zinc/29/21/33/1026292133.db2.gz IEFSAHODHCTBLJ-KURKYZTESA-N 2 0 348.531 4.113 20 0 EIADRP Fc1ccccc1CC1([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CCC1 ZINC001167977876 1026340413 /nfs/dbraw/zinc/34/04/13/1026340413.db2.gz HNNBLDYLSQAWNU-IHWFROFDSA-N 2 0 342.502 4.286 20 0 EIADRP CCC1([NH2+]C2C[C@H]3CC[C@@H](C2)[N@H+]3CC2CC2)CCC(F)(F)CC1 ZINC001167979041 1026348664 /nfs/dbraw/zinc/34/86/64/1026348664.db2.gz STTIZQPKVRKXID-ALOPSCKCSA-N 2 0 326.475 4.340 20 0 EIADRP CC[NH+]1CCC(CC[NH2+]Cc2ccc(-c3scnc3C)cc2)CC1 ZINC000657375957 1026369434 /nfs/dbraw/zinc/36/94/34/1026369434.db2.gz GMNSQORBDKKQRE-UHFFFAOYSA-N 2 0 343.540 4.330 20 0 EIADRP C[N@H+](Cc1cc2ccnc(Cl)c2s1)C1C[C@H]2CC[C@@H](C1)[NH+]2C ZINC000894748168 1026391237 /nfs/dbraw/zinc/39/12/37/1026391237.db2.gz IGLBTSFHNUAABW-PBWFPOADSA-N 2 0 335.904 4.007 20 0 EIADRP CCCC[N@H+](C)CC1CC[NH+](C/C=C\c2ccccc2OC)CC1 ZINC000506867956 1026476130 /nfs/dbraw/zinc/47/61/30/1026476130.db2.gz PMOYYSUDJWOAFV-NTMALXAHSA-N 2 0 330.516 4.152 20 0 EIADRP CCCOc1ccc(C[NH+]2CCC(C[NH+](CC)CC)CC2)cc1OC ZINC000506882481 1026485185 /nfs/dbraw/zinc/48/51/85/1026485185.db2.gz WRVUQJWUWCCYMQ-UHFFFAOYSA-N 2 0 348.531 4.038 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cnc(C3CCCC3)s2)CC1 ZINC000506942674 1026530019 /nfs/dbraw/zinc/53/00/19/1026530019.db2.gz CMHXBFOESDDNBV-UHFFFAOYSA-N 2 0 335.561 4.355 20 0 EIADRP C[C@H]([NH2+]Cc1cc2ccncc2s1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000657430592 1026644293 /nfs/dbraw/zinc/64/42/93/1026644293.db2.gz RSQZTABUPRTFDR-GOEBONIOSA-N 2 0 329.513 4.039 20 0 EIADRP CC(C)n1nccc1C[NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC000279877648 1026745924 /nfs/dbraw/zinc/74/59/24/1026745924.db2.gz KATXARHUBMABAX-GOSISDBHSA-N 2 0 340.515 4.128 20 0 EIADRP Cc1ncsc1-c1ccc(C[NH2+]CC2CC[NH+](C3CC3)CC2)cc1 ZINC000657450090 1026751187 /nfs/dbraw/zinc/75/11/87/1026751187.db2.gz MJKDIUNMBUMDBO-UHFFFAOYSA-N 2 0 341.524 4.083 20 0 EIADRP Fc1ccc(C[NH2+][C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1-c1cccs1 ZINC000391397338 1026752904 /nfs/dbraw/zinc/75/29/04/1026752904.db2.gz NGACIKXWBJKFLW-HOTGVXAUSA-N 2 0 330.472 4.271 20 0 EIADRP COc1ccccc1[C@@H]([NH2+]CC1(C)CC[NH+](C)CC1)C1CCCC1 ZINC000507424018 1026789581 /nfs/dbraw/zinc/78/95/81/1026789581.db2.gz SPSGYNKQEWYCOC-FQEVSTJZSA-N 2 0 330.516 4.248 20 0 EIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+]CC1(C)CC[NH+](C)CC1)CCCO2 ZINC000507447502 1026797860 /nfs/dbraw/zinc/79/78/60/1026797860.db2.gz IGXUCUDDOASERP-LJQANCHMSA-N 2 0 330.516 4.345 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+]CC1(C)CC[NH+](C)CC1 ZINC000507479188 1026808148 /nfs/dbraw/zinc/80/81/48/1026808148.db2.gz NXDJLYDMSXMQCV-OAHLLOKOSA-N 2 0 342.449 4.348 20 0 EIADRP CCc1cccnc1[C@H](C)[NH2+]Cc1ccc(C[NH+](CC)CC)cc1 ZINC000507520585 1026827067 /nfs/dbraw/zinc/82/70/67/1026827067.db2.gz ROZLTRPONUWTCT-KRWDZBQOSA-N 2 0 325.500 4.337 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)CCCOc2cccc3ccccc32)C[C@H]1C ZINC001167589381 1026859581 /nfs/dbraw/zinc/85/95/81/1026859581.db2.gz DKKYOBPXNIBJDQ-UYAOXDASSA-N 2 0 340.511 4.413 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1C[N@H+]1C[C@H](C)C[C@H](C)C1)C1CCOCC1 ZINC000474484331 1027119689 /nfs/dbraw/zinc/11/96/89/1027119689.db2.gz HXOKRCNVJMDSJM-OTWHNJEPSA-N 2 0 344.543 4.069 20 0 EIADRP C[NH+]1CCC(Oc2ccc(C[NH2+][C@@H]3CCC[C@H]3CCCF)cc2)CC1 ZINC000342824895 1027178883 /nfs/dbraw/zinc/17/88/83/1027178883.db2.gz KLDULINDHQEJIA-GHTZIAJQSA-N 2 0 348.506 4.168 20 0 EIADRP C[C@@H]1CC([NH2+]C2(c3ccc(N)cc3)CC2)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168038993 1027315643 /nfs/dbraw/zinc/31/56/43/1027315643.db2.gz ASHSFRIRTNOHRH-QZTJIDSGSA-N 2 0 349.522 4.289 20 0 EIADRP c1[nH]c2ccccc2c1C1CC[NH+](CCC[NH+]2CCCCC2)CC1 ZINC000034801033 1027338605 /nfs/dbraw/zinc/33/86/05/1027338605.db2.gz CSYQAZGMLGSKCF-UHFFFAOYSA-N 2 0 325.500 4.223 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1 ZINC000320915259 1027562082 /nfs/dbraw/zinc/56/20/82/1027562082.db2.gz DOOGLPPWFUVPDY-UNEWFSDZSA-N 2 0 326.406 4.230 20 0 EIADRP FC(F)(F)CCC(CCC(F)(F)F)[NH2+][C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000657706271 1027759496 /nfs/dbraw/zinc/75/94/96/1027759496.db2.gz KYOPEPAYXVVQLE-STQMWFEESA-N 2 0 346.359 4.256 20 0 EIADRP Fc1cccc([C@@H]2CCC[N@@H+]2C2C[C@H]3CC[C@@H](C2)[NH+]3CC2CC2)c1 ZINC001167996134 1027847253 /nfs/dbraw/zinc/84/72/53/1027847253.db2.gz XEGOZEJYUMDGKC-JKWVGCSGSA-N 2 0 328.475 4.368 20 0 EIADRP CC(F)(F)CCC[N@@H+]1CC[C@@H]2[C@@H](CCC[NH+]2Cc2ccccc2)C1 ZINC001167648721 1027851083 /nfs/dbraw/zinc/85/10/83/1027851083.db2.gz XLXFZCVLFLCJPK-RBUKOAKNSA-N 2 0 336.470 4.408 20 0 EIADRP C[N@@H+](CCCc1cc(-c2ccccc2)no1)CCC[NH+]1CCCCC1 ZINC000444585170 1027884559 /nfs/dbraw/zinc/88/45/59/1027884559.db2.gz XNSBKGJGMAQFFT-UHFFFAOYSA-N 2 0 341.499 4.082 20 0 EIADRP FC(F)(F)c1cccc([C@H]2C[C@H]([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)C2)c1 ZINC000280803824 1027894992 /nfs/dbraw/zinc/89/49/92/1027894992.db2.gz LBRWSLUVFNRDMD-VDHUWJSZSA-N 2 0 338.417 4.168 20 0 EIADRP C[C@@H](c1ccncc1)[NH+](C)CCCCC[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000091988586 1028146651 /nfs/dbraw/zinc/14/66/51/1028146651.db2.gz IGWFOTRNYNMTDV-OALUTQOASA-N 2 0 340.515 4.333 20 0 EIADRP c1cc2c(s1)C[NH+](CCCCC[N@@H+]1CCc3ccsc3C1)CC2 ZINC000536368156 1028178770 /nfs/dbraw/zinc/17/87/70/1028178770.db2.gz GEDCMZMYWKIKNL-UHFFFAOYSA-N 2 0 346.565 4.396 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](c1cncc(F)c1)C1CC1 ZINC000281095773 1028375090 /nfs/dbraw/zinc/37/50/90/1028375090.db2.gz AXEQVDAVSVKPNN-OAQYLSRUSA-N 2 0 341.474 4.302 20 0 EIADRP FC(F)(F)c1ccc(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000261827620 1028417571 /nfs/dbraw/zinc/41/75/71/1028417571.db2.gz XHBUGBICBCMFCN-IXDOHACOSA-N 2 0 326.406 4.106 20 0 EIADRP FC(F)(F)c1ccc(C[NH2+][C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)cc1 ZINC000261827624 1028418657 /nfs/dbraw/zinc/41/86/57/1028418657.db2.gz XHBUGBICBCMFCN-YESZJQIVSA-N 2 0 326.406 4.106 20 0 EIADRP CC[NH+](CC)Cc1ccc(CN[C@H](c2ncc[nH]2)c2ccccc2)cc1 ZINC000125614950 1028438116 /nfs/dbraw/zinc/43/81/16/1028438116.db2.gz VLLIAVCCRQGRMG-NRFANRHFSA-N 2 0 348.494 4.131 20 0 EIADRP Fc1cncc([C@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)C2CC2)c1 ZINC000281266311 1028480004 /nfs/dbraw/zinc/48/00/04/1028480004.db2.gz OYFJKNXNSBKORP-OAQYLSRUSA-N 2 0 339.458 4.057 20 0 EIADRP Cc1nc(-c2ccccc2)sc1[C@H](C)[NH2+][C@H]1CC[C@H](C[NH3+])CC1 ZINC000635003737 1028812505 /nfs/dbraw/zinc/81/25/05/1028812505.db2.gz BCDSPZXHOHQGPN-QRTARXTBSA-N 2 0 329.513 4.287 20 0 EIADRP Clc1ccc([C@H]2C[C@H]([NH2+][C@H]3CC[N@@H+]4CCC[C@H]4C3)C2)cc1Cl ZINC000281644673 1028822495 /nfs/dbraw/zinc/82/24/95/1028822495.db2.gz PEJBTUTTXLYPJY-VGWMRTNUSA-N 2 0 339.310 4.456 20 0 EIADRP C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000347001248 1028837925 /nfs/dbraw/zinc/83/79/25/1028837925.db2.gz GVNOGJMJNKQWEU-DZGCQCFKSA-N 2 0 334.410 4.000 20 0 EIADRP C[C@H](CCc1ccc(Cl)s1)[NH2+]Cc1ccc(C[NH3+])cc1F ZINC000650717594 1028874779 /nfs/dbraw/zinc/87/47/79/1028874779.db2.gz GTCPTMQGOYNUOR-LLVKDONJSA-N 2 0 326.868 4.110 20 0 EIADRP C[N@@H+](Cc1cc(F)ccc1Cl)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000445806537 1028901767 /nfs/dbraw/zinc/90/17/67/1028901767.db2.gz WYNWZDHMXFNFKV-UHFFFAOYSA-N 2 0 347.865 4.223 20 0 EIADRP COCCC[C@H]([NH2+]C[C@H]1CCC[N@@H+](C(C)C)C1)c1ccc(F)cc1 ZINC000281880162 1028905675 /nfs/dbraw/zinc/90/56/75/1028905675.db2.gz GDLNGWTXJXLZPT-XLIONFOSSA-N 2 0 336.495 4.003 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cc3ccccc3nc2Cl)CC1 ZINC000728571646 1028980548 /nfs/dbraw/zinc/98/05/48/1028980548.db2.gz IQSPSFGRYJVWEA-UHFFFAOYSA-N 2 0 345.918 4.440 20 0 EIADRP Cc1ccsc1C[N@@H+]1CC[C@]2(CC[NH+](Cc3ccccc3)C2)C1 ZINC000583660787 1029002931 /nfs/dbraw/zinc/00/29/31/1029002931.db2.gz MFWBSJIYHNLTMC-FQEVSTJZSA-N 2 0 326.509 4.155 20 0 EIADRP C[C@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc(Oc2ccccc2)c(F)c1 ZINC000650743941 1029064209 /nfs/dbraw/zinc/06/42/09/1029064209.db2.gz BWUOIJQGXKQNDA-HNNXBMFYSA-N 2 0 328.431 4.398 20 0 EIADRP CC(C)COc1ccc([C@@H](C)[NH2+]Cc2ccc(C[NH3+])cc2F)cc1 ZINC000650751923 1029145281 /nfs/dbraw/zinc/14/52/81/1029145281.db2.gz FOKYFPVITYLYKQ-OAHLLOKOSA-N 2 0 330.447 4.170 20 0 EIADRP Cc1cc2c(cc1C)[C@H]([NH2+]Cc1ccc(C[NH3+])cc1F)CCS2 ZINC000650755045 1029185776 /nfs/dbraw/zinc/18/57/76/1029185776.db2.gz XJYBEVATNRIGIB-GOSISDBHSA-N 2 0 330.472 4.228 20 0 EIADRP Cc1cc2c(cc1C)[C@@H]([NH2+]Cc1ccc(C[NH3+])cc1F)CCS2 ZINC000650755046 1029186385 /nfs/dbraw/zinc/18/63/85/1029186385.db2.gz XJYBEVATNRIGIB-SFHVURJKSA-N 2 0 330.472 4.228 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](C2CC2)CC1)[C@H](C)c1nc2ccccc2s1 ZINC000278480451 1029326327 /nfs/dbraw/zinc/32/63/27/1029326327.db2.gz OPJIILKYDKCCCB-LSDHHAIUSA-N 2 0 343.540 4.252 20 0 EIADRP c1sc(C[NH2+]CC2CC[NH+](CC3CC3)CC2)nc1-c1ccccc1 ZINC000657813765 1029478143 /nfs/dbraw/zinc/47/81/43/1029478143.db2.gz ZNXPJJKQVXVXCN-UHFFFAOYSA-N 2 0 341.524 4.022 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]Cc2ccc3ncccc3c2)CC1 ZINC000475339032 1029554636 /nfs/dbraw/zinc/55/46/36/1029554636.db2.gz XMICWEZVLAPRJH-VGSWGCGISA-N 2 0 337.511 4.368 20 0 EIADRP C[NH+](C)C[C@H]1CCN(Cc2ccc(Oc3cccc(F)c3)cc2)C1 ZINC000446766408 1029566645 /nfs/dbraw/zinc/56/66/45/1029566645.db2.gz HVRKHPVEAOKCTN-QGZVFWFLSA-N 2 0 328.431 4.002 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cc2ccccc2s1 ZINC000446817222 1029580715 /nfs/dbraw/zinc/58/07/15/1029580715.db2.gz GYDWWPGMKKJUJB-ZACQAIPSSA-N 2 0 346.540 4.441 20 0 EIADRP CSC1CC[NH+]([C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)[C@@H](C)C2)CC1 ZINC001168063143 1029605511 /nfs/dbraw/zinc/60/55/11/1029605511.db2.gz MEOWZSGNEZHNRL-IZZQQSIFSA-N 2 0 332.557 4.255 20 0 EIADRP Fc1ccc(C2=CC[C@H]([NH2+]CC3CC[NH+](C4CC4)CC3)CC2)cc1 ZINC000446887304 1029632443 /nfs/dbraw/zinc/63/24/43/1029632443.db2.gz QYLDJAXCCDCVNZ-FQEVSTJZSA-N 2 0 328.475 4.226 20 0 EIADRP Cc1ccc(C[N@H+]2CC[C@@H](CN(C)Cc3cccc(F)c3)C2)s1 ZINC000584259148 1029698729 /nfs/dbraw/zinc/69/87/29/1029698729.db2.gz YOSSQWDXGFTCOD-KRWDZBQOSA-N 2 0 332.488 4.150 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCC[C@@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657838281 1029724653 /nfs/dbraw/zinc/72/46/53/1029724653.db2.gz PYOBGHVSNFTFBW-CABCVRRESA-N 2 0 325.447 4.182 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@@H+]1CCC[C@H](C)C1)c1ccc(C(F)F)nc1 ZINC000657838284 1029727935 /nfs/dbraw/zinc/72/79/35/1029727935.db2.gz PYOBGHVSNFTFBW-LSDHHAIUSA-N 2 0 325.447 4.182 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc(Br)c(Cl)c2)C1 ZINC000657840429 1029747358 /nfs/dbraw/zinc/74/73/58/1029747358.db2.gz GHSFFXIHYYXJAN-RYUDHWBXSA-N 2 0 345.712 4.095 20 0 EIADRP C[C@H](C[NH2+]Cc1cccc(OCc2ccccc2)c1)C[NH+]1CCCC1 ZINC000394463726 1029824384 /nfs/dbraw/zinc/82/43/84/1029824384.db2.gz JBOYGIKJRRRHJX-LJQANCHMSA-N 2 0 338.495 4.087 20 0 EIADRP CC(C)[C@H]([NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1)c1cccnc1 ZINC000091310344 1029883461 /nfs/dbraw/zinc/88/34/61/1029883461.db2.gz SZBKJFJSLSFOQK-NRFANRHFSA-N 2 0 325.500 4.409 20 0 EIADRP c1c[nH]c([C@H]2CCC[N@@H+](Cc3cccc(OC4CCCC4)c3)C2)n1 ZINC000092071784 1029900123 /nfs/dbraw/zinc/90/01/23/1029900123.db2.gz BCQXMTYGFARYCR-KRWDZBQOSA-N 2 0 325.456 4.111 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1OC ZINC000183187485 1029990025 /nfs/dbraw/zinc/99/00/25/1029990025.db2.gz UNTAPTLJWLZMII-QKLQHJQFSA-N 2 0 330.516 4.389 20 0 EIADRP CC[NH+](CC)CCOc1ccccc1C[NH2+][C@@H](C)c1cc(C)oc1C ZINC000447545035 1030151171 /nfs/dbraw/zinc/15/11/71/1030151171.db2.gz QLJSIGNNODBBSL-KRWDZBQOSA-N 2 0 344.499 4.468 20 0 EIADRP C[C@H]([NH2+]CC1CC[NH+](C2CC2)CC1)c1ccc(OC(C)(C)C)cc1 ZINC000447565128 1030175815 /nfs/dbraw/zinc/17/58/15/1030175815.db2.gz IWSISBJZQDKZSI-INIZCTEOSA-N 2 0 330.516 4.389 20 0 EIADRP Clc1ccc2c(c1)OCCC[C@H]2[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000447566726 1030179153 /nfs/dbraw/zinc/17/91/53/1030179153.db2.gz WAFUYFWFVUZSRG-GOSISDBHSA-N 2 0 334.891 4.018 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@H]([NH2+]Cc2ccc4c(c2)COC4)C3)cc1 ZINC000447587132 1030187226 /nfs/dbraw/zinc/18/72/26/1030187226.db2.gz OWKTWBABVZFFNF-WBDAEOGXSA-N 2 0 348.490 4.002 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]C2(c4ccccc4)CC2)C3)cc1 ZINC000447589013 1030189134 /nfs/dbraw/zinc/18/91/34/1030189134.db2.gz WHKODEOKIONNNL-KOUNCHBCSA-N 2 0 332.491 4.461 20 0 EIADRP CC[C@H]1C[C@H]([NH2+]Cc2ccccc2C[NH+]2CCCCCC2)CCO1 ZINC000648453869 1030215016 /nfs/dbraw/zinc/21/50/16/1030215016.db2.gz LRTONMAQNMCQBO-RTWAWAEBSA-N 2 0 330.516 4.110 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]Cc1ccc(-c2ccccc2)s1 ZINC000530214086 1030218998 /nfs/dbraw/zinc/21/89/98/1030218998.db2.gz XMTHCGYXQBJLDF-CQSZACIVSA-N 2 0 337.492 4.428 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc(C[NH+](CC)CC)cc1)c1ccc(F)cn1 ZINC000392486413 1030303189 /nfs/dbraw/zinc/30/31/89/1030303189.db2.gz LRPFODGOBCTDBP-LJQANCHMSA-N 2 0 329.463 4.303 20 0 EIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+]CCc2ccc(F)c(F)c2)CC1 ZINC000530329386 1030319647 /nfs/dbraw/zinc/31/96/47/1030319647.db2.gz XQBLYLKXRKAWKH-MGPUTAFESA-N 2 0 336.470 4.140 20 0 EIADRP CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1cccc2cnccc21 ZINC000685456721 1030335084 /nfs/dbraw/zinc/33/50/84/1030335084.db2.gz NZINRAIZGRWGDA-UHFFFAOYSA-N 2 0 333.479 4.319 20 0 EIADRP CC[C@H]([NH2+]CCc1cncn1C)c1ccc(Oc2ccccc2)cc1 ZINC000530407316 1030377635 /nfs/dbraw/zinc/37/76/35/1030377635.db2.gz PRWXJBSSSMHNFG-NRFANRHFSA-N 2 0 335.451 4.496 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+]Cc1ccnn1-c1ccccc1 ZINC000447930376 1030444172 /nfs/dbraw/zinc/44/41/72/1030444172.db2.gz LQVIETAGDCKFSH-UHFFFAOYSA-N 2 0 348.494 4.004 20 0 EIADRP C[C@@H]([NH2+]CCCc1ccccc1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000530477276 1030447364 /nfs/dbraw/zinc/44/73/64/1030447364.db2.gz XBPRETQYAMNESR-WIYYLYMNSA-N 2 0 340.486 4.259 20 0 EIADRP C[C@@H]([NH2+]C1CCN([C@H](C)c2ccccc2)CC1)c1cccc(CO)c1 ZINC000121857381 1030462169 /nfs/dbraw/zinc/46/21/69/1030462169.db2.gz GHVJHCXJVAJRRL-QZTJIDSGSA-N 2 0 338.495 4.055 20 0 EIADRP COCCCC[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)c1ccccc1 ZINC000527241351 1030571674 /nfs/dbraw/zinc/57/16/74/1030571674.db2.gz WZTQJDFLTGYOSB-NRFANRHFSA-N 2 0 330.516 4.008 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(Cl)c3cccnc23)C[C@@H]1C ZINC000530663223 1030620934 /nfs/dbraw/zinc/62/09/34/1030620934.db2.gz YNSHKOXVEPOUSC-GOEBONIOSA-N 2 0 331.891 4.193 20 0 EIADRP CCOC1CCC([NH2+]CC[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000657933747 1030628446 /nfs/dbraw/zinc/62/84/46/1030628446.db2.gz VFCDYNUWTHIUGV-JSFXGIFRSA-N 2 0 344.543 4.224 20 0 EIADRP C[C@@H]([NH2+]CC1=CC[N@H+](C)CC1)c1ccc(Br)c(Cl)c1 ZINC000657939433 1030644956 /nfs/dbraw/zinc/64/49/56/1030644956.db2.gz YBZFAGOCFBEEOL-LLVKDONJSA-N 2 0 343.696 4.015 20 0 EIADRP CC[N@@H+](Cc1cc(F)ccc1F)CC1CCN(c2ccccn2)CC1 ZINC000530757294 1030705513 /nfs/dbraw/zinc/70/55/13/1030705513.db2.gz WTZQUQFMISWZGF-UHFFFAOYSA-N 2 0 345.437 4.098 20 0 EIADRP C[C@H](N[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1cc2cnccc2o1 ZINC000657968523 1030713441 /nfs/dbraw/zinc/71/34/41/1030713441.db2.gz AVYDFSDXBNKYKE-JYJNAYRXSA-N 2 0 327.472 4.131 20 0 EIADRP Cc1cc(C[NH2+]CC2CC[NH+](Cc3ccccc3Cl)CC2)ccn1 ZINC000527658347 1030814067 /nfs/dbraw/zinc/81/40/67/1030814067.db2.gz XEAKOMCVGZWMPV-UHFFFAOYSA-N 2 0 343.902 4.045 20 0 EIADRP CCCC[C@H]([NH2+]CC1CC[NH+](C2CCOCC2)CC1)c1ccccc1 ZINC000658068607 1030814261 /nfs/dbraw/zinc/81/42/61/1030814261.db2.gz XOWFVHPLIGQKRJ-QFIPXVFZSA-N 2 0 344.543 4.399 20 0 EIADRP Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]CC1CC[NH+](C2CCOCC2)CC1 ZINC000658067899 1030814371 /nfs/dbraw/zinc/81/43/71/1030814371.db2.gz RJMRUUGYJIPIMG-LAUBAEHRSA-N 2 0 342.527 4.024 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]CCc3noc4ccccc43)CC2)C1 ZINC000658067711 1030814627 /nfs/dbraw/zinc/81/46/27/1030814627.db2.gz YCSCMAPOSXRDCT-SJLPKXTDSA-N 2 0 341.499 4.003 20 0 EIADRP Cc1ccc([C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)C2CC2)cc1 ZINC000658165438 1030862647 /nfs/dbraw/zinc/86/26/47/1030862647.db2.gz JQKRLMJYUKRXSN-HSZRJFAPSA-N 2 0 349.522 4.343 20 0 EIADRP CCC[C@@H]([NH2+]CC1CC[NH+](Cc2ccncc2)CC1)c1ccsc1 ZINC000658167518 1030864134 /nfs/dbraw/zinc/86/41/34/1030864134.db2.gz SMMWXYJBASGITM-HXUWFJFHSA-N 2 0 343.540 4.486 20 0 EIADRP CC1(C)C[C@@H]([NH2+]CC2CC[NH+](Cc3ccncc3)CC2)c2ccccc21 ZINC000658167266 1030864618 /nfs/dbraw/zinc/86/46/18/1030864618.db2.gz RHWCYTXXCATXIP-JOCHJYFZSA-N 2 0 349.522 4.306 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1C[N@H+](Cc2ccccc2)CC12CCC2)c1cncs1 ZINC000658319532 1030978827 /nfs/dbraw/zinc/97/88/27/1030978827.db2.gz FYEQZJAXPOQXRL-SJLPKXTDSA-N 2 0 341.524 4.096 20 0 EIADRP c1ccc(C[N@H+]2C[C@@H](C[NH2+][C@@H]3CCCSCC3)C3(CCC3)C2)cc1 ZINC000658318857 1030979119 /nfs/dbraw/zinc/97/91/19/1030979119.db2.gz SYJIGFXSIYEVLD-WOJBJXKFSA-N 2 0 344.568 4.164 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1cccc(Br)n1 ZINC000924528622 1031036524 /nfs/dbraw/zinc/03/65/24/1031036524.db2.gz ONVNJQBHOXMDOW-ZIAGYGMSSA-N 2 0 342.325 4.005 20 0 EIADRP CN1CC[C@H]([NH2+]Cc2cccc3cccnc32)C[C@H]1c1ccccc1 ZINC000340213240 1031189292 /nfs/dbraw/zinc/18/92/92/1031189292.db2.gz VDTBZFZNZFNWFT-SFTDATJTSA-N 2 0 331.463 4.160 20 0 EIADRP COc1cccc(C[N@H+](C2CCC(C)CC2)[C@H]2CC[C@H]([NH3+])CC2)c1 ZINC001168205432 1031271662 /nfs/dbraw/zinc/27/16/62/1031271662.db2.gz BNQAZPOQRQPFBB-YAEFEIELSA-N 2 0 330.516 4.346 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC(NC2CC[NH+](C3CCC3)CC2)CC1 ZINC000449096833 1031441137 /nfs/dbraw/zinc/44/11/37/1031441137.db2.gz JUVDVZHPGWYVMD-UHFFFAOYSA-N 2 0 349.607 4.272 20 0 EIADRP c1cc(C[NH2+][C@H]2CCOC3(CCC3)C2)cc(C[NH+]2CCCCCC2)c1 ZINC000449109049 1031447036 /nfs/dbraw/zinc/44/70/36/1031447036.db2.gz XCQBXEWBKZXGRH-NRFANRHFSA-N 2 0 342.527 4.254 20 0 EIADRP C[C@H](Cc1ccccc1)[NH+]1CCC([NH2+]CCCOC2CCCC2)CC1 ZINC000449108150 1031447048 /nfs/dbraw/zinc/44/70/48/1031447048.db2.gz SHYXACNIBQFHLU-LJQANCHMSA-N 2 0 344.543 4.021 20 0 EIADRP CC[C@H]([NH2+]Cc1ccccc1C[N@@H+]1CCCC[C@@H]1C)C1CCOCC1 ZINC000531682127 1031474840 /nfs/dbraw/zinc/47/48/40/1031474840.db2.gz HNOMNZUCSCQWCA-AVRDEDQJSA-N 2 0 344.543 4.356 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@@H]2CCCOc3ccc(C)cc32)c1 ZINC000123946043 1031496472 /nfs/dbraw/zinc/49/64/72/1031496472.db2.gz CXZWFBYNEISKJW-OAQYLSRUSA-N 2 0 338.495 4.450 20 0 EIADRP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C[C@H]1CCC[N@H+](C)C1 ZINC000531715397 1031501581 /nfs/dbraw/zinc/50/15/81/1031501581.db2.gz ZOOLAGCFLCYWSC-GDBMZVCRSA-N 2 0 326.937 4.142 20 0 EIADRP C[C@@H](O)CC(C)(C)C[NH2+]C1CC[NH+](C(C)(C)CC(C)(C)C)CC1 ZINC000449161894 1031503563 /nfs/dbraw/zinc/50/35/63/1031503563.db2.gz PSSPUGHXOOBPRG-MRXNPFEDSA-N 2 0 326.569 4.052 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+][C@@H]2[C@H]3CCO[C@H]3C2(C)C)CC1 ZINC000449163139 1031504179 /nfs/dbraw/zinc/50/41/79/1031504179.db2.gz LJGBCPYARCDWKK-KZNAEPCWSA-N 2 0 336.564 4.069 20 0 EIADRP CC[NH+]1CCC(CC[NH2+]Cc2cnc(-c3ccccc3F)s2)CC1 ZINC000449166525 1031504612 /nfs/dbraw/zinc/50/46/12/1031504612.db2.gz DKLDOOCWMJEXQK-UHFFFAOYSA-N 2 0 347.503 4.161 20 0 EIADRP CC(C)(C)CC(C)(C)[NH+]1CCC([NH2+]C[C@@H](CO)c2ccccc2)CC1 ZINC000449168472 1031508295 /nfs/dbraw/zinc/50/82/95/1031508295.db2.gz DMKXHPQTHWWSAL-IBGZPJMESA-N 2 0 346.559 4.031 20 0 EIADRP C[C@@H](Cc1ccccc1)[NH+]1CCC([NH2+][C@H]2CCCC(F)(F)C2)CC1 ZINC000449183954 1031522564 /nfs/dbraw/zinc/52/25/64/1031522564.db2.gz GPAAQCYIZGOOTA-LPHOPBHVSA-N 2 0 336.470 4.250 20 0 EIADRP COCC1CCC([NH2+]CC[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)CC1 ZINC000449216236 1031549534 /nfs/dbraw/zinc/54/95/34/1031549534.db2.gz QQJAFAMENNRVIF-YOLZPYMBSA-N 2 0 344.543 4.082 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+][C@H]1CCc2cc(F)c(F)c(F)c21 ZINC000449217892 1031551018 /nfs/dbraw/zinc/55/10/18/1031551018.db2.gz COBKHGBOAJWTIG-WFASDCNBSA-N 2 0 328.422 4.191 20 0 EIADRP CC1CC[NH+](Cc2ccccc2C[NH2+]Cc2cc3cccnc3o2)CC1 ZINC000449223674 1031554954 /nfs/dbraw/zinc/55/49/54/1031554954.db2.gz YDKKXSZYSIWTJT-UHFFFAOYSA-N 2 0 349.478 4.350 20 0 EIADRP Cc1[nH]c2ccccc2c1C1CC[NH+](CC[C@H]2CCC[N@H+]2C)CC1 ZINC000124972030 1031563771 /nfs/dbraw/zinc/56/37/71/1031563771.db2.gz LOCHTFBFMMFGRK-GOSISDBHSA-N 2 0 325.500 4.140 20 0 EIADRP C[C@@H](CCCc1cccnc1)[NH2+]Cc1cccc(C[NH+]2CCCC2)c1 ZINC000453084777 1031574124 /nfs/dbraw/zinc/57/41/24/1031574124.db2.gz WRODZUUAMQFCBG-IBGZPJMESA-N 2 0 337.511 4.178 20 0 EIADRP CN(Cc1ccccn1)[C@H]1CCC[N@H+](Cc2cccc3ccoc32)CC1 ZINC000449264332 1031602695 /nfs/dbraw/zinc/60/26/95/1031602695.db2.gz LNMOAVNTUHBVED-NRFANRHFSA-N 2 0 349.478 4.314 20 0 EIADRP C[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1ncc(-c2ccccc2)n1C ZINC000453231789 1031753539 /nfs/dbraw/zinc/75/35/39/1031753539.db2.gz UGDZRXOFIISVFW-GOSISDBHSA-N 2 0 340.515 4.004 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCCCC1(F)F)c1cccc(OCC[NH+](C)C)c1 ZINC000453251809 1031774573 /nfs/dbraw/zinc/77/45/73/1031774573.db2.gz NUSHDUTZOWCCQU-NVXWUHKLSA-N 2 0 340.458 4.103 20 0 EIADRP CC[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](Cc2ccccc2)C1)c1ccncc1 ZINC000453256132 1031780521 /nfs/dbraw/zinc/78/05/21/1031780521.db2.gz QQBARDLRMJOYEQ-RBBKRZOGSA-N 2 0 337.511 4.425 20 0 EIADRP C/C(=C\c1ccccc1OC(F)F)C[NH2+]C(C)(C)CCC[NH+](C)C ZINC000449525556 1031822770 /nfs/dbraw/zinc/82/27/70/1031822770.db2.gz BTPGBYDJRODJNS-FYWRMAATSA-N 2 0 340.458 4.401 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(NC2CC[NH+](C3CC3)CC2)cc1 ZINC000459344582 1031863120 /nfs/dbraw/zinc/86/31/20/1031863120.db2.gz NXZKXOZBZHKYNV-KRWDZBQOSA-N 2 0 327.516 4.100 20 0 EIADRP CCC[C@H]([NH2+]C[C@@H]1CCC[N@H+](C)C1)c1cccc(C(F)(F)F)c1 ZINC000531972395 1031910689 /nfs/dbraw/zinc/91/06/89/1031910689.db2.gz OBLIUZGOOVTXOM-YOEHRIQHSA-N 2 0 328.422 4.478 20 0 EIADRP CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2C)c1ccc(OC(F)(F)F)cc1 ZINC000453375540 1031923301 /nfs/dbraw/zinc/92/33/01/1031923301.db2.gz XWAYQRWTFORZLG-UCMJJCQDSA-N 2 0 342.405 4.251 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1cccc(OC(F)(F)F)c1 ZINC000453399170 1031934215 /nfs/dbraw/zinc/93/42/15/1031934215.db2.gz KZQLVTCRNSHBBP-CYBMUJFWSA-N 2 0 330.394 4.110 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@H](C)c1nc2ccccc2s1 ZINC000453417580 1031951149 /nfs/dbraw/zinc/95/11/49/1031951149.db2.gz XVEGFGIYBKHQFZ-GJZGRUSLSA-N 2 0 331.529 4.252 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccccc1OC(F)(F)F ZINC000453418665 1031952031 /nfs/dbraw/zinc/95/20/31/1031952031.db2.gz YPYJMNSLYIUWPI-CYBMUJFWSA-N 2 0 330.394 4.110 20 0 EIADRP C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000453393767 1031961343 /nfs/dbraw/zinc/96/13/43/1031961343.db2.gz GHAMIVATZACCES-VHDGCEQUSA-N 2 0 326.937 4.358 20 0 EIADRP Cc1nc(CN2CCC(C[NH2+]C[C@@H]3C(C)=CCC[C@H]3C)CC2)oc1C ZINC000134186314 1031995259 /nfs/dbraw/zinc/99/52/59/1031995259.db2.gz RDOAYLQZCNPGCZ-OXQOHEQNSA-N 2 0 345.531 4.085 20 0 EIADRP Cc1ccc(-c2nc(C[NH2+]CCCC[N@@H+](C)C3CC3)cs2)cc1 ZINC000453590204 1032037438 /nfs/dbraw/zinc/03/74/38/1032037438.db2.gz AZDLBQBNKMVQIM-UHFFFAOYSA-N 2 0 329.513 4.083 20 0 EIADRP CCO[C@H](C[NH2+][C@H](C)c1ccc(-n2ccnc2)cc1)c1ccccc1 ZINC000193431161 1032048236 /nfs/dbraw/zinc/04/82/36/1032048236.db2.gz SCQMKIKEOFCBHW-DYESRHJHSA-N 2 0 335.451 4.301 20 0 EIADRP C[C@@H]1C[C@@H](C)C[NH+](CCCC[NH2+]Cc2ncc(C(F)(F)F)s2)C1 ZINC000433336632 1034254442 /nfs/dbraw/zinc/25/44/42/1034254442.db2.gz WJMMDWJQBGJPDJ-CHWSQXEVSA-N 2 0 349.466 4.010 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)C1 ZINC000333272946 1034576565 /nfs/dbraw/zinc/57/65/65/1034576565.db2.gz KUXZVRLSFPOMMK-OWCLPIDISA-N 2 0 345.487 4.186 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H]2CCC[C@H](C)C2)cc1OC ZINC000513103972 1034583066 /nfs/dbraw/zinc/58/30/66/1034583066.db2.gz AVASVQSSPMNCFN-HKUYNNGSSA-N 2 0 348.531 4.084 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+]Cc2cccc3c2NCCC3)c1 ZINC000894205677 1034704336 /nfs/dbraw/zinc/70/43/36/1034704336.db2.gz ALIKIZIQCOYCIT-UHFFFAOYSA-N 2 0 337.511 4.175 20 0 EIADRP COCc1ccccc1/C=C(\C)C[NH2+]CCCC[N@@H+]1CCCC[C@H]1C ZINC000509921695 1034850289 /nfs/dbraw/zinc/85/02/89/1034850289.db2.gz BBCLHUXFOWCZPX-BQUCVHFLSA-N 2 0 344.543 4.481 20 0 EIADRP CC(C)c1ncc(CN2CCC[C@H](C[NH+]3CCCCCC3)C2)s1 ZINC000513406225 1034919897 /nfs/dbraw/zinc/91/98/97/1034919897.db2.gz OKUZVLNIOWZRMC-QGZVFWFLSA-N 2 0 335.561 4.355 20 0 EIADRP C[C@H]([NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccc(SCC(F)F)cc1 ZINC000414170132 1035055606 /nfs/dbraw/zinc/05/56/06/1035055606.db2.gz BRWLMMLYWXWXTK-GJZGRUSLSA-N 2 0 342.499 4.426 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+]C1CCC([NH+](C)C)CC1 ZINC000513702214 1035328870 /nfs/dbraw/zinc/32/88/70/1035328870.db2.gz GDGQLTDPUXAMAP-IGEOTXOUSA-N 2 0 328.422 4.099 20 0 EIADRP CC[NH+]1CCC([NH2+]C/C(C)=C/c2ccccc2C(F)(F)F)CC1 ZINC000501413788 1035438335 /nfs/dbraw/zinc/43/83/35/1035438335.db2.gz QLJMOQMUEKOIHP-WYMLVPIESA-N 2 0 326.406 4.183 20 0 EIADRP c1cncc([C@H]2CCC[C@H]([NH2+]C3CC[NH+](C4CCCCC4)CC3)C2)c1 ZINC000501454084 1035447900 /nfs/dbraw/zinc/44/79/00/1035447900.db2.gz UDFJQBGPAJORMW-RXVVDRJESA-N 2 0 341.543 4.495 20 0 EIADRP CC(C)CC[NH+]1CCC(C[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)CC1 ZINC000501476020 1035453259 /nfs/dbraw/zinc/45/32/59/1035453259.db2.gz UDEKJNIWDGWMHY-UNMCSNQZSA-N 2 0 343.559 4.456 20 0 EIADRP c1cc(CCC[N@H+](Cc2ccsc2)[C@@H]2CC23CC[NH2+]CC3)cs1 ZINC000420301648 1035502751 /nfs/dbraw/zinc/50/27/51/1035502751.db2.gz ARBIWFLXENFELI-GOSISDBHSA-N 2 0 346.565 4.387 20 0 EIADRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2nc(-c3ccccc3Cl)cs2)C1 ZINC000420303716 1035504406 /nfs/dbraw/zinc/50/44/06/1035504406.db2.gz DAJVVVUVSDZXSM-ZDUSSCGKSA-N 2 0 335.904 4.024 20 0 EIADRP Cc1nc([C@H](C)[N@@H+]2CCC[C@@H](CC[NH3+])C2)oc1-c1ccc(Cl)cc1 ZINC000420319111 1035514269 /nfs/dbraw/zinc/51/42/69/1035514269.db2.gz XDBOUXCEDPHRDM-GJZGRUSLSA-N 2 0 347.890 4.425 20 0 EIADRP CC[C@H](c1ccc(Cl)cc1)[NH+]1CCC([C@@H]2C[C@H]([NH3+])CCO2)CC1 ZINC000420394533 1035567438 /nfs/dbraw/zinc/56/74/38/1035567438.db2.gz RURRJJRNZRHTMW-QRVBRYPASA-N 2 0 336.907 4.009 20 0 EIADRP CC[C@H](c1ccc(Cl)cc1)[NH+]1CCC([C@H]2C[C@@H]([NH3+])CCO2)CC1 ZINC000420394527 1035567774 /nfs/dbraw/zinc/56/77/74/1035567774.db2.gz RURRJJRNZRHTMW-IPMKNSEASA-N 2 0 336.907 4.009 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]C[C@H]1CC[NH2+]C1 ZINC000420396463 1035568796 /nfs/dbraw/zinc/56/87/96/1035568796.db2.gz FHHSTOMFRSSHQP-YPMHNXCESA-N 2 0 335.904 4.032 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2cc(Br)cs2)CC1 ZINC000501770310 1035575755 /nfs/dbraw/zinc/57/57/55/1035575755.db2.gz OCVHBAJBHXETFJ-UHFFFAOYSA-N 2 0 345.350 4.064 20 0 EIADRP C[C@@H](C[N@@H+]1CCC[C@H]([NH+](C)C)CC1)c1ccc(C(F)(F)F)cc1 ZINC000501951056 1035752607 /nfs/dbraw/zinc/75/26/07/1035752607.db2.gz OBQYKHKYSRXORP-YOEHRIQHSA-N 2 0 328.422 4.225 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1ccccc1F ZINC000491062902 1035794911 /nfs/dbraw/zinc/79/49/11/1035794911.db2.gz BMKWVHJBGOHMBS-NRFANRHFSA-N 2 0 344.474 4.397 20 0 EIADRP Cc1cccc(C[NH2+][C@@H]2CCCC[C@H]3C[N@H+](Cc4ccccc4)C[C@H]32)n1 ZINC000571380350 1036034829 /nfs/dbraw/zinc/03/48/29/1036034829.db2.gz IPAXKICDKUKXEN-MDNUFGMLSA-N 2 0 349.522 4.170 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2cc(Br)ccc2Cl)CC1 ZINC000421365358 1036311195 /nfs/dbraw/zinc/31/11/95/1036311195.db2.gz ACWBTYXJSXVNGH-UHFFFAOYSA-N 2 0 345.712 4.065 20 0 EIADRP C[C@@H]([NH2+]CC1CC[NH+](Cc2ccccc2)CC1)c1ccncc1Cl ZINC000421824898 1036782092 /nfs/dbraw/zinc/78/20/92/1036782092.db2.gz KWJSWFBUNOFSSH-MRXNPFEDSA-N 2 0 343.902 4.298 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2cccc(COC)c2)CC1)CC(C)C ZINC001168413945 1036796206 /nfs/dbraw/zinc/79/62/06/1036796206.db2.gz MJOYWDOGAILFAA-UHFFFAOYSA-N 2 0 346.559 4.413 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+]Cc2cc3ccc(F)cc3[nH]2)C1 ZINC000486689703 1036816617 /nfs/dbraw/zinc/81/66/17/1036816617.db2.gz PGAPNTYSZYXKNU-IYBDPMFKSA-N 2 0 331.479 4.155 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H]2CCc3ccc(OC(F)(F)F)cc32)CC1 ZINC000421891963 1036838298 /nfs/dbraw/zinc/83/82/98/1036838298.db2.gz ZACJBYLHUFHZSJ-MQBCKMQZSA-N 2 0 342.405 4.035 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC000486859848 1036872801 /nfs/dbraw/zinc/87/28/01/1036872801.db2.gz QBXPWKDDYOIRTI-TZIWHRDSSA-N 2 0 346.478 4.392 20 0 EIADRP CCCC[N@H+](CCCN1CC[NH+](C(C)C)CC1)[C@@H](C)c1ccc(C)o1 ZINC000669688942 1036891781 /nfs/dbraw/zinc/89/17/81/1036891781.db2.gz GGASWIXUOBEAFH-FQEVSTJZSA-N 2 0 349.563 4.167 20 0 EIADRP Clc1csc(C[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c1 ZINC000486966228 1036927069 /nfs/dbraw/zinc/92/70/69/1036927069.db2.gz FKBLOLCCAARRIP-UHFFFAOYSA-N 2 0 340.945 4.465 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+][C@@H]3[C@@H]4Cc5cc(F)ccc5[C@@H]43)CC2)C1 ZINC000668743532 1037006550 /nfs/dbraw/zinc/00/65/50/1037006550.db2.gz IOBRILCZTPAQAX-DNRFVNEXSA-N 2 0 342.502 4.097 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CC1=CC[N@H+](C)CC1 ZINC000271902762 1037047514 /nfs/dbraw/zinc/04/75/14/1037047514.db2.gz VXFQGOVNUZZHKS-ZDUSSCGKSA-N 2 0 345.487 4.170 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2coc(-c3ccc(F)cc3)n2)CC1 ZINC000590786286 1037167201 /nfs/dbraw/zinc/16/72/01/1037167201.db2.gz NBSYGRNBVRNTDL-UHFFFAOYSA-N 2 0 345.462 4.033 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](CCCOc2cccc(Cl)c2)CC1 ZINC000590786378 1037167736 /nfs/dbraw/zinc/16/77/36/1037167736.db2.gz UOMSATUSYNSQJA-UHFFFAOYSA-N 2 0 338.923 4.161 20 0 EIADRP Cc1ccc(C)c(OCCC[NH+]2CCC(C[N@@H+](C)C(C)C)CC2)c1 ZINC000590818876 1037185399 /nfs/dbraw/zinc/18/53/99/1037185399.db2.gz FERRTRJLZVWAKG-UHFFFAOYSA-N 2 0 332.532 4.125 20 0 EIADRP Cc1ccc(C[N@@H+]2CC[C@]3(CC[NH+](Cc4ccccc4)C3)C2)s1 ZINC000573018197 1037230380 /nfs/dbraw/zinc/23/03/80/1037230380.db2.gz DJVINNMBEMOSKJ-FQEVSTJZSA-N 2 0 326.509 4.155 20 0 EIADRP Clc1cccc(C2CC[NH+](C3CC[NH+](CC4CC4)CC3)CC2)c1 ZINC001168374127 1037342554 /nfs/dbraw/zinc/34/25/54/1037342554.db2.gz WNQOPSQRSBRENI-UHFFFAOYSA-N 2 0 332.919 4.394 20 0 EIADRP Cc1csc([C@H](C)C[NH2+][C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000273470315 1037474109 /nfs/dbraw/zinc/47/41/09/1037474109.db2.gz RXDDCUHYKATPNV-JTDSTZFVSA-N 2 0 343.540 4.055 20 0 EIADRP Cc1ccccc1CC(C)(C)[NH2+]Cc1ccc(OCC[NH+](C)C)cc1 ZINC000591722245 1037544449 /nfs/dbraw/zinc/54/44/49/1037544449.db2.gz URULUQCYXSVONS-UHFFFAOYSA-N 2 0 340.511 4.046 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1nc(C(C)C)n2ccccc12 ZINC000573614593 1037602361 /nfs/dbraw/zinc/60/23/61/1037602361.db2.gz BESVVIYZBXWQNQ-KRWDZBQOSA-N 2 0 330.520 4.058 20 0 EIADRP CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2cccc(C[NH+]3CCCC3)c2)CS1 ZINC000488467719 1037616549 /nfs/dbraw/zinc/61/65/49/1037616549.db2.gz WYKVWFNQDWJZQI-OALUTQOASA-N 2 0 332.557 4.292 20 0 EIADRP Fc1ccc2c(c1)CC[C@@H]([NH2+]C1CC[NH+](C[C@@H]3CC=CCC3)CC1)C2 ZINC001168420168 1037719012 /nfs/dbraw/zinc/71/90/12/1037719012.db2.gz JTBWVIILSAUBRS-VGOFRKELSA-N 2 0 342.502 4.093 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](C)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000422700789 1037802130 /nfs/dbraw/zinc/80/21/30/1037802130.db2.gz ASIXHMYZQOYDRY-CVEARBPZSA-N 2 0 330.447 4.183 20 0 EIADRP COC[C@@H](CCC[NH3+])[NH2+][C@H](C)c1ccc(Oc2ccccc2)c(F)c1 ZINC000422710324 1037804009 /nfs/dbraw/zinc/80/40/09/1037804009.db2.gz LPRXBNVYFOUVQL-NVXWUHKLSA-N 2 0 346.446 4.023 20 0 EIADRP [NH3+][C@@H]1C[C@@H](NCc2ccccc2C[NH+]2CCCCCC2)c2ccccc21 ZINC000422711480 1037804316 /nfs/dbraw/zinc/80/43/16/1037804316.db2.gz NESNNARUBIRPFE-DHIUTWEWSA-N 2 0 349.522 4.297 20 0 EIADRP [NH3+][C@H]1C[C@H](NCc2ccccc2C[NH+]2CCCCCC2)c2ccccc21 ZINC000422711485 1037804598 /nfs/dbraw/zinc/80/45/98/1037804598.db2.gz NESNNARUBIRPFE-GOTSBHOMSA-N 2 0 349.522 4.297 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]C1CCC([NH3+])CC1 ZINC000422733980 1037808263 /nfs/dbraw/zinc/80/82/63/1037808263.db2.gz BUTPPQZKGHXLLJ-SOISORPOSA-N 2 0 333.476 4.178 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)CC(C)(C)c1ccccc1 ZINC000422716075 1037813645 /nfs/dbraw/zinc/81/36/45/1037813645.db2.gz MWNOALAHMZTHCX-CVEARBPZSA-N 2 0 325.500 4.256 20 0 EIADRP COc1cc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])ccc1OCc1ccccc1 ZINC000422723126 1037816443 /nfs/dbraw/zinc/81/64/43/1037816443.db2.gz QJBJPJWUIKPLMS-IRXDYDNUSA-N 2 0 342.483 4.052 20 0 EIADRP Cc1[nH]c2c(cc(C)cc2C[NH2+][C@H](C)c2ccc(C[NH3+])nc2C)c1C ZINC000422741508 1037822313 /nfs/dbraw/zinc/82/23/13/1037822313.db2.gz OQJGMKSMQMTUIC-OAHLLOKOSA-N 2 0 336.483 4.106 20 0 EIADRP c1cc(-c2ccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)cc2)ccn1 ZINC000422774373 1037830474 /nfs/dbraw/zinc/83/04/74/1037830474.db2.gz WTDWXIWTGZPSAA-BHIFYINESA-N 2 0 335.495 4.149 20 0 EIADRP C[C@H](CC[NH2+][C@@H]1CC[NH2+]CC[C@H]1C)c1cccc(C(F)(F)F)c1 ZINC000422806062 1037837438 /nfs/dbraw/zinc/83/74/38/1037837438.db2.gz HRUKHBJAHFHFCI-CKEIUWERSA-N 2 0 328.422 4.177 20 0 EIADRP c1cncc(-c2ccc(C[NH2+][C@@H]3CCC[C@H]3[C@@H]3CCCC[NH2+]3)cc2)c1 ZINC000422804315 1037837885 /nfs/dbraw/zinc/83/78/85/1037837885.db2.gz HJFFSRGAKQNWDR-FDFHNCONSA-N 2 0 335.495 4.149 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCC[NH2+]C2)cc1 ZINC000422791600 1037839640 /nfs/dbraw/zinc/83/96/40/1037839640.db2.gz YQYCBSLFYNDEPE-SQGPQFPESA-N 2 0 338.495 4.401 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)c1ccc(-c2ccncc2)cc1 ZINC000422814974 1037839897 /nfs/dbraw/zinc/83/98/97/1037839897.db2.gz WSFMKLDNQPTGHX-CVEARBPZSA-N 2 0 346.478 4.323 20 0 EIADRP Cc1ccc([C@H]([NH2+][C@@H]2C[C@@]3(CC[NH2+]C3)Oc3ccccc32)C2CC2)cc1 ZINC000422813362 1037840530 /nfs/dbraw/zinc/84/05/30/1037840530.db2.gz RQWYTOFKZCESFC-AKIFATBCSA-N 2 0 348.490 4.292 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+]CC(C)(C)c1cccc(Cl)c1 ZINC000422822162 1037841892 /nfs/dbraw/zinc/84/18/92/1037841892.db2.gz JHUFPURRIJTGDW-CYBMUJFWSA-N 2 0 331.891 4.131 20 0 EIADRP FC(F)(F)[C@@H]1CCC[C@H](C[NH2+][C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)C1 ZINC000422853090 1037846218 /nfs/dbraw/zinc/84/62/18/1037846218.db2.gz RVZUYMBYJUVYRR-DMRKSPOLSA-N 2 0 332.454 4.256 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCCc2nc(-c3ccccc3)sc21)[C@@H]1CCC[NH2+]C1 ZINC000422866003 1037848259 /nfs/dbraw/zinc/84/82/59/1037848259.db2.gz ZUHMHKNDQUGLHM-USXIJHARSA-N 2 0 341.524 4.165 20 0 EIADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1cccc(COCc2ccccc2)c1 ZINC000422866501 1037848369 /nfs/dbraw/zinc/84/83/69/1037848369.db2.gz QKRXCABNMVTHJB-FGZHOGPDSA-N 2 0 338.495 4.011 20 0 EIADRP [NH3+]C[C@@H]1CCCC[C@H]1[NH2+]Cc1cccc(COCc2ccccc2)c1 ZINC000422866500 1037849024 /nfs/dbraw/zinc/84/90/24/1037849024.db2.gz QKRXCABNMVTHJB-FCHUYYIVSA-N 2 0 338.495 4.011 20 0 EIADRP Fc1cccc2c1SCC[C@@H]2[NH2+][C@@H]1CCC[C@H]1[C@H]1CCCC[NH2+]1 ZINC000422844721 1037850667 /nfs/dbraw/zinc/85/06/67/1037850667.db2.gz MWFIJMMHMDEMJQ-LIRZEXBASA-N 2 0 334.504 4.263 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCCOc2c(Cl)c(Cl)ccc21 ZINC000422905955 1037862849 /nfs/dbraw/zinc/86/28/49/1037862849.db2.gz SYFAWINIUWXXBZ-BXUZGUMPSA-N 2 0 331.287 4.314 20 0 EIADRP CCC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cccc(C(F)(F)F)c1 ZINC000422900695 1037863463 /nfs/dbraw/zinc/86/34/63/1037863463.db2.gz ARFXTPYSKMBYRG-WFVVYAPDSA-N 2 0 326.406 4.419 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+][C@H](C)CCCC[NH3+] ZINC000422914651 1037868581 /nfs/dbraw/zinc/86/85/81/1037868581.db2.gz VIFLAKUHTLFSES-OLZOCXBDSA-N 2 0 335.492 4.426 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+]CCc1cccc(Cl)c1Cl ZINC000422935770 1037876750 /nfs/dbraw/zinc/87/67/50/1037876750.db2.gz DPCLOVKAZWCKJX-NSHDSACASA-N 2 0 338.282 4.049 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@H](c1ccccc1Cl)c1cc(F)ccc1F ZINC000422917574 1037877878 /nfs/dbraw/zinc/87/78/78/1037877878.db2.gz GKQXRERQKZUEMV-KPZWWZAWSA-N 2 0 338.829 4.425 20 0 EIADRP [NH3+]C[C@@H]1CCCC[C@@H]1[NH2+]CCc1csc(-c2ccc(Cl)cc2)n1 ZINC000423012774 1037901482 /nfs/dbraw/zinc/90/14/82/1037901482.db2.gz LJDMIZUHWJYEFN-YOEHRIQHSA-N 2 0 349.931 4.113 20 0 EIADRP C[C@H]([NH2+][C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1)C1C[NH2+]C1 ZINC000423019392 1037904081 /nfs/dbraw/zinc/90/40/81/1037904081.db2.gz VLNIMHKCKAHBPZ-BJOHPYRUSA-N 2 0 332.797 4.007 20 0 EIADRP CC[N@H+](Cc1ccc(-c2ccccc2OC)cc1)[C@@H]1CCC[NH2+]CC1 ZINC000414712456 1037911706 /nfs/dbraw/zinc/91/17/06/1037911706.db2.gz IXUMQCMFGMCKFO-HXUWFJFHSA-N 2 0 338.495 4.326 20 0 EIADRP C[C@@H](CCCC[NH3+])[NH2+][C@H](c1cc(F)cc(Br)c1)C1CC1 ZINC000423056248 1037924460 /nfs/dbraw/zinc/92/44/60/1037924460.db2.gz XEDYSUKTZDRXLB-ZBEGNZNMSA-N 2 0 343.284 4.146 20 0 EIADRP c1ccc(N2CCCCC2)c(C[NH2+][C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000423040661 1037921815 /nfs/dbraw/zinc/92/18/15/1037921815.db2.gz HTJHYFARKXGJJQ-QHAWAJNXSA-N 2 0 341.543 4.077 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCC[NH2+]1 ZINC000423063798 1037928148 /nfs/dbraw/zinc/92/81/48/1037928148.db2.gz XGUHLNUAGUTHKL-YESZJQIVSA-N 2 0 326.406 4.024 20 0 EIADRP CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])c1cc(F)cc(Br)c1 ZINC000423059824 1037930225 /nfs/dbraw/zinc/93/02/25/1037930225.db2.gz GUHMCVQZXKDHRQ-NHYWBVRUSA-N 2 0 331.273 4.146 20 0 EIADRP FC(F)(F)[C@H](C[NH2+][C@@H]1CCC[C@H]1[C@@H]1CCCC[NH2+]1)c1ccccc1 ZINC000423067192 1037930492 /nfs/dbraw/zinc/93/04/92/1037930492.db2.gz YVEWCODUYFUTFN-XWTMOSNGSA-N 2 0 340.433 4.233 20 0 EIADRP c1cncc(-c2cccc(C[NH2+][C@@H]3CCC[C@@H]3[C@@H]3CCCC[NH2+]3)c2)c1 ZINC000423052950 1037936384 /nfs/dbraw/zinc/93/63/84/1037936384.db2.gz RNPRFTVWFAFHQR-BHIFYINESA-N 2 0 335.495 4.149 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@H](C)[NH2+][C@H](C)C1(c2ccccc2)CCCC1 ZINC000423050779 1037936841 /nfs/dbraw/zinc/93/68/41/1037936841.db2.gz MAUOOPCMMYSTRD-FUHWJXTLSA-N 2 0 337.511 4.400 20 0 EIADRP c1cncc(-c2cccc(C[NH2+][C@@H]3CCC[C@@H]3[C@H]3CCCC[NH2+]3)c2)c1 ZINC000423052952 1037938728 /nfs/dbraw/zinc/93/87/28/1037938728.db2.gz RNPRFTVWFAFHQR-YPAWHYETSA-N 2 0 335.495 4.149 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H](C)c1cc2ccccc2s1 ZINC000423053864 1037940106 /nfs/dbraw/zinc/94/01/06/1037940106.db2.gz BDXMTFATCAZZOL-TZMCWYRMSA-N 2 0 325.481 4.475 20 0 EIADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000423096957 1037954581 /nfs/dbraw/zinc/95/45/81/1037954581.db2.gz QDTZSZYOXGDCBO-MUIFIZLQSA-N 2 0 326.406 4.059 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000423097862 1037956924 /nfs/dbraw/zinc/95/69/24/1037956924.db2.gz BOOQVNWPYWWHFK-KBRIMQKVSA-N 2 0 328.422 4.449 20 0 EIADRP [NH3+]C1CCC([NH2+][C@@H](c2cccc(C(F)(F)F)c2)C2CCC2)CC1 ZINC000423098486 1037957338 /nfs/dbraw/zinc/95/73/38/1037957338.db2.gz CWQVIOGHRREBDK-OFLPRAFFSA-N 2 0 326.406 4.406 20 0 EIADRP Fc1ccc(C2CC([NH2+][C@@H]3CCC[C@H]3[C@@H]3CCC[NH2+]3)C2)cc1Cl ZINC000423099245 1037957521 /nfs/dbraw/zinc/95/75/21/1037957521.db2.gz LUFAADCATFSCJY-KKYACZQASA-N 2 0 336.882 4.235 20 0 EIADRP [NH3+]C[C@H]1CCCC[C@H]1[NH2+]Cc1cnc(-c2ccc(Cl)cc2)s1 ZINC000423100579 1037958042 /nfs/dbraw/zinc/95/80/42/1037958042.db2.gz HCVXLRKMZGHJND-CZUORRHYSA-N 2 0 335.904 4.071 20 0 EIADRP C[C@H]([NH3+])[C@H](Cc1ccccc1)[NH2+][C@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000423098583 1037959131 /nfs/dbraw/zinc/95/91/31/1037959131.db2.gz SIXHXYLSYSZIGR-MTOHEIAKSA-N 2 0 326.459 4.010 20 0 EIADRP COc1ccc([C@@H](Cc2ccccc2)[NH2+]C2CCC(C[NH3+])CC2)cc1 ZINC000423120162 1037969665 /nfs/dbraw/zinc/96/96/65/1037969665.db2.gz FTTDFRYOWYCBAQ-ZOGYUUGASA-N 2 0 338.495 4.086 20 0 EIADRP Cc1nc(C[NH3+])ccc1[C@@H](C)[NH2+][C@H]1CCCc2sc(Cl)cc21 ZINC000423126392 1037970169 /nfs/dbraw/zinc/97/01/69/1037970169.db2.gz ISIBCJAIYCFURJ-ABAIWWIYSA-N 2 0 335.904 4.292 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1C[C@]3(CC[NH2+]C3)Oc3ccccc31)CCC2 ZINC000423127846 1037976234 /nfs/dbraw/zinc/97/62/34/1037976234.db2.gz PSHKXABLJGFXBU-FUDKSRODSA-N 2 0 348.490 4.218 20 0 EIADRP C[C@H]([NH2+][C@H](c1cccc(C(F)(F)F)c1)C1CCC1)[C@H]1CC[NH2+]C1 ZINC000423112409 1037988306 /nfs/dbraw/zinc/98/83/06/1037988306.db2.gz XNDUENAGSNDHIM-NUTKFTJISA-N 2 0 326.406 4.134 20 0 EIADRP Clc1ccc([C@H]2C[C@H]([NH2+]C3C[C@H]4CC[C@@H](C3)[NH2+]4)C2)cc1Cl ZINC000423113540 1037990527 /nfs/dbraw/zinc/99/05/27/1037990527.db2.gz YLTDJIZNDUTZGX-KWIKQGISSA-N 2 0 325.283 4.112 20 0 EIADRP CC[N@H+](Cc1ccc(Oc2cccnc2)c(C)c1)[C@@H]1CCC[NH2+]CC1 ZINC000414720189 1038002076 /nfs/dbraw/zinc/00/20/76/1038002076.db2.gz XLLXKIFZYSJGIF-LJQANCHMSA-N 2 0 339.483 4.146 20 0 EIADRP C[C@H]([NH2+]CC1CCC(F)(F)CC1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000503906430 1038007576 /nfs/dbraw/zinc/00/75/76/1038007576.db2.gz ZKOOACSSMHPGAJ-LPHOPBHVSA-N 2 0 336.470 4.312 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+]Cc2ccc(-c3ccccc3Cl)o2)CC1 ZINC000503929466 1038019914 /nfs/dbraw/zinc/01/99/14/1038019914.db2.gz QXAZPJQUUPQYDX-UHFFFAOYSA-N 2 0 332.875 4.422 20 0 EIADRP C[C@H]1CCCC[C@H]1[NH+]1CCC([NH2+][C@@H]2CCCC[C@H]2OC(F)F)CC1 ZINC000503950142 1038042254 /nfs/dbraw/zinc/04/22/54/1038042254.db2.gz BIMNTVCRROYLHN-DZOHQFGASA-N 2 0 344.490 4.170 20 0 EIADRP C[C@H]([NH2+]C[C@H]1CCC[NH2+]C1)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000423203932 1038053850 /nfs/dbraw/zinc/05/38/50/1038053850.db2.gz CXTUSQOTRUBZMR-WMZOPIPTSA-N 2 0 342.458 4.055 20 0 EIADRP C[C@H]([NH2+][C@@H](C)[C@H]1CCC[NH2+]C1)c1ccc(SCC(F)(F)F)cc1 ZINC000423216235 1038060490 /nfs/dbraw/zinc/06/04/90/1038060490.db2.gz OENIEOHDTGCXSM-YDHLFZDLSA-N 2 0 346.462 4.380 20 0 EIADRP C[C@H]([NH2+]C1CCC([NH3+])CC1)c1ccc(SCC(F)(F)F)cc1 ZINC000423220487 1038066349 /nfs/dbraw/zinc/06/63/49/1038066349.db2.gz VHOIPKPBMHLPIC-XGNXJENSSA-N 2 0 332.435 4.262 20 0 EIADRP Cc1nc(Cc2ccccc2)sc1[C@H](C)[NH2+][C@@H](C)[C@H]1CCC[NH2+]C1 ZINC000423221162 1038067671 /nfs/dbraw/zinc/06/76/71/1038067671.db2.gz WLPIYVQSFSRHBD-MPGHIAIKSA-N 2 0 343.540 4.081 20 0 EIADRP [NH3+]C1CCC([NH2+][C@H]2CCCCc3cc(Br)ccc32)CC1 ZINC000423242086 1038078214 /nfs/dbraw/zinc/07/82/14/1038078214.db2.gz YIVZXPWUIBGCAZ-DQPZFDDXSA-N 2 0 337.305 4.076 20 0 EIADRP Cc1nc(-c2ccccc2F)sc1[C@H](C)[NH2+]CC[C@@H]1CCC[NH2+]C1 ZINC000423257120 1038087784 /nfs/dbraw/zinc/08/77/84/1038087784.db2.gz HNQFKYWJORQMMD-ZFWWWQNUSA-N 2 0 347.503 4.298 20 0 EIADRP CCOc1ccc([C@H](C)[NH2+]Cc2ccc([C@@H](C)[NH3+])cc2)cc1OCC ZINC000423291937 1038095005 /nfs/dbraw/zinc/09/50/05/1038095005.db2.gz KQCPOTCHIVOTSD-CVEARBPZSA-N 2 0 342.483 4.355 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+][C@H](C)c2ccc(F)cc2OC(F)F)cc1 ZINC000423296560 1038124349 /nfs/dbraw/zinc/12/43/49/1038124349.db2.gz ZKDLGKANRXVTBL-VXGBXAGGSA-N 2 0 338.373 4.298 20 0 EIADRP COc1ccccc1-c1ccc([C@@H](C)[NH2+]CC2(C)CC[NH2+]CC2)cc1 ZINC000423326396 1038141942 /nfs/dbraw/zinc/14/19/42/1038141942.db2.gz KLNSVLWJPDPFRR-QGZVFWFLSA-N 2 0 338.495 4.403 20 0 EIADRP Cc1ccsc1[C@@H]([NH2+]CCCC[NH3+])c1ccc(Cl)cc1F ZINC000423327434 1038142687 /nfs/dbraw/zinc/14/26/87/1038142687.db2.gz NDVAKCBMLABWTO-HNNXBMFYSA-N 2 0 326.868 4.267 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cccc(OC(F)(F)F)c1 ZINC000423386631 1038193430 /nfs/dbraw/zinc/19/34/30/1038193430.db2.gz MCPFWOCNZVWMGH-GFCCVEGCSA-N 2 0 336.357 4.039 20 0 EIADRP C[C@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccc(Br)c(F)c1 ZINC000423386070 1038197232 /nfs/dbraw/zinc/19/72/32/1038197232.db2.gz LXAYHOYJGJFISL-NSHDSACASA-N 2 0 349.247 4.042 20 0 EIADRP CC[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1ccccc1OC(F)F ZINC000423396817 1038203739 /nfs/dbraw/zinc/20/37/39/1038203739.db2.gz SRMLAFKKTDTAQF-QGZVFWFLSA-N 2 0 332.394 4.132 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]([NH2+][C@H](c2ccccc2)c2ccc(OC(F)F)cc2)C1 ZINC000423402126 1038216154 /nfs/dbraw/zinc/21/61/54/1038216154.db2.gz WFYHXLDGNIMRJI-ZIFCJYIRSA-N 2 0 346.421 4.237 20 0 EIADRP C[C@@H]1C[NH2+]CC[C@H]1[NH2+]C1CCC(c2cccc(C(F)(F)F)c2)CC1 ZINC000423406515 1038216322 /nfs/dbraw/zinc/21/63/22/1038216322.db2.gz UTIVOXCIPPJCER-YHDCKOJYSA-N 2 0 340.433 4.319 20 0 EIADRP Cc1nc(C(C)(C)C)sc1[C@@H](C)[NH2+]Cc1ccc2c(c1)C[NH2+]C2 ZINC000423407285 1038216975 /nfs/dbraw/zinc/21/69/75/1038216975.db2.gz ZQCSGTRXWYMMCC-GFCCVEGCSA-N 2 0 329.513 4.203 20 0 EIADRP C[C@@H](CCC[NH3+])[NH2+][C@H](c1ccc(F)cc1)c1cnc2ccccc2c1 ZINC000423443827 1038226129 /nfs/dbraw/zinc/22/61/29/1038226129.db2.gz AQMSDGMOGFMQEK-YCRPNKLZSA-N 2 0 337.442 4.180 20 0 EIADRP Cc1ccccc1COc1ccc([C@H](C)[NH2+][C@@H](C)CCC[NH3+])cc1 ZINC000423450521 1038231435 /nfs/dbraw/zinc/23/14/35/1038231435.db2.gz HJSSKROCIVEUQC-ROUUACIJSA-N 2 0 326.484 4.352 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000423431533 1038233437 /nfs/dbraw/zinc/23/34/37/1038233437.db2.gz LSKFUSPDEHOMGQ-DNVCBOLYSA-N 2 0 331.891 4.126 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000423431907 1038233560 /nfs/dbraw/zinc/23/35/60/1038233560.db2.gz MBVILGUOVOMXGI-FRFSOERESA-N 2 0 328.422 4.449 20 0 EIADRP C[C@H](CCCC[NH3+])[NH2+][C@@H](Cc1cccnc1)c1cccc(Cl)c1 ZINC000423431532 1038234288 /nfs/dbraw/zinc/23/42/88/1038234288.db2.gz LSKFUSPDEHOMGQ-BEFAXECRSA-N 2 0 331.891 4.126 20 0 EIADRP C[C@H](CCC[NH3+])[NH2+][C@@H](c1ccc(Br)cc1Cl)C1CC1 ZINC000423455318 1038237676 /nfs/dbraw/zinc/23/76/76/1038237676.db2.gz MKKKAGIQWZEMPD-MEBBXXQBSA-N 2 0 345.712 4.271 20 0 EIADRP C[C@H]([NH2+]C[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccc(F)c(F)c1 ZINC000423475049 1038247330 /nfs/dbraw/zinc/24/73/30/1038247330.db2.gz PTKOGYYQETVHGX-QANKJYHBSA-N 2 0 348.412 4.148 20 0 EIADRP COc1cccc(C[C@H]([NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)c2ccccc2)c1 ZINC000423478700 1038249915 /nfs/dbraw/zinc/24/99/15/1038249915.db2.gz UKRLFEJDIIFMAV-DWLFOUALSA-N 2 0 338.495 4.086 20 0 EIADRP CSC[C@H]([NH2+]C[C@H]1CCC[C@@H]([NH3+])C1)c1ccc(C(F)(F)F)cc1 ZINC000423479220 1038253177 /nfs/dbraw/zinc/25/31/77/1038253177.db2.gz USAMWMDXUYILCJ-MAZHCROVSA-N 2 0 346.462 4.217 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)C1 ZINC000423499688 1038254632 /nfs/dbraw/zinc/25/46/32/1038254632.db2.gz ICMMAGCJAGHOHU-ZFVVBOAOSA-N 2 0 326.406 4.059 20 0 EIADRP C[C@@H]([NH2+][C@H](CCC[NH3+])c1ccccc1)c1ccc(OC(F)F)cc1 ZINC000423501150 1038256936 /nfs/dbraw/zinc/25/69/36/1038256936.db2.gz LALOSUUYSPLCAC-RDTXWAMCSA-N 2 0 334.410 4.419 20 0 EIADRP FC(F)(F)c1cccc([C@H]([NH2+]CCC[C@@H]2CCC[NH2+]2)C2CC2)c1 ZINC000423487684 1038261708 /nfs/dbraw/zinc/26/17/08/1038261708.db2.gz UOCNFQPJYNJUNY-DLBZAZTESA-N 2 0 326.406 4.278 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+][C@H]1CC[C@@H](C[NH3+])C1 ZINC000423489311 1038262120 /nfs/dbraw/zinc/26/21/20/1038262120.db2.gz FXFZOMLJXFDSNT-LXZKKBNFSA-N 2 0 329.513 4.205 20 0 EIADRP C[C@H]([NH2+][C@H]1CC[C@@H](C[NH3+])C1)c1ccc2ccccc2c1OC(F)F ZINC000423487189 1038262421 /nfs/dbraw/zinc/26/24/21/1038262421.db2.gz CFFVPISSUASICE-GUTXKFCHSA-N 2 0 334.410 4.219 20 0 EIADRP Cc1cccnc1[C@@H]1CCC[C@H]([NH2+][C@@H](CCC[NH3+])c2ccccc2)C1 ZINC000423512560 1038269950 /nfs/dbraw/zinc/26/99/50/1038269950.db2.gz OOVKAFJRJGMAPJ-HKBOAZHASA-N 2 0 337.511 4.486 20 0 EIADRP COc1cc(C)c([C@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cc1OC ZINC000423516991 1038270912 /nfs/dbraw/zinc/27/09/12/1038270912.db2.gz YJEAOLWALIJDFK-LPHOPBHVSA-N 2 0 342.483 4.143 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+]C2CCC(c3cccc(C(F)(F)F)c3)CC2)C1 ZINC000423513814 1038272241 /nfs/dbraw/zinc/27/22/41/1038272241.db2.gz ROHWGCXWTPVDIY-QQOVODFUSA-N 2 0 340.433 4.449 20 0 EIADRP [NH3+]C[C@@H]1CC[C@H]([NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000423519161 1038273658 /nfs/dbraw/zinc/27/36/58/1038273658.db2.gz VGUOCQWJXUNJPP-QCPWZWHMSA-N 2 0 326.406 4.059 20 0 EIADRP C[C@H](CCc1cccc(C(F)(F)F)c1)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423538345 1038286562 /nfs/dbraw/zinc/28/65/62/1038286562.db2.gz GDYYBKPREZUORG-NOVWEMISSA-N 2 0 340.433 4.004 20 0 EIADRP FC(F)(F)c1ccc([C@@H]2CC[C@H]([NH2+]CCC3=CC[NH2+]CC3)C2)cc1 ZINC000423535386 1038286789 /nfs/dbraw/zinc/28/67/89/1038286789.db2.gz CWMPWANFXPQPPL-AEFFLSMTSA-N 2 0 338.417 4.241 20 0 EIADRP CC(C)c1ccc2c(c1)[C@H]([NH2+][C@@H]1CC[C@@H]3C[NH2+]C[C@@H]3C1)CCCO2 ZINC000423542156 1038289715 /nfs/dbraw/zinc/28/97/15/1038289715.db2.gz LUUKQGMZALNVLE-AJYBTWMASA-N 2 0 328.500 4.001 20 0 EIADRP C[C@H](CC(C)(C)c1c[nH]c2ccccc21)[NH2+][C@@H]1CC[C@H]2C[NH2+]C[C@H]2C1 ZINC000423544575 1038290183 /nfs/dbraw/zinc/29/01/83/1038290183.db2.gz OLPDIWZYMLHIRJ-XMTFNYHQSA-N 2 0 339.527 4.202 20 0 EIADRP FC(F)(F)c1cccc([C@H]([NH2+][C@@H]2CC[C@@H]3C[NH2+]C[C@H]3C2)C2CC2)c1 ZINC000423545917 1038290323 /nfs/dbraw/zinc/29/03/23/1038290323.db2.gz PONJKLXSFNWGSM-JOCBIADPSA-N 2 0 338.417 4.134 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CCC[C@@H](c2nc3c(s2)CCCC3)C1 ZINC000490070172 1038330174 /nfs/dbraw/zinc/33/01/74/1038330174.db2.gz WRCXGXISGHLADO-IAGOWNOFSA-N 2 0 347.572 4.076 20 0 EIADRP C[NH+](C)CCCC[NH2+][C@H](c1ccc(F)cc1)c1ccccc1Cl ZINC000490143895 1038356055 /nfs/dbraw/zinc/35/60/55/1038356055.db2.gz NONLBDXOAMZASC-LJQANCHMSA-N 2 0 334.866 4.500 20 0 EIADRP C[C@@H](c1ccccc1Br)[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000490296176 1038448669 /nfs/dbraw/zinc/44/86/69/1038448669.db2.gz DAIDTGWHCNMIOH-QWHCGFSZSA-N 2 0 334.261 4.113 20 0 EIADRP C[N@H+](Cc1ccccc1)[C@@H]1CCN(c2cc[nH+]c3cc(F)ccc32)C1 ZINC000608092838 1038603316 /nfs/dbraw/zinc/60/33/16/1038603316.db2.gz PUQXSJKEBGMKHF-GOSISDBHSA-N 2 0 335.426 4.085 20 0 EIADRP CC[N@H+](CCC1CC[NH+]([C@H](C)c2ccc(F)nc2)CC1)CC1CC1 ZINC001168423921 1038610614 /nfs/dbraw/zinc/61/06/14/1038610614.db2.gz RWADSDUYNXPVRS-MRXNPFEDSA-N 2 0 333.495 4.116 20 0 EIADRP COc1cccc2c1CC[C@@H](CCC[NH2+]C1CCC([NH+](C)C)CC1)C2 ZINC001168311966 1038784168 /nfs/dbraw/zinc/78/41/68/1038784168.db2.gz GNPOPQIRTSAKRF-QHGAOEGBSA-N 2 0 344.543 4.043 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@H]2CCC[N@H+](CC(C)C)C2)cc1Cl ZINC000539052650 1038800184 /nfs/dbraw/zinc/80/01/84/1038800184.db2.gz NXEMFGUBIGTKKJ-JKSUJKDBSA-N 2 0 338.923 4.367 20 0 EIADRP CSC1(C[NH2+][C@H](C)CCc2ccc(Cl)s2)CC[NH+](C)CC1 ZINC000554997731 1038821325 /nfs/dbraw/zinc/82/13/25/1038821325.db2.gz BKFAHTQQPDSOTQ-CYBMUJFWSA-N 2 0 346.993 4.140 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2nc3ccccc3o2)CC1)CC(C)C ZINC000539099133 1038836874 /nfs/dbraw/zinc/83/68/74/1038836874.db2.gz XFESXMMRPJQVSO-UHFFFAOYSA-N 2 0 343.515 4.408 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCCC[C@H]1[NH3+])[C@@H](C)Oc1ccc(Cl)cc1Cl ZINC000424369194 1038837499 /nfs/dbraw/zinc/83/74/99/1038837499.db2.gz BIGLCJRJVLRBOY-YIKOMLBNSA-N 2 0 331.287 4.009 20 0 EIADRP CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cccc(F)c1Br ZINC000156679333 1038870960 /nfs/dbraw/zinc/87/09/60/1038870960.db2.gz MXJYDCMDPBJJCY-ZDUSSCGKSA-N 2 0 345.300 4.188 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+][C@H](CCc2ccccc2)Cc2ccccc2)CCN1C ZINC000462104072 1038909464 /nfs/dbraw/zinc/90/94/64/1038909464.db2.gz JONLIIFIIAHOBE-PTUXOGIPSA-N 2 0 336.523 4.303 20 0 EIADRP CC[N@H+](Cc1cccc(C(F)(F)F)c1)C1CCC([NH+](C)C)CC1 ZINC001168329551 1038953412 /nfs/dbraw/zinc/95/34/12/1038953412.db2.gz XRKSKHMTLTYQSN-UHFFFAOYSA-N 2 0 328.422 4.400 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1cccc(OC)c1 ZINC000120447718 1039107861 /nfs/dbraw/zinc/10/78/61/1039107861.db2.gz DBWLVLLDQQCKLW-KRWDZBQOSA-N 2 0 326.484 4.388 20 0 EIADRP C[C@@H]([NH3+])c1ccc(C[NH2+]Cc2cc(Cl)ccc2OCC2CC2)cc1 ZINC000414817524 1039108726 /nfs/dbraw/zinc/10/87/26/1039108726.db2.gz SJBBSZFYXBCZNR-CQSZACIVSA-N 2 0 344.886 4.438 20 0 EIADRP CC[NH+](CC)Cc1ccccc1C[NH2+][C@@H](C)c1ccc(OC)cc1 ZINC000120446690 1039110601 /nfs/dbraw/zinc/11/06/01/1039110601.db2.gz FXYURFGOVDKSPE-KRWDZBQOSA-N 2 0 326.484 4.388 20 0 EIADRP C[C@H]([NH2+]CCCCc1cccc(C(F)(F)F)c1)[C@@H]1CCC[NH2+]C1 ZINC000414819310 1039154774 /nfs/dbraw/zinc/15/47/74/1039154774.db2.gz HEVOINRIHIJWBF-GOEBONIOSA-N 2 0 328.422 4.006 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](C)CCc2ccc(OC(F)F)cc2)CC1 ZINC000120706823 1039210652 /nfs/dbraw/zinc/21/06/52/1039210652.db2.gz AEYHQZSDUGKWMA-HNNXBMFYSA-N 2 0 340.458 4.073 20 0 EIADRP CCOc1ccccc1[C@@H](C)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000120963424 1039249185 /nfs/dbraw/zinc/24/91/85/1039249185.db2.gz DSLCUVKDLSCCBJ-OAHLLOKOSA-N 2 0 330.447 4.137 20 0 EIADRP CCC[N@H+](C)C[C@@H]1CC[NH+]([C@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000478000688 1039293649 /nfs/dbraw/zinc/29/36/49/1039293649.db2.gz IQXGHXSNVQBBMJ-CABCVRRESA-N 2 0 328.422 4.430 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@H](CCc2ccccc2)Cc2ccccc2)C1 ZINC000481324778 1039296041 /nfs/dbraw/zinc/29/60/41/1039296041.db2.gz RXLGEGRTTKDYGV-XZOQPEGZSA-N 2 0 336.523 4.162 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)c1ccc(OCC(F)(F)F)cc1)C[NH+]1CCCC1 ZINC000481330925 1039305868 /nfs/dbraw/zinc/30/58/68/1039305868.db2.gz FBFBXJPYSBFVSZ-GJZGRUSLSA-N 2 0 344.421 4.010 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](CC)c2cccc(C)c2)[C@H](C)C1 ZINC000552244525 1039311236 /nfs/dbraw/zinc/31/12/36/1039311236.db2.gz DEYJCPYKLAQTFD-GIVPXCGWSA-N 2 0 332.532 4.173 20 0 EIADRP CC[C@H](CSc1ccc(Cl)cc1)[NH2+]C[C@H]1CC[N@H+](CC)C1 ZINC000481339685 1039318760 /nfs/dbraw/zinc/31/87/60/1039318760.db2.gz QZXOQCIGDRZKGU-GDBMZVCRSA-N 2 0 326.937 4.142 20 0 EIADRP CCC1(C[NH2+][C@@H](C)c2cccnc2)CC[NH+](Cc2ccccc2)CC1 ZINC000513871430 1039337635 /nfs/dbraw/zinc/33/76/35/1039337635.db2.gz QRZKFQKNIPJBRK-IBGZPJMESA-N 2 0 337.511 4.425 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cccc(OC3CCCC3)c2)C[C@H]1C ZINC000537634895 1039340007 /nfs/dbraw/zinc/34/00/07/1039340007.db2.gz YIJWXQGPPRYHIS-IEBWSBKVSA-N 2 0 330.516 4.313 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+]Cc1ccc(C2CCC2)cc1 ZINC000555535504 1039343264 /nfs/dbraw/zinc/34/32/64/1039343264.db2.gz WMOPVFZFRSOJGS-UHFFFAOYSA-N 2 0 338.495 4.184 20 0 EIADRP C[C@@H]([NH2+]C1CC[NH+](C2CCCCC2)CC1)c1ccc2n[nH]cc2c1 ZINC000552336986 1039401241 /nfs/dbraw/zinc/40/12/41/1039401241.db2.gz LWAJWDORSHESDN-OAHLLOKOSA-N 2 0 326.488 4.011 20 0 EIADRP CC[NH+]1CCC(CC[NH2+][C@H](C)[C@H](C)c2nc3ccccc3s2)CC1 ZINC000121732594 1039446408 /nfs/dbraw/zinc/44/64/08/1039446408.db2.gz FFXBBTJKPNOBST-JKSUJKDBSA-N 2 0 345.556 4.500 20 0 EIADRP CCOCCCC[NH2+][C@@H]1CCCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC000514103470 1039610140 /nfs/dbraw/zinc/61/01/40/1039610140.db2.gz CIONWXYZOWWFHF-BHDDXSALSA-N 2 0 344.543 4.084 20 0 EIADRP C[NH+](C)CCOc1ccccc1C[NH2+][C@H]1CCc2cc(Cl)ccc21 ZINC000122388126 1039680234 /nfs/dbraw/zinc/68/02/34/1039680234.db2.gz UBMBNZDCWUBLMQ-IBGZPJMESA-N 2 0 344.886 4.058 20 0 EIADRP C[C@H]([NH2+]Cc1ccccc1OCC[NH+](C)C)c1cc2ccccc2o1 ZINC000122398650 1039688093 /nfs/dbraw/zinc/68/80/93/1039688093.db2.gz KTADWEMVDWRDLX-INIZCTEOSA-N 2 0 338.451 4.224 20 0 EIADRP C[C@@H]([NH2+][C@H]1CC12CC[NH2+]CC2)c1ccc2ccccc2c1OC(F)F ZINC000643533799 1039709725 /nfs/dbraw/zinc/70/97/25/1039709725.db2.gz FDMCTSKTJSCDLV-DYVFJYSZSA-N 2 0 346.421 4.234 20 0 EIADRP COc1ccccc1-c1ccc([C@H](C)[NH2+][C@@H]2CC23CC[NH2+]CC3)cc1 ZINC000643534268 1039714477 /nfs/dbraw/zinc/71/44/77/1039714477.db2.gz PFWIVDIAVAGURS-HRAATJIYSA-N 2 0 336.479 4.155 20 0 EIADRP C[NH+](C)CCCC[NH2+]Cc1ccc(-c2cccc(C(F)(F)F)c2)o1 ZINC000514250796 1039799954 /nfs/dbraw/zinc/79/99/54/1039799954.db2.gz ZMJNRSOEQXAALQ-UHFFFAOYSA-N 2 0 340.389 4.397 20 0 EIADRP C[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccc(OC(F)F)cc1 ZINC000550883271 1039810541 /nfs/dbraw/zinc/81/05/41/1039810541.db2.gz XRTOKGMXSLCSAU-HNNXBMFYSA-N 2 0 326.431 4.205 20 0 EIADRP C[NH+](C)CCCC1CC[NH+](Cc2ccccc2OCC2CC2)CC1 ZINC000537648140 1039822559 /nfs/dbraw/zinc/82/25/59/1039822559.db2.gz NIFCBASITSPQQK-UHFFFAOYSA-N 2 0 330.516 4.029 20 0 EIADRP Cc1ccc(OCCC[NH2+][C@@H]2CCN(C)[C@@H](c3ccccc3)C2)cc1 ZINC000551029566 1039886836 /nfs/dbraw/zinc/88/68/36/1039886836.db2.gz KCUJOOBLRJDYPF-IFMALSPDSA-N 2 0 338.495 4.189 20 0 EIADRP Cc1ccc(OCCC[NH2+][C@H]2CCN(C)[C@@H](c3ccccc3)C2)cc1 ZINC000551029568 1039887344 /nfs/dbraw/zinc/88/73/44/1039887344.db2.gz KCUJOOBLRJDYPF-RBBKRZOGSA-N 2 0 338.495 4.189 20 0 EIADRP CCCCc1ccc([C@@H](C)[NH2+]C2CC[NH+](CCCOC)CC2)cc1 ZINC000481929184 1039899646 /nfs/dbraw/zinc/89/96/46/1039899646.db2.gz CHUHKTVJCIGALX-GOSISDBHSA-N 2 0 332.532 4.181 20 0 EIADRP CC(C)[N@@H+]1CCC[C@H](C[NH2+][C@H](C)Cc2ccccc2C(F)(F)F)C1 ZINC000481925960 1039902440 /nfs/dbraw/zinc/90/24/40/1039902440.db2.gz NPJTUSBBKCEGNF-HZPDHXFCSA-N 2 0 342.449 4.346 20 0 EIADRP C[C@@H](CC[NH+](C)C)N[C@@H](C)c1ccc2ccccc2c1OC(F)F ZINC000481962674 1039926325 /nfs/dbraw/zinc/92/63/25/1039926325.db2.gz PXLDXRCXIUKOJG-KBPBESRZSA-N 2 0 336.426 4.432 20 0 EIADRP C[C@@H](Cc1ccccc1C(F)(F)F)[NH2+]CC1CC[NH+](C2CC2)CC1 ZINC000481993203 1039937004 /nfs/dbraw/zinc/93/70/04/1039937004.db2.gz NFLREKCARUUOIB-AWEZNQCLSA-N 2 0 340.433 4.100 20 0 EIADRP CC(C)=CCC[C@H](C)CC[NH+]1CCC(N2CC[NH+](C(C)C)CC2)CC1 ZINC000482173138 1040057861 /nfs/dbraw/zinc/05/78/61/1040057861.db2.gz XDBIYQXUOKKVAZ-NRFANRHFSA-N 2 0 349.607 4.249 20 0 EIADRP CC[NH2+]CCCN[C@@H](c1ccc(F)cc1)c1cnc2ccccc2c1 ZINC000643498969 1040060298 /nfs/dbraw/zinc/06/02/98/1040060298.db2.gz DGARVSXTCOKVLI-NRFANRHFSA-N 2 0 337.442 4.053 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCCCC[NH+]2CCCC2)cc1 ZINC000551262643 1040121171 /nfs/dbraw/zinc/12/11/71/1040121171.db2.gz FMOHFPNCJJHTDJ-DUXKGJEZSA-N 2 0 330.516 4.043 20 0 EIADRP CCOC1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCC1 ZINC000551264832 1040123170 /nfs/dbraw/zinc/12/31/70/1040123170.db2.gz OJWSHOUSPXFTFP-WKCHPHFGSA-N 2 0 342.527 4.121 20 0 EIADRP CC(C)N(CC[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)C(C)C ZINC000551268067 1040129913 /nfs/dbraw/zinc/12/99/13/1040129913.db2.gz YLRBGFFZCJPODF-UHFFFAOYSA-N 2 0 345.575 4.138 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000551273214 1040140519 /nfs/dbraw/zinc/14/05/19/1040140519.db2.gz VFVYEWZFCSNSIK-QQUTXWOLSA-N 2 0 334.507 4.290 20 0 EIADRP CCOC[C@@H]([NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1)C(C)C ZINC000551279886 1040142359 /nfs/dbraw/zinc/14/23/59/1040142359.db2.gz KRNHUUYWOOFYCP-XVAXZDLZSA-N 2 0 332.532 4.080 20 0 EIADRP [NH3+]CCC[C@H]([NH2+]Cc1c(Cl)ccc2cccnc21)c1ccccc1 ZINC000666977326 1040183420 /nfs/dbraw/zinc/18/34/20/1040183420.db2.gz PWRKZOIJZDVGKX-IBGZPJMESA-N 2 0 339.870 4.458 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cccc(C(F)(F)F)c2)C1 ZINC000482336223 1040185964 /nfs/dbraw/zinc/18/59/64/1040185964.db2.gz RVECHZWGPGIUIM-GJZGRUSLSA-N 2 0 328.422 4.476 20 0 EIADRP CC(C)[N@@H+]1CCC[C@@H](C[NH2+][C@@H](C)c2cccc(OC(F)(F)F)c2)C1 ZINC000482355198 1040197099 /nfs/dbraw/zinc/19/70/99/1040197099.db2.gz FKRXCVUQOCIMEU-GJZGRUSLSA-N 2 0 344.421 4.356 20 0 EIADRP Cc1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CC[N@H+](CCc3ccccc3)C1)CC2 ZINC000482436778 1040244291 /nfs/dbraw/zinc/24/42/91/1040244291.db2.gz JKFZVVXQHNJRHN-REWPJTCUSA-N 2 0 334.507 4.137 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1cccc(F)c1 ZINC000482442762 1040250269 /nfs/dbraw/zinc/25/02/69/1040250269.db2.gz XCIACAPNNAVCIN-IEBWSBKVSA-N 2 0 326.459 4.041 20 0 EIADRP c1ccc(CC[N@@H+]2CC[C@H](C[NH2+][C@@H](Cc3ccccc3)C3CC3)C2)cc1 ZINC000482452130 1040263562 /nfs/dbraw/zinc/26/35/62/1040263562.db2.gz ABHIMGHYFMWALQ-VWNXMTODSA-N 2 0 348.534 4.162 20 0 EIADRP Cc1cccnc1C(C)(C)C[NH2+]C1CC[NH+]([C@@H]2CCCC[C@@H]2C)CC1 ZINC000514820433 1040268832 /nfs/dbraw/zinc/26/88/32/1040268832.db2.gz MMJJLVIZNWDSHU-FXAWDEMLSA-N 2 0 343.559 4.300 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H]2CCCc3c(Cl)sc(Cl)c32)CC1 ZINC000482562309 1040352199 /nfs/dbraw/zinc/35/21/99/1040352199.db2.gz QEHDCGJTJUHUQC-GFCCVEGCSA-N 2 0 333.328 4.364 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](CCCSCc2ccccc2)CC1 ZINC000535584100 1040386267 /nfs/dbraw/zinc/38/62/67/1040386267.db2.gz BYKKIYBXIKXVAS-UHFFFAOYSA-N 2 0 334.573 4.362 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)cc1 ZINC000551530081 1040386789 /nfs/dbraw/zinc/38/67/89/1040386789.db2.gz NLMDRIMAVNBKAN-XLNTUCKNSA-N 2 0 332.532 4.143 20 0 EIADRP c1ccc(CC(Cc2ccccc2)[NH2+][C@@H]2CC[NH2+]C3(CCC3)C2)cc1 ZINC000666995034 1040404057 /nfs/dbraw/zinc/40/40/57/1040404057.db2.gz AWOPSLLXCSXIHP-OAQYLSRUSA-N 2 0 334.507 4.105 20 0 EIADRP CC(C)COc1ccc(C(C)(C)C[NH2+][C@@H]2CC[N@H+](C)[C@@H](C)C2)cc1 ZINC000482643064 1040405035 /nfs/dbraw/zinc/40/50/35/1040405035.db2.gz ODJBWYZZBYIQOU-PKOBYXMFSA-N 2 0 332.532 4.071 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+][C@@H](C)c2cc(C)cc(C)c2)[C@H](C)C1 ZINC000482647706 1040406710 /nfs/dbraw/zinc/40/67/10/1040406710.db2.gz BMAQCEUHBIJGKV-DYXWJJEUSA-N 2 0 332.532 4.091 20 0 EIADRP c1ccc(COc2cccc(C[NH2+][C@H]3CC[NH2+]C4(CCC4)C3)c2)cc1 ZINC000666998399 1040421184 /nfs/dbraw/zinc/42/11/84/1040421184.db2.gz RFKWPFVFXKGTJZ-FQEVSTJZSA-N 2 0 336.479 4.030 20 0 EIADRP C[N@H+](CC1CC1)C[C@@H]1CC[NH+](CC(c2ccccc2)c2ccccc2)C1 ZINC000508857198 1040653994 /nfs/dbraw/zinc/65/39/94/1040653994.db2.gz CSQKTYYSKXYIST-NRFANRHFSA-N 2 0 348.534 4.482 20 0 EIADRP Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)[NH2+]CC(C)(C)C[NH+](C)C ZINC000479878154 1040739645 /nfs/dbraw/zinc/73/96/45/1040739645.db2.gz ZMESQPRHZXTOPX-ZDUSSCGKSA-N 2 0 349.519 4.496 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2cc(C)c(OC(F)F)c(C)c2)C[C@H]1C ZINC000539838135 1040819060 /nfs/dbraw/zinc/81/90/60/1040819060.db2.gz LAWFABGJPQUATP-WBVHZDCISA-N 2 0 340.458 4.209 20 0 EIADRP CC[N@@H+]1CC[C@@H](N(C)Cc2cnc(-c3ccc(C)cc3)s2)[C@@H](C)C1 ZINC000539835705 1040829197 /nfs/dbraw/zinc/82/91/97/1040829197.db2.gz PAMZFRRVIUKVTQ-QFBILLFUSA-N 2 0 343.540 4.281 20 0 EIADRP C[C@H]1CCCC[N@@H+]1CCCNCc1ccc(CSC(F)F)o1 ZINC000237505876 1040847576 /nfs/dbraw/zinc/84/75/76/1040847576.db2.gz CYMNLTHZUBYKHR-ZDUSSCGKSA-N 2 0 332.460 4.090 20 0 EIADRP Cc1cn2c(n1)[C@@H](C[NH2+][C@@H](C)c1ccc(OCC(C)C)cc1)CCC2 ZINC000483444493 1040861978 /nfs/dbraw/zinc/86/19/78/1040861978.db2.gz FTLSARLIGQGWIN-PKOBYXMFSA-N 2 0 341.499 4.455 20 0 EIADRP C[C@H](c1ccc(OC(F)(F)F)cc1)[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000483472229 1040869371 /nfs/dbraw/zinc/86/93/71/1040869371.db2.gz JXRLRQRQQOEODL-UNEWFSDZSA-N 2 0 342.405 4.062 20 0 EIADRP C[C@H](c1ccc(C(F)(F)F)cc1)[N@@H+]1CC[C@H]2[C@H](CCC[NH+]2C)C1 ZINC000483483453 1040873261 /nfs/dbraw/zinc/87/32/61/1040873261.db2.gz NNFKUGPRECHSNE-UNEWFSDZSA-N 2 0 326.406 4.183 20 0 EIADRP CCCCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCCN2CC)cc1OC ZINC000480082870 1040939229 /nfs/dbraw/zinc/93/92/29/1040939229.db2.gz GTIQOVXBTMSKJN-WMZOPIPTSA-N 2 0 334.504 4.009 20 0 EIADRP CC[N@H+](CCC1CC[NH+](Cc2ccc(OC)cc2)CC1)CC1CC1 ZINC000539957228 1040944245 /nfs/dbraw/zinc/94/42/45/1040944245.db2.gz ICWLSNGNSQADQI-UHFFFAOYSA-N 2 0 330.516 4.029 20 0 EIADRP CC[C@H]([NH2+]CCC1CC[NH+](CC)CC1)c1ccc(OC(F)F)cc1 ZINC000483708936 1040979625 /nfs/dbraw/zinc/97/96/25/1040979625.db2.gz IFNBWIIVKPHWFZ-SFHVURJKSA-N 2 0 340.458 4.451 20 0 EIADRP CCC[NH+]1CCC([NH2+][C@@H](C)c2ccc(OC)c3ccccc32)CC1 ZINC000480139539 1040988512 /nfs/dbraw/zinc/98/85/12/1040988512.db2.gz LWSVCKJSDQECBQ-INIZCTEOSA-N 2 0 326.484 4.373 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+]CC2(CCOC)CCCCC2)c1 ZINC000436234924 1041003825 /nfs/dbraw/zinc/00/38/25/1041003825.db2.gz ZOPNRHUCGNMSMO-UHFFFAOYSA-N 2 0 332.532 4.215 20 0 EIADRP CCN(CC)[C@@H](C[NH2+][C@@H](c1cccnc1)C(C)C)c1ccccc1 ZINC000538060561 1041031245 /nfs/dbraw/zinc/03/12/45/1041031245.db2.gz NNKYZICGTMYVAD-LEWJYISDSA-N 2 0 325.500 4.451 20 0 EIADRP COc1cc([C@H](C)[NH2+]CCC[NH+]2CCC(C)CC2)ccc1SC ZINC000480174240 1041036824 /nfs/dbraw/zinc/03/68/24/1041036824.db2.gz SFRSPBQZQRHDPX-INIZCTEOSA-N 2 0 336.545 4.190 20 0 EIADRP CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)CC(C)(C)c2c[nH]c3ccccc32)C1 ZINC000462889310 1041050253 /nfs/dbraw/zinc/05/02/53/1041050253.db2.gz SJINKFOZHFMYAK-IRXDYDNUSA-N 2 0 327.516 4.156 20 0 EIADRP C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000480267478 1041138853 /nfs/dbraw/zinc/13/88/53/1041138853.db2.gz SCIHNVCCTQFTQF-QVKFZJNVSA-N 2 0 326.459 4.301 20 0 EIADRP C[C@H](Nc1cc2c(c[nH+]1)CCCC2)c1cccc(OCC[NH+](C)C)c1 ZINC000462957419 1041142848 /nfs/dbraw/zinc/14/28/48/1041142848.db2.gz QSBZPNRLPKGDOE-INIZCTEOSA-N 2 0 339.483 4.074 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(OCC2CC2)cc1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000480273620 1041146116 /nfs/dbraw/zinc/14/61/16/1041146116.db2.gz IVBDNFBHXZIEMG-FXAWDEMLSA-N 2 0 342.527 4.218 20 0 EIADRP C[C@H]1C[C@@H]([NH2+]CCc2ccc(Oc3ccc(F)cc3)cc2)CC[N@@H+]1C ZINC000540140579 1041160784 /nfs/dbraw/zinc/16/07/84/1041160784.db2.gz PCYQAEVBTZYWLR-LPHOPBHVSA-N 2 0 342.458 4.233 20 0 EIADRP COc1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[N@H+](CC(C)C)C1)CCC2 ZINC000540148315 1041162436 /nfs/dbraw/zinc/16/24/36/1041162436.db2.gz YVPQNKRDNLQWPH-UTKZUKDTSA-N 2 0 330.516 4.030 20 0 EIADRP CCCC[C@H]([NH2+]C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1 ZINC000540158068 1041183690 /nfs/dbraw/zinc/18/36/90/1041183690.db2.gz SPLAHUJQBZULJV-BHDDXSALSA-N 2 0 344.543 4.275 20 0 EIADRP CC[NH+](CC)C[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1cccc(NC(C)=O)c1 ZINC000484293016 1041194576 /nfs/dbraw/zinc/19/45/76/1041194576.db2.gz PWYHZOVNGHSYEW-LRQRDZAKSA-N 2 0 345.531 4.196 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cc(Cl)cc(Cl)c1 ZINC000484289490 1041197842 /nfs/dbraw/zinc/19/78/42/1041197842.db2.gz FXQQQBPMPTVTEA-LRDDRELGSA-N 2 0 333.303 4.001 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC000484316753 1041208343 /nfs/dbraw/zinc/20/83/43/1041208343.db2.gz ZOTCIHCIKUFDQS-JSGCOSHPSA-N 2 0 333.303 4.001 20 0 EIADRP C[C@H]([NH2+]CCCC[NH+]1C[C@@H](C)O[C@H](C)C1)c1cccc2ccccc21 ZINC000540169052 1041212333 /nfs/dbraw/zinc/21/23/33/1041212333.db2.gz JJQUMKAGIHPQNS-QRVBRYPASA-N 2 0 340.511 4.380 20 0 EIADRP CCOCCC[N@@H+]1CC[C@H]([NH2+]C[C@@H](c2ccccc2)C(C)C)[C@H](C)C1 ZINC000480331505 1041218002 /nfs/dbraw/zinc/21/80/02/1041218002.db2.gz HBIHUOZWCJGSGI-FCEUIQTBSA-N 2 0 346.559 4.153 20 0 EIADRP C[C@@H]1C[N@H+](C)CC[C@H]1[NH2+]CC1(c2ccc(Cl)cc2Cl)CCC1 ZINC000540163761 1041227095 /nfs/dbraw/zinc/22/70/95/1041227095.db2.gz JQNRLHHFLQVDPH-CXAGYDPISA-N 2 0 341.326 4.345 20 0 EIADRP Cc1ncsc1-c1ccc(C[N@@H+]2CC[C@@H](C[NH+]3CCCC3)C2)cc1 ZINC000667663587 1041229067 /nfs/dbraw/zinc/22/90/67/1041229067.db2.gz QSOQHEPXODHSDN-SFHVURJKSA-N 2 0 341.524 4.036 20 0 EIADRP CSc1ccccc1[C@H](C)[NH2+]Cc1cccc(OCC[NH+](C)C)c1 ZINC000194855225 1041233374 /nfs/dbraw/zinc/23/33/74/1041233374.db2.gz LXKMWLKWPWOPQE-INIZCTEOSA-N 2 0 344.524 4.200 20 0 EIADRP C[C@@H](NC1(C[NH2+][C@H]2CCC23CCOCC3)CCCC1)c1ccccc1 ZINC000554559548 1041244602 /nfs/dbraw/zinc/24/46/02/1041244602.db2.gz DFEYIPKKNDJOLT-QUCCMNQESA-N 2 0 342.527 4.199 20 0 EIADRP C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1cccc(OC(F)(F)F)c1 ZINC000484475479 1041269771 /nfs/dbraw/zinc/26/97/71/1041269771.db2.gz RRWSQYWEZSECIN-AEGPPILISA-N 2 0 330.394 4.109 20 0 EIADRP C[C@H]1C[C@H](C)C[NH+](C(C)(C)C[NH2+]C2CCN(c3ccccc3)CC2)C1 ZINC000463076623 1041320503 /nfs/dbraw/zinc/32/05/03/1041320503.db2.gz KLDJBHSPMMNVJY-OALUTQOASA-N 2 0 343.559 4.002 20 0 EIADRP C[N@H+]1CC=C(C[NH2+][C@H](c2ccc(Cl)c(Cl)c2)C2CC2)CC1 ZINC000538408255 1041325340 /nfs/dbraw/zinc/32/53/40/1041325340.db2.gz DDYMHXRTPVSPTJ-KRWDZBQOSA-N 2 0 325.283 4.296 20 0 EIADRP C[N@H+](CCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1C[C@@H]1c1ccccc1 ZINC000463162023 1041378137 /nfs/dbraw/zinc/37/81/37/1041378137.db2.gz JZSOVVDYWQIKTR-FGZHOGPDSA-N 2 0 335.495 4.176 20 0 EIADRP COc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(C[NH+](C)C)c2)cc1OC ZINC000924796833 1041394740 /nfs/dbraw/zinc/39/47/40/1041394740.db2.gz DIAWULFSVSFOLK-HZPDHXFCSA-N 2 0 342.483 4.177 20 0 EIADRP CC(C)(C[NH2+]C1CC[NH+](CC2CC2)CC1)c1c(F)cccc1Cl ZINC000540360431 1041414917 /nfs/dbraw/zinc/41/49/17/1041414917.db2.gz VTXQWYNASBMNDW-UHFFFAOYSA-N 2 0 338.898 4.221 20 0 EIADRP COc1cc(C)c([C@H](C)[NH2+]CCCC[N@@H+]2CCC[C@@H](C)C2)cc1OC ZINC000480611629 1041422524 /nfs/dbraw/zinc/42/25/24/1041422524.db2.gz OPJGOJUXXAZOIY-AEFFLSMTSA-N 2 0 348.531 4.175 20 0 EIADRP C[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)c1ccc(-n2cccn2)cc1 ZINC000480631812 1041445256 /nfs/dbraw/zinc/44/52/56/1041445256.db2.gz QXAXBFPIROSAGF-MOPGFXCFSA-N 2 0 340.515 4.178 20 0 EIADRP CCc1nc2c(s1)[C@H]([NH2+]CCCC[N@@H+]1CCCC[C@H]1C)CCC2 ZINC000480635083 1041448606 /nfs/dbraw/zinc/44/86/06/1041448606.db2.gz VNQCFUSMPGBVKH-HZPDHXFCSA-N 2 0 335.561 4.327 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@@H]1Nc1ccc2c(c1)nc(C(C)(C)C)n2C ZINC000538627233 1041459698 /nfs/dbraw/zinc/45/96/98/1041459698.db2.gz CQXJSYYYIJEEAP-FMKPAKJESA-N 2 0 328.504 4.011 20 0 EIADRP C[C@H]([NH2+]C1(Cc2ccccc2)CC1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000480692504 1041476453 /nfs/dbraw/zinc/47/64/53/1041476453.db2.gz ASDBOOZMTQCQNQ-SIKLNZKXSA-N 2 0 334.507 4.262 20 0 EIADRP Fc1ccc([C@@H]([NH2+]CCCNc2ccccn2)c2ccccc2)cc1 ZINC000480722862 1041489614 /nfs/dbraw/zinc/48/96/14/1041489614.db2.gz KYCWXRYUQPNPBD-NRFANRHFSA-N 2 0 335.426 4.402 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2)cc1 ZINC000480738064 1041498848 /nfs/dbraw/zinc/49/88/48/1041498848.db2.gz PUASIIQRUKAHSA-QGZVFWFLSA-N 2 0 344.474 4.397 20 0 EIADRP COc1ccc2ccccc2c1C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1 ZINC000538749408 1041520504 /nfs/dbraw/zinc/52/05/04/1041520504.db2.gz LLSWZVGXVLBDRP-GOSISDBHSA-N 2 0 338.495 4.012 20 0 EIADRP CCO[C@@H](CC[NH+](C)C)C[NH2+][C@@H](C)c1oc2ccccc2c1CC ZINC000540595265 1041551337 /nfs/dbraw/zinc/55/13/37/1041551337.db2.gz SAUOLNWKDYNQBO-HOTGVXAUSA-N 2 0 332.488 4.003 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@H](C)C[C@H]1Nc1ccc(C[NH+]2CCCC[C@@H]2C)cc1 ZINC000540699939 1041615329 /nfs/dbraw/zinc/61/53/29/1041615329.db2.gz RRMSCPHOFKVVRT-BMQTXXJKSA-N 2 0 329.532 4.202 20 0 EIADRP C[C@H]([NH2+]CCc1ccc(F)cc1F)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000516802130 1041763186 /nfs/dbraw/zinc/76/31/86/1041763186.db2.gz LSPNPISOOLLEDR-QFBILLFUSA-N 2 0 344.449 4.008 20 0 EIADRP Cc1nc2ccc(C[NH+]3CCC(C[N@@H+](C)C(C)C)CC3)cc2s1 ZINC000516860357 1041787280 /nfs/dbraw/zinc/78/72/80/1041787280.db2.gz ZCCMAZFQQXPFOS-UHFFFAOYSA-N 2 0 331.529 4.157 20 0 EIADRP CC[C@H](C[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1)CC(F)(F)F ZINC000402486993 1041819141 /nfs/dbraw/zinc/81/91/41/1041819141.db2.gz ASRVHNKRKAKRDR-XYJFISCASA-N 2 0 342.449 4.465 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H]2CCCc3c4cc(C)ccc4[nH]c32)CC1 ZINC000516992730 1041833651 /nfs/dbraw/zinc/83/36/51/1041833651.db2.gz KGNYLDVYOJJKBB-FQEVSTJZSA-N 2 0 325.500 4.175 20 0 EIADRP COc1cccc(C2([NH2+]C3CC[NH+](C4CCCCC4)CC3)CCC2)c1 ZINC001203223648 1041853087 /nfs/dbraw/zinc/85/30/87/1041853087.db2.gz YZELIIFSFILHLI-UHFFFAOYSA-N 2 0 342.527 4.461 20 0 EIADRP C[C@@H](Cc1ccccc1F)[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000437768965 1041899847 /nfs/dbraw/zinc/89/98/47/1041899847.db2.gz DKPOXJZQDPKUMW-KKXNLOMOSA-N 2 0 332.507 4.389 20 0 EIADRP COc1ccc(C2(C[NH2+]C3CC[NH+](C4CCCC4)CC3)CCC2)cc1 ZINC000541558908 1042000554 /nfs/dbraw/zinc/00/05/54/1042000554.db2.gz UYWVVHHWRXMNTL-UHFFFAOYSA-N 2 0 342.527 4.114 20 0 EIADRP C[C@@H](C[N@H+](C)CC1CCN(c2cc[nH+]cc2)CC1)c1ccc(F)cc1 ZINC000437982497 1042004157 /nfs/dbraw/zinc/00/41/57/1042004157.db2.gz CNOGXOCTUSXDIB-KRWDZBQOSA-N 2 0 341.474 4.173 20 0 EIADRP CSC1(C[NH2+][C@@H](C)c2ccc3ccccc3c2)CC[NH+](C)CC1 ZINC000517630678 1042117238 /nfs/dbraw/zinc/11/72/38/1042117238.db2.gz JNDXQOSPTDHJLC-INIZCTEOSA-N 2 0 328.525 4.318 20 0 EIADRP CSC1(C[NH2+][C@H](C)c2ccc3ccccc3c2)CC[NH+](C)CC1 ZINC000517630684 1042117670 /nfs/dbraw/zinc/11/76/70/1042117670.db2.gz JNDXQOSPTDHJLC-MRXNPFEDSA-N 2 0 328.525 4.318 20 0 EIADRP CC[NH+](CC)C[C@H]1CC[N@H+](CCCOc2ccc3ccccc3c2)C1 ZINC000464772671 1042166037 /nfs/dbraw/zinc/16/60/37/1042166037.db2.gz FRPFZORGQLQCKB-LJQANCHMSA-N 2 0 340.511 4.272 20 0 EIADRP C[C@@H]1CCCC[C@@H]1OCC[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC000464847135 1042194945 /nfs/dbraw/zinc/19/49/45/1042194945.db2.gz UTUIURPIHCXRCE-HJNYFJLDSA-N 2 0 344.543 4.036 20 0 EIADRP C[C@@H]1C[C@H](C)C[N@@H+](CCCC[NH2+][C@H](c2cncc(F)c2)C2CC2)C1 ZINC000467371503 1042213825 /nfs/dbraw/zinc/21/38/25/1042213825.db2.gz WEHNDGLSTYQQIH-YRNRMSPPSA-N 2 0 333.495 4.020 20 0 EIADRP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1[NH2+]CC1(c2cccc(F)c2F)CCCC1 ZINC000426063599 1042240020 /nfs/dbraw/zinc/24/00/20/1042240020.db2.gz PPOGMKDSJBBIFP-VKJFTORMSA-N 2 0 336.470 4.095 20 0 EIADRP CC1([NH2+]C/C=C\c2ccc(OCc3ccccc3)cc2)CC[NH2+]CC1 ZINC000414938381 1042289495 /nfs/dbraw/zinc/28/94/95/1042289495.db2.gz IOOCWCJGMSSDDH-YVMONPNESA-N 2 0 336.479 4.011 20 0 EIADRP CC(C)[NH+]1CCC([NH2+]CC(C)(C)c2c(F)cccc2Cl)CC1 ZINC000542136451 1042299603 /nfs/dbraw/zinc/29/96/03/1042299603.db2.gz LBIIVDCKCDEPHS-UHFFFAOYSA-N 2 0 326.887 4.219 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(C[NH+]2CCCCC2)cc1)c1ccc(F)cn1 ZINC000491397941 1042440513 /nfs/dbraw/zinc/44/05/13/1042440513.db2.gz RNQXSLROXCGHGC-FQEVSTJZSA-N 2 0 341.474 4.448 20 0 EIADRP C[C@@H](c1ccc(C[N@H+](C)C2C[C@H]3CC[C@@H](C2)[NH+]3C)cc1)C(F)(F)F ZINC000295283234 1042457053 /nfs/dbraw/zinc/45/70/53/1042457053.db2.gz KTOATUIMXKWCFM-BXEVVDMOSA-N 2 0 340.433 4.409 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@H]2[NH2+]CCC[C@@H]2CCC[NH2+]2)cc1 ZINC000414983642 1042520533 /nfs/dbraw/zinc/52/05/33/1042520533.db2.gz ZYVOKCPXLPIKNY-SESVDKBCSA-N 2 0 330.516 4.232 20 0 EIADRP c1c2ccccc2sc1C[NH2+]C1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1 ZINC001167964036 1042548932 /nfs/dbraw/zinc/54/89/32/1042548932.db2.gz LMDSBXQUZUJEIC-AYHJJNSGSA-N 2 0 326.509 4.396 20 0 EIADRP [NH3+][C@@H]1CCC[C@@H](C[NH2+]CC(c2ccc(F)cc2)c2ccc(F)cc2)C1 ZINC000414996487 1042600518 /nfs/dbraw/zinc/60/05/18/1042600518.db2.gz GJZQXNQIYDXKJF-FOIQADDNSA-N 2 0 344.449 4.204 20 0 EIADRP C[C@H]([NH2+]CCCc1cccc(F)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492326082 1042614086 /nfs/dbraw/zinc/61/40/86/1042614086.db2.gz BBAFCNLNSXYOKN-GHTZIAJQSA-N 2 0 340.486 4.259 20 0 EIADRP C[C@H]([NH2+]CCCc1cccc(F)c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492326084 1042614297 /nfs/dbraw/zinc/61/42/97/1042614297.db2.gz BBAFCNLNSXYOKN-RXVVDRJESA-N 2 0 340.486 4.259 20 0 EIADRP C[C@@H]([NH2+]CCO[C@H]1CCCC[C@H]1C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000492427281 1042649098 /nfs/dbraw/zinc/64/90/98/1042649098.db2.gz YRWKSXRUOHNWSJ-CZAYHTPWSA-N 2 0 344.543 4.082 20 0 EIADRP CC(C)Oc1ccc([C@@H]2CCC[C@@H]2[NH2+]C[C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC000415004120 1042740563 /nfs/dbraw/zinc/74/05/63/1042740563.db2.gz NUHCPKVLIWDWEP-OFCAXSSNSA-N 2 0 330.516 4.217 20 0 EIADRP CC[NH+]1CCC(C[NH2+][C@H]2CCCOc3c(Cl)cc(C)cc32)CC1 ZINC000519055856 1042805125 /nfs/dbraw/zinc/80/51/25/1042805125.db2.gz AYUCGYNQEIBEKA-SFHVURJKSA-N 2 0 336.907 4.184 20 0 EIADRP C[C@H](CC[NH+](C)C)[NH2+][C@H](C)c1ccc(OCc2ccccc2)cc1 ZINC000309876395 1042823947 /nfs/dbraw/zinc/82/39/47/1042823947.db2.gz JCDHVRIXCGSZSY-QZTJIDSGSA-N 2 0 326.484 4.256 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[N@@H+](C)[C@@H](C)c1ccc(C)cc1C ZINC000542465032 1042831248 /nfs/dbraw/zinc/83/12/48/1042831248.db2.gz ZQAZKIFKFATBCZ-SFHVURJKSA-N 2 0 334.467 4.386 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H](C)c2cccc(OC)c2)c1 ZINC000177227893 1042831258 /nfs/dbraw/zinc/83/12/58/1042831258.db2.gz VWZYQCLMBDPHOP-KRWDZBQOSA-N 2 0 326.484 4.388 20 0 EIADRP COc1cccc([C@@H](C)[NH2+]CC2CC[NH+](Cc3cccs3)CC2)c1 ZINC000177270932 1042832813 /nfs/dbraw/zinc/83/28/13/1042832813.db2.gz CIUAOUBLCLUEOP-MRXNPFEDSA-N 2 0 344.524 4.320 20 0 EIADRP Cc1cc(C[NH2+][C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1F ZINC000310522228 1042839142 /nfs/dbraw/zinc/83/91/42/1042839142.db2.gz NVJWGIYVOVMALP-PXNSSMCTSA-N 2 0 326.459 4.134 20 0 EIADRP CC(C)[NH2+]C1CCN([C@H](C)c2ccc(OC(F)(F)F)cc2)CC1 ZINC000170986839 1042911117 /nfs/dbraw/zinc/91/11/17/1042911117.db2.gz NLAVZDPWLUCMPR-CYBMUJFWSA-N 2 0 330.394 4.109 20 0 EIADRP CCCC[N@H+](CC)CCN[C@@H]1C[C@@H](C)[NH+](Cc2ccccc2)[C@@H](C)C1 ZINC001168008113 1043032105 /nfs/dbraw/zinc/03/21/05/1043032105.db2.gz CNYGBKDWAUXVMB-VTYHHJSWSA-N 2 0 345.575 4.140 20 0 EIADRP CC[N@@H+]1CC[C@H](N(C)Cc2ccc(Oc3ccccc3)o2)C[C@@H]1C ZINC000507809882 1043042594 /nfs/dbraw/zinc/04/25/94/1043042594.db2.gz AMADFQBSMHULST-IRXDYDNUSA-N 2 0 328.456 4.377 20 0 EIADRP C[C@H]([NH2+][C@H](COc1ccccc1)c1ccccc1)C1CC[NH+](C)CC1 ZINC000678583959 1043075949 /nfs/dbraw/zinc/07/59/49/1043075949.db2.gz HQYGENFWQVOEHR-PGRDOPGGSA-N 2 0 338.495 4.127 20 0 EIADRP Brc1cscc1C[NH2+]CCCCC[NH+]1CCCCC1 ZINC000511998193 1043085559 /nfs/dbraw/zinc/08/55/59/1043085559.db2.gz ZAKAVJBDZRQNSO-UHFFFAOYSA-N 2 0 345.350 4.256 20 0 EIADRP Cc1cncc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCC[C@H](C)C3)cc2)c1 ZINC000184278819 1043087229 /nfs/dbraw/zinc/08/72/29/1043087229.db2.gz UWRVKOANJQPJJY-HKUYNNGSSA-N 2 0 337.511 4.473 20 0 EIADRP COCCC[C@@H]([NH2+]C1CC[NH+](C(C)(C)C)CC1)c1ccc(F)cc1 ZINC000282320347 1043179867 /nfs/dbraw/zinc/17/98/67/1043179867.db2.gz NOHNIVVNHBYFOS-LJQANCHMSA-N 2 0 336.495 4.146 20 0 EIADRP FC(F)(F)C1CCC(C[N@@H+]2CCC[C@@H]([NH+]3CCCC3)CC2)CC1 ZINC000185515734 1043193582 /nfs/dbraw/zinc/19/35/82/1043193582.db2.gz JDCMIQWOELRJOT-OFLPRAFFSA-N 2 0 332.454 4.305 20 0 EIADRP CC1CC[NH+](C2CCC([NH2+][C@H]3CCc4ccc(F)cc43)CC2)CC1 ZINC000536824726 1043306069 /nfs/dbraw/zinc/30/60/69/1043306069.db2.gz DOMNIMYICICZAN-GRERDSQWSA-N 2 0 330.491 4.446 20 0 EIADRP Clc1ccc(CCC[NH2+][C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c(Cl)c1 ZINC000166760821 1043312606 /nfs/dbraw/zinc/31/26/06/1043312606.db2.gz OKKRLZUSIDPCHE-HZPDHXFCSA-N 2 0 327.299 4.142 20 0 EIADRP COCCC1(C[NH2+]C2CC[NH+](C3CCCCC3)CC2)CCCCC1 ZINC000186887274 1043316121 /nfs/dbraw/zinc/31/61/21/1043316121.db2.gz ATGJCZMZBWMTNK-UHFFFAOYSA-N 2 0 336.564 4.360 20 0 EIADRP FC1(F)C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(C[NH+]2CCCCC2)cc1 ZINC000625678447 1043335746 /nfs/dbraw/zinc/33/57/46/1043335746.db2.gz CMQKFRMDLZCJSC-KDURUIRLSA-N 2 0 334.454 4.435 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)C1CCC(F)(F)CC1 ZINC000474025941 1043384738 /nfs/dbraw/zinc/38/47/38/1043384738.db2.gz YSSDFAKIPKVDOF-CYBMUJFWSA-N 2 0 328.422 4.191 20 0 EIADRP Cc1ccc(C[NH2+]C2CCN([C@@H](C)c3ccncc3)CC2)c(Cl)c1 ZINC000520822464 1043397626 /nfs/dbraw/zinc/39/76/26/1043397626.db2.gz RMCJHJHSUIFSFG-INIZCTEOSA-N 2 0 343.902 4.359 20 0 EIADRP Cc1ccc(C[NH2+]C2CCN([C@H](C)c3ccncc3)CC2)c(Cl)c1 ZINC000520822465 1043398021 /nfs/dbraw/zinc/39/80/21/1043398021.db2.gz RMCJHJHSUIFSFG-MRXNPFEDSA-N 2 0 343.902 4.359 20 0 EIADRP C[C@@H]1CC(n2ccc3cc(C[NH3+])cnc32)C[C@@H](C)[NH+]1Cc1ccccc1 ZINC001168012449 1043423318 /nfs/dbraw/zinc/42/33/18/1043423318.db2.gz AKJUIMFAVGGERF-IAGOWNOFSA-N 2 0 348.494 4.109 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000174992617 1043426397 /nfs/dbraw/zinc/42/63/97/1043426397.db2.gz RXWVFEUKJYKOPX-NRFANRHFSA-N 2 0 326.459 4.443 20 0 EIADRP Clc1ccccc1C[NH+]1CCC(C[NH2+]Cc2ccccc2)CC1 ZINC000520973806 1043469736 /nfs/dbraw/zinc/46/97/36/1043469736.db2.gz DLDJTHHLHVBYOQ-UHFFFAOYSA-N 2 0 328.887 4.342 20 0 EIADRP CC(C)O[C@H](C[N@@H+]1CCC[C@H]([NH+]2CCCC2)CC1)c1ccccc1 ZINC000428251059 1043695941 /nfs/dbraw/zinc/69/59/41/1043695941.db2.gz YALIBPCCQYJKHA-LEWJYISDSA-N 2 0 330.516 4.103 20 0 EIADRP CCc1ccc([C@H](CC)[NH2+]CC2CC[NH+](C3CCOCC3)CC2)cc1 ZINC000658067386 1043722563 /nfs/dbraw/zinc/72/25/63/1043722563.db2.gz MZRLCMRUEAGYEV-QFIPXVFZSA-N 2 0 344.543 4.181 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000442705869 1043812674 /nfs/dbraw/zinc/81/26/74/1043812674.db2.gz CEWCTJQGZHYVAP-KYJSFNMBSA-N 2 0 340.433 4.273 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000442705865 1043813299 /nfs/dbraw/zinc/81/32/99/1043813299.db2.gz CEWCTJQGZHYVAP-HFTRVMKXSA-N 2 0 340.433 4.273 20 0 EIADRP CC[N@@H+]1CC[C@H](C[NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC000442705871 1043813533 /nfs/dbraw/zinc/81/35/33/1043813533.db2.gz CEWCTJQGZHYVAP-QGPMSJSTSA-N 2 0 340.433 4.273 20 0 EIADRP COCCC[C@H]([NH2+]C[C@H](C)C[NH+]1CCCCC1)c1ccc(F)cc1 ZINC000442723112 1043824276 /nfs/dbraw/zinc/82/42/76/1043824276.db2.gz YONZDLNTGGLDAV-PXNSSMCTSA-N 2 0 336.495 4.005 20 0 EIADRP C[C@H]1C[C@H]([NH2+]CC(C)(C)c2ccc(C(F)(F)F)cc2)CC[N@@H+]1C ZINC000191548929 1043825718 /nfs/dbraw/zinc/82/57/18/1043825718.db2.gz MDHZUEBSKVIIJX-XJKSGUPXSA-N 2 0 328.422 4.055 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CC1 ZINC000442790826 1043840787 /nfs/dbraw/zinc/84/07/87/1043840787.db2.gz MIDAJFGJWNJWGA-FUHWJXTLSA-N 2 0 340.433 4.273 20 0 EIADRP [NH3+]CC[C@@H]1CCC[N@H+](Cc2c(OC(F)F)ccc3ccccc32)C1 ZINC000442920469 1043898374 /nfs/dbraw/zinc/89/83/74/1043898374.db2.gz LMARWOSPEHTYQK-AWEZNQCLSA-N 2 0 334.410 4.002 20 0 EIADRP CCC(CC)(C[NH2+][C@@H](C)c1ccc(C[NH3+])nc1C)c1ccc(F)cc1 ZINC000665301028 1043913263 /nfs/dbraw/zinc/91/32/63/1043913263.db2.gz MRUPSAGLOMFMOL-HNNXBMFYSA-N 2 0 343.490 4.396 20 0 EIADRP Cc1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](Cc3ccncc3)CC1)[C@@H](C)C2 ZINC000658168493 1043950559 /nfs/dbraw/zinc/95/05/59/1043950559.db2.gz XNBGJWUZTURZRU-FDDCHVKYSA-N 2 0 349.522 4.125 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]Cc3ccc4ncccc4c3)CC2)C1 ZINC000192982756 1043989202 /nfs/dbraw/zinc/98/92/02/1043989202.db2.gz RWWYCQXGMLSRCG-UTKZUKDTSA-N 2 0 337.511 4.368 20 0 EIADRP C[C@@]1(CC[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1(F)F ZINC000658223136 1044073494 /nfs/dbraw/zinc/07/34/94/1044073494.db2.gz SPHGYKJKOYLGLR-AKHDSKFASA-N 2 0 334.454 4.207 20 0 EIADRP C[NH+](C/C=C/C[N@H+](C)CCc1cccs1)CCc1cccs1 ZINC000173759467 1044130872 /nfs/dbraw/zinc/13/08/72/1044130872.db2.gz UZKAQPHOBVPZJB-ONEGZZNKSA-N 2 0 334.554 4.015 20 0 EIADRP CC(C)[N@H+](C)CCC[NH2+]C1CC(c2ccc(Br)cc2)C1 ZINC000226392159 1044179013 /nfs/dbraw/zinc/17/90/13/1044179013.db2.gz SLBYKXKZNPWMRL-UHFFFAOYSA-N 2 0 339.321 4.015 20 0 EIADRP CC(C)C[N@@H+]1CCC[C@H](C[NH2+]CC2CCC(C(F)(F)F)CC2)C1 ZINC000466361380 1044323694 /nfs/dbraw/zinc/32/36/94/1044323694.db2.gz UWKMVHVQYOWYAJ-AQFXKWCLSA-N 2 0 334.470 4.313 20 0 EIADRP Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000326934488 1044332083 /nfs/dbraw/zinc/33/20/83/1044332083.db2.gz VVJSWBYPZJKMTD-LJQANCHMSA-N 2 0 339.483 4.255 20 0 EIADRP COc1ccc2c(c1)C(C)(C)C[C@@H]2[NH2+]Cc1cccc(C[NH+](C)C)c1 ZINC000474066570 1044335428 /nfs/dbraw/zinc/33/54/28/1044335428.db2.gz NSXQWRBQFZNWRB-NRFANRHFSA-N 2 0 338.495 4.269 20 0 EIADRP C[NH+](C)Cc1ccc(C[NH2+]CC2CCC(C(F)(F)F)CC2)cc1F ZINC000466373986 1044340910 /nfs/dbraw/zinc/34/09/10/1044340910.db2.gz IJPSHFWKEXVFPS-UHFFFAOYSA-N 2 0 346.412 4.346 20 0 EIADRP Cc1nc(C(C)C)sc1[C@H](C)[NH2+]CC1CC[NH+](CC2CC2)CC1 ZINC000658353008 1044365687 /nfs/dbraw/zinc/36/56/87/1044365687.db2.gz BCFIYKNYQJLGNW-AWEZNQCLSA-N 2 0 335.561 4.348 20 0 EIADRP CCC(C)(C)[NH2+][C@H](C)C(=O)Nc1ccc(C[N@@H+]2CCC[C@H](C)C2)cc1 ZINC000542515433 1044394836 /nfs/dbraw/zinc/39/48/36/1044394836.db2.gz YGUPKMUGHAVJQG-DLBZAZTESA-N 2 0 345.531 4.024 20 0 EIADRP Cc1nc(-c2ccc([C@H](C)[NH2+][C@H](C)C3CC[NH+](C)CC3)cc2)cs1 ZINC000675735440 1044453374 /nfs/dbraw/zinc/45/33/74/1044453374.db2.gz JIAPCDIHHNTABZ-LSDHHAIUSA-N 2 0 343.540 4.499 20 0 EIADRP Cc1nn(-c2cc[nH+]cc2)cc1C[NH2+][C@@H](c1ccccc1F)C(C)C ZINC000657616313 1044464303 /nfs/dbraw/zinc/46/43/03/1044464303.db2.gz WEWOOCXKOKKNRZ-HXUWFJFHSA-N 2 0 338.430 4.202 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](C)c1c(Cl)cccc1Cl)C1CC[NH+](C)CC1 ZINC000675802975 1044504210 /nfs/dbraw/zinc/50/42/10/1044504210.db2.gz JNPQDGISKNZLDF-CHWSQXEVSA-N 2 0 329.315 4.417 20 0 EIADRP CCC[C@@H]([NH2+][C@@H](C)c1ccc(OCC[NH+](C)C)cc1)c1ccccn1 ZINC000675815274 1044515987 /nfs/dbraw/zinc/51/59/87/1044515987.db2.gz AOJGPKRKCJBZFQ-LAUBAEHRSA-N 2 0 341.499 4.214 20 0 EIADRP c1cncc([C@@H]2CCC[C@H]([NH2+][C@H]3CCN(C4CCCCC4)C3)C2)c1 ZINC000657678219 1044519981 /nfs/dbraw/zinc/51/99/81/1044519981.db2.gz NXGDMGVWSFNLIM-HOJAQTOUSA-N 2 0 327.516 4.104 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2cccc3ncoc32)C[C@H](C)[N@H+]1Cc1ccccc1 ZINC001168022570 1044523143 /nfs/dbraw/zinc/52/31/43/1044523143.db2.gz AGTBIRFPCIDJJJ-XEMDLRDOSA-N 2 0 349.478 4.359 20 0 EIADRP C(=C\c1ccncc1)\CN1CC[C@]2(C1)CCC[N@H+](Cc1ccccc1)C2 ZINC000494963873 1044558551 /nfs/dbraw/zinc/55/85/51/1044558551.db2.gz KGHHNCICSNLYRS-HEBQJAJPSA-N 2 0 347.506 4.083 20 0 EIADRP CC[N@@H+]1CC[C@@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2C)C[C@@H]1C ZINC000443650243 1044620223 /nfs/dbraw/zinc/62/02/23/1044620223.db2.gz CNRDIWCSZUYYLO-WMLDXEAASA-N 2 0 328.422 4.318 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH+](C)Cc2ccc(C(F)(F)F)cc2C)[C@@H](C)C1 ZINC000443658962 1044647480 /nfs/dbraw/zinc/64/74/80/1044647480.db2.gz OMWAELMAUFEAQA-YOEHRIQHSA-N 2 0 328.422 4.176 20 0 EIADRP Cc1ccccc1OCCC[NH2+][C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000543461464 1044651088 /nfs/dbraw/zinc/65/10/88/1044651088.db2.gz GYLWTVOGIWUTRG-RBUKOAKNSA-N 2 0 330.516 4.007 20 0 EIADRP C[C@H]1CCC[N@H+](Cc2ccc(C[NH2+]C3CC(CF)(CF)C3)cc2)C1 ZINC000657836810 1044719917 /nfs/dbraw/zinc/71/99/17/1044719917.db2.gz OVRLTQCEVRJHOS-INIZCTEOSA-N 2 0 336.470 4.096 20 0 EIADRP C[C@H]([NH2+]C1C[C@@H](C)[NH+](Cc2ccccc2)[C@H](C)C1)c1cccc(N)c1 ZINC001168026958 1044722305 /nfs/dbraw/zinc/72/23/05/1044722305.db2.gz MPVSXSRFJAWQRC-KURKYZTESA-N 2 0 337.511 4.361 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccccc1C[NH2+]C1CC(CF)(CF)C1 ZINC000657838421 1044730227 /nfs/dbraw/zinc/73/02/27/1044730227.db2.gz SYEWLHLVSLTVPF-INIZCTEOSA-N 2 0 336.470 4.238 20 0 EIADRP COc1ccccc1/C=C/C[NH2+]Cc1cccc(C[N@H+](C)C(C)C)c1 ZINC000237310374 1044824786 /nfs/dbraw/zinc/82/47/86/1044824786.db2.gz PCQCCHIJZIWOLQ-XYOKQWHBSA-N 2 0 338.495 4.338 20 0 EIADRP C[C@H]([NH2+]C1CC[NH+](CC2CCCC2)CC1)[C@@H]1C[C@H]1c1ccccc1 ZINC000670154304 1044932702 /nfs/dbraw/zinc/93/27/02/1044932702.db2.gz XMYIQOVGKYWCQO-HSQYWUDLSA-N 2 0 326.528 4.423 20 0 EIADRP CC(C)[NH+]1CCC(N2CC[NH+](C[C@@H](C)CC3CCCCC3)CC2)CC1 ZINC000543630745 1044990389 /nfs/dbraw/zinc/99/03/89/1044990389.db2.gz AOFFIQFHFIAVFP-FQEVSTJZSA-N 2 0 349.607 4.083 20 0 EIADRP COCc1ccccc1/C=C(/C)C[NH2+]C1CCC(C)([NH+]2CCC2)CC1 ZINC000922845837 1044993152 /nfs/dbraw/zinc/99/31/52/1044993152.db2.gz UHNCYCABNPBTJN-SDXDJHTJSA-N 2 0 342.527 4.233 20 0 EIADRP Cc1nccn1-c1ccc([C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000347913516 1045000273 /nfs/dbraw/zinc/00/02/73/1045000273.db2.gz AEMWYYDXMLOGKU-ZWKOTPCHSA-N 2 0 340.515 4.096 20 0 EIADRP c1ccc(CN2CC(C[NH2+]C3CCC(c4ccccc4)CC3)C2)cc1 ZINC000716273312 1045001359 /nfs/dbraw/zinc/00/13/59/1045001359.db2.gz WGJIOOBEVKMZRZ-UHFFFAOYSA-N 2 0 334.507 4.434 20 0 EIADRP C[C@H]([NH2+]CCN1CCCC[C@H]1C)[C@H](C)c1nc2ccccc2s1 ZINC000474479563 1045021929 /nfs/dbraw/zinc/02/19/29/1045021929.db2.gz YFBHHQZIWDXNKF-PMPSAXMXSA-N 2 0 331.529 4.252 20 0 EIADRP CC(C)C[NH+]1CCC([NH2+][C@H]2CC=C(c3ccc(F)cc3)CC2)CC1 ZINC000495415804 1045068575 /nfs/dbraw/zinc/06/85/75/1045068575.db2.gz UGVBWSRKAXXYGE-FQEVSTJZSA-N 2 0 330.491 4.472 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCC[NH+]2CCCC2)cc1)c1ccsc1 ZINC000509443742 1045175815 /nfs/dbraw/zinc/17/58/15/1045175815.db2.gz GEWSBRKFGSIKHK-MRXNPFEDSA-N 2 0 330.497 4.074 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@@H]1Cc2cccc(Cl)c2C1 ZINC001168741226 1045230449 /nfs/dbraw/zinc/23/04/49/1045230449.db2.gz XLFIOEUITOUGAD-OKZBNKHCSA-N 2 0 332.919 4.146 20 0 EIADRP COC[C@H](C)[NH2+]Cc1ccccc1-c1ccc(C[NH+]2CCCC2)cc1 ZINC000237239725 1045378634 /nfs/dbraw/zinc/37/86/34/1045378634.db2.gz OKFKYIASJAAMFX-SFHVURJKSA-N 2 0 338.495 4.074 20 0 EIADRP COc1ccc(C[NH2+]C2CC(C)(C)[NH2+]C(C)(C)C2)c2ccccc12 ZINC000237318833 1045381352 /nfs/dbraw/zinc/38/13/52/1045381352.db2.gz BGEDRYYYZUBLOR-UHFFFAOYSA-N 2 0 326.484 4.247 20 0 EIADRP C[C@@H](Cc1cccc(F)c1)[N@H+](C)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC001168498140 1045455388 /nfs/dbraw/zinc/45/53/88/1045455388.db2.gz QTXMWMNPGDULOT-GHTZIAJQSA-N 2 0 340.486 4.211 20 0 EIADRP C[NH2+]CC1CC[NH+](Cc2ccc(Br)cc2C(C)C)CC1 ZINC001235680327 1045492933 /nfs/dbraw/zinc/49/29/33/1045492933.db2.gz VZENYDBDHALMDP-UHFFFAOYSA-N 2 0 339.321 4.004 20 0 EIADRP C[NH+](C)CCC1CC[NH+](Cc2c(Cl)ccc3cccnc32)CC1 ZINC000054337869 1045573768 /nfs/dbraw/zinc/57/37/68/1045573768.db2.gz XQGXVKZQOVOEMN-UHFFFAOYSA-N 2 0 331.891 4.052 20 0 EIADRP COc1cccc([C@H](C)[NH2+]CC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000397495464 1045580435 /nfs/dbraw/zinc/58/04/35/1045580435.db2.gz ABMINAXQIDVBDW-SFHVURJKSA-N 2 0 338.495 4.258 20 0 EIADRP C[N@@H+]1CCCC[C@@H]1CC[NH+]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767874487 1045670105 /nfs/dbraw/zinc/67/01/05/1045670105.db2.gz FUWBUTWZHJRUHT-SJLPKXTDSA-N 2 0 340.433 4.369 20 0 EIADRP c1ccc(C[NH+]2CCCCC2)c(C[NH2+][C@@H]2CCOC3(CCCC3)C2)c1 ZINC000767929377 1045685294 /nfs/dbraw/zinc/68/52/94/1045685294.db2.gz OJBHJEQAOXZVLZ-OAQYLSRUSA-N 2 0 342.527 4.254 20 0 EIADRP CC[C@@H]([NH2+]CCC1CC[NH+](CC)CC1)c1ccc2c(c1)CCCO2 ZINC000768102975 1045715433 /nfs/dbraw/zinc/71/54/33/1045715433.db2.gz RYSMNVZCTGLBDP-HXUWFJFHSA-N 2 0 330.516 4.174 20 0 EIADRP C[C@H](CC(C)(C)c1ccccc1)[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459389386 1045833360 /nfs/dbraw/zinc/83/33/60/1045833360.db2.gz NKHFMQANSTWXPI-GOSISDBHSA-N 2 0 337.511 4.396 20 0 EIADRP CCn1cc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCCC[C@H]3C)cc2)cn1 ZINC000246946338 1045835685 /nfs/dbraw/zinc/83/56/85/1045835685.db2.gz HVBCAFDYUAKRLT-MSOLQXFVSA-N 2 0 340.515 4.128 20 0 EIADRP CCn1cc([C@@H](C)[NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@H]2C)cn1 ZINC000247015376 1045837501 /nfs/dbraw/zinc/83/75/01/1045837501.db2.gz LMFYQAPROZAPJH-QZTJIDSGSA-N 2 0 340.515 4.128 20 0 EIADRP c1ccc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H]([NH2+]CCC[C@@H]2CCCCO2)C3)cc1 ZINC000248887156 1045887722 /nfs/dbraw/zinc/88/77/22/1045887722.db2.gz MKPOAEWZMZTNDP-LRSLUSHPSA-N 2 0 342.527 4.121 20 0 EIADRP CC[C@@H]1C[C@@H]([N@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)CCO1 ZINC001170194964 1045934478 /nfs/dbraw/zinc/93/44/78/1045934478.db2.gz PHMNLCQJQTZKDF-XSDIEEQYSA-N 2 0 330.516 4.025 20 0 EIADRP C[C@H]([NH3+])c1ccc(-c2nc(-c3cccc(C[NH+]4CCCC4)c3)no2)cc1 ZINC000841826266 1046095131 /nfs/dbraw/zinc/09/51/31/1046095131.db2.gz GDYGLCCZGNCKEZ-HNNXBMFYSA-N 2 0 348.450 4.019 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](CCCOc2c(C)cccc2C)CC1 ZINC000496950060 1046112157 /nfs/dbraw/zinc/11/21/57/1046112157.db2.gz ITPDJGNUQWKMCE-UHFFFAOYSA-N 2 0 332.532 4.126 20 0 EIADRP C[C@@H]([NH2+]C[C@@H](C)Cc1cccs1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000508692942 1046324966 /nfs/dbraw/zinc/32/49/66/1046324966.db2.gz XMTQOQCIZQMNIP-NLWGTHIKSA-N 2 0 342.552 4.427 20 0 EIADRP CCc1ccc([C@@H](C)[NH2+]Cc2ccc(OCC[NH+](C)C)cc2)s1 ZINC000162524288 1046325082 /nfs/dbraw/zinc/32/50/82/1046325082.db2.gz MDUOYVLALMBPPX-OAHLLOKOSA-N 2 0 332.513 4.102 20 0 EIADRP Cc1cc([C@H](C)[NH2+]Cc2cccc(OCC[NH+](C)C)c2)c(C)s1 ZINC000162539987 1046329473 /nfs/dbraw/zinc/32/94/73/1046329473.db2.gz AGGDAGUGXZAFAX-HNNXBMFYSA-N 2 0 332.513 4.156 20 0 EIADRP COc1cc(C)cc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000508722039 1046422580 /nfs/dbraw/zinc/42/25/80/1046422580.db2.gz QUTGCHMSSXOLLZ-WIYYLYMNSA-N 2 0 338.495 4.004 20 0 EIADRP Cc1nc(-c2ccc(C)cc2)sc1[C@H](C)[NH2+]CC1CC[NH+](C)CC1 ZINC000126171621 1046452195 /nfs/dbraw/zinc/45/21/95/1046452195.db2.gz AHRAXOAROSRROI-HNNXBMFYSA-N 2 0 343.540 4.419 20 0 EIADRP C[NH+]1C(C)(C)CC(Nc2ccc([C@H]3CCCC[N@H+]3C)cn2)CC1(C)C ZINC001170450924 1046497541 /nfs/dbraw/zinc/49/75/41/1046497541.db2.gz OBTBFSKBBBBHEN-GOSISDBHSA-N 2 0 344.547 4.302 20 0 EIADRP Cc1[nH+]ccc(NC[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1Cl ZINC000497251756 1046516252 /nfs/dbraw/zinc/51/62/52/1046516252.db2.gz ZWHMYUZBWDUWEV-CXAGYDPISA-N 2 0 335.904 4.022 20 0 EIADRP CC(C)[N@H+](C)CC1CC[NH+](Cc2cc(Br)cs2)CC1 ZINC000536652998 1046596782 /nfs/dbraw/zinc/59/67/82/1046596782.db2.gz OEMFKUBEQITZJY-UHFFFAOYSA-N 2 0 345.350 4.063 20 0 EIADRP CC[N@H+](C[C@H]1C[C@H]1c1ccccc1)CC1CCN(c2ccccn2)CC1 ZINC000536661075 1046626812 /nfs/dbraw/zinc/62/68/12/1046626812.db2.gz WSLWEHBOAXVMTF-YADHBBJMSA-N 2 0 349.522 4.424 20 0 EIADRP C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]C1CCN(c2cc[nH+]cc2)CC1 ZINC000459434973 1046645910 /nfs/dbraw/zinc/64/59/10/1046645910.db2.gz VXFDHGLSCOKENP-VFNWGFHPSA-N 2 0 339.458 4.103 20 0 EIADRP Cc1cc([C@H]([NH2+]C2CCN(c3cc[nH+]cc3)CC2)C2CC2)ccc1F ZINC000459445967 1046677464 /nfs/dbraw/zinc/67/74/64/1046677464.db2.gz TVSFZBZYDCSETJ-OAQYLSRUSA-N 2 0 339.458 4.239 20 0 EIADRP C[N@@H+](Cc1csc(-c2ccc(Cl)cc2)n1)CC1CC[NH+](C)CC1 ZINC000536682958 1046683132 /nfs/dbraw/zinc/68/31/32/1046683132.db2.gz CYIAGKSKOVCIDB-UHFFFAOYSA-N 2 0 349.931 4.237 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]CCCOc2ccccc2)CCN1Cc1ccccc1 ZINC000379624691 1046715099 /nfs/dbraw/zinc/71/50/99/1046715099.db2.gz JRDUVMUTZSYSOT-CTNGQTDRSA-N 2 0 338.495 4.098 20 0 EIADRP CC[N@@H+](Cc1cccc(OC)c1)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000536711383 1046720704 /nfs/dbraw/zinc/72/07/04/1046720704.db2.gz TZGQVIYUNRGPAH-OAQYLSRUSA-N 2 0 338.495 4.039 20 0 EIADRP COc1ccc(-c2ccccc2C)cc1C[NH2+][C@@H]1CCc2nc[nH]c2C1 ZINC000459565615 1046785127 /nfs/dbraw/zinc/78/51/27/1046785127.db2.gz RHVOOLMCAMXZIF-GOSISDBHSA-N 2 0 347.462 4.041 20 0 EIADRP C[C@@H]([NH2+]CC1CCN(c2cc[nH+]cc2)CC1)c1cc2c(s1)CCC2 ZINC000536829305 1046800641 /nfs/dbraw/zinc/80/06/41/1046800641.db2.gz ZKDXRVBFNVXLKT-OAHLLOKOSA-N 2 0 341.524 4.199 20 0 EIADRP COc1ccc2c(c1)CCC[C@@H]2[NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000536836800 1046812075 /nfs/dbraw/zinc/81/20/75/1046812075.db2.gz BPFGVHQPWNFENJ-UWJYYQICSA-N 2 0 330.516 4.030 20 0 EIADRP COc1cccc2c1CC[C@H]2[NH2+]C1CCC([NH+]2CCC(C)CC2)CC1 ZINC000536831070 1046822746 /nfs/dbraw/zinc/82/27/46/1046822746.db2.gz FANHDSQNQSHTSP-WIXQSORDSA-N 2 0 342.527 4.315 20 0 EIADRP C[C@H](CCCc1cccnc1)[NH2+]C1CC[NH+]([C@H]2CCC[C@@H](C)C2)CC1 ZINC000459645829 1046831970 /nfs/dbraw/zinc/83/19/70/1046831970.db2.gz HOZDBUYPELEKMM-KNKQGSTJSA-N 2 0 343.559 4.426 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]Cc2ccc(-c3ccc(OC)cc3)cc2)[C@@H](C)C1 ZINC000536874168 1046836961 /nfs/dbraw/zinc/83/69/61/1046836961.db2.gz CJHDNVFGNKGAKV-JTSKRJEESA-N 2 0 338.495 4.182 20 0 EIADRP CC[N@@H+]1CC[C@H]([NH2+]CC(C)(C)c2c(F)cccc2Cl)[C@H](C)C1 ZINC000536875846 1046839150 /nfs/dbraw/zinc/83/91/50/1046839150.db2.gz JFKJRTMHLMEYDP-CJNGLKHVSA-N 2 0 326.887 4.077 20 0 EIADRP CC(C)[C@@H]([NH2+]Cc1cccc(C[NH+]2CCCC2)c1)c1ccc(F)cn1 ZINC000497544618 1046853891 /nfs/dbraw/zinc/85/38/91/1046853891.db2.gz FLUIQQDPYJQRHJ-OAQYLSRUSA-N 2 0 341.474 4.303 20 0 EIADRP COc1cccc2c1C[C@H]([NH2+][C@@H](C)c1ccc(-n3ccnc3C)cc1)C2 ZINC000459722638 1046863726 /nfs/dbraw/zinc/86/37/26/1046863726.db2.gz IDSVSYGRCBUHQY-HNAYVOBHSA-N 2 0 347.462 4.007 20 0 EIADRP C[C@@H](C[NH2+]CC[C@@H]1CCC[N@H+](C)C1)c1ccc(C(F)(F)F)cc1 ZINC000459725130 1046865641 /nfs/dbraw/zinc/86/56/41/1046865641.db2.gz BATFYJPYBJRHIE-GJZGRUSLSA-N 2 0 328.422 4.130 20 0 EIADRP COc1ccc(C2CCC([NH2+]CC[C@@H]3CCC[N@H+](C)C3)CC2)cc1 ZINC000459725080 1046865820 /nfs/dbraw/zinc/86/58/20/1046865820.db2.gz AYOLLYISDSTCGB-ZJRDLVKKSA-N 2 0 330.516 4.043 20 0 EIADRP C(=C/c1ccc(OCc2ccccc2)cc1)\C[NH2+][C@H]1CCC[NH2+]CC1 ZINC000666858095 1047010344 /nfs/dbraw/zinc/01/03/44/1047010344.db2.gz WTFDOFJTMUVMFY-VPVJOJIASA-N 2 0 336.479 4.011 20 0 EIADRP CC(C)[N@H+](C)Cc1cccc(C[NH2+][C@H]2CCc3nc(Cl)ccc32)c1 ZINC000806134324 1047131812 /nfs/dbraw/zinc/13/18/12/1047131812.db2.gz JMDSWACYQSNAKM-SFHVURJKSA-N 2 0 343.902 4.352 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[N@@H+]2CCCC[C@H]2C)cc1)c1cc[nH]c(=O)c1 ZINC000788525005 1047201709 /nfs/dbraw/zinc/20/17/09/1047201709.db2.gz AEIGLMZUEHZTQM-SJORKVTESA-N 2 0 339.483 4.012 20 0 EIADRP CC[NH+](CC)CCC[N@@H+]1CCCCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000788482682 1047214355 /nfs/dbraw/zinc/21/43/55/1047214355.db2.gz QLFJBWRDWADLMA-QZTJIDSGSA-N 2 0 338.561 4.148 20 0 EIADRP Clc1ccccc1C[C@H]([NH2+]C1CC[NH+](CC2CC2)CC1)C1CC1 ZINC000556060338 1047427399 /nfs/dbraw/zinc/42/73/99/1047427399.db2.gz DLNQOUSMYCILKU-FQEVSTJZSA-N 2 0 332.919 4.125 20 0 EIADRP C[C@H]1CC[C@H]([NH+]2CCC([NH3+])(Cc3ccccc3C(F)(F)F)CC2)C1 ZINC001170121537 1047482026 /nfs/dbraw/zinc/48/20/26/1047482026.db2.gz MXHWNUBAXLWJRZ-HOCLYGCPSA-N 2 0 340.433 4.230 20 0 EIADRP C[C@H]1CC[C@@H]([NH+]2CCC([NH3+])(Cc3ccccc3C(F)(F)F)CC2)C1 ZINC001170121536 1047482415 /nfs/dbraw/zinc/48/24/15/1047482415.db2.gz MXHWNUBAXLWJRZ-GOEBONIOSA-N 2 0 340.433 4.230 20 0 EIADRP C[C@H]([NH2+][C@@H]1CCN(C2CC2)[C@@H](c2ccccc2)C1)c1cncs1 ZINC000897931038 1047500125 /nfs/dbraw/zinc/50/01/25/1047500125.db2.gz VABOCWNQNJKYNJ-YXJHDRRASA-N 2 0 327.497 4.162 20 0 EIADRP C[C@@H]1CCC[C@H]([NH+]2CCC([NH2+]C[C@@H]3C[C@H]3c3ccccc3)CC2)C1 ZINC000556240190 1047606263 /nfs/dbraw/zinc/60/62/63/1047606263.db2.gz HEPGOVRULGYWMY-HQMSXXKGSA-N 2 0 326.528 4.423 20 0 EIADRP C[NH+](C)C1CCC([NH2+]Cc2ccc(C(F)(F)F)c(Cl)c2)CC1 ZINC001168298300 1047673577 /nfs/dbraw/zinc/67/35/77/1047673577.db2.gz LJKDESHWHRPISL-UHFFFAOYSA-N 2 0 334.813 4.321 20 0 EIADRP C[NH+](C)C1CCC([NH2+]CCCc2ccc(C(F)(F)F)cc2)CC1 ZINC001168298501 1047676412 /nfs/dbraw/zinc/67/64/12/1047676412.db2.gz XTGQOVJUVIKIOD-UHFFFAOYSA-N 2 0 328.422 4.100 20 0 EIADRP CC[C@H]1CCC[C@H]([NH2+]Cc2ccc(OC3CC[NH+](C)CC3)cc2)C1 ZINC000556408866 1047739780 /nfs/dbraw/zinc/73/97/80/1047739780.db2.gz HKGJGRUBRUMSHW-HKUYNNGSSA-N 2 0 330.516 4.218 20 0 EIADRP CC[C@H]([NH2+]CCC1CC[NH+](C)CC1)c1cccc(Br)c1 ZINC000130626433 1047755989 /nfs/dbraw/zinc/75/59/89/1047755989.db2.gz XOMIKMMODPLXSS-KRWDZBQOSA-N 2 0 339.321 4.222 20 0 EIADRP C[NH+](C)C1CCC([NH2+][C@@H]2CCc3ccc(C(F)(F)F)cc32)CC1 ZINC001168305713 1047778306 /nfs/dbraw/zinc/77/83/06/1047778306.db2.gz LCKDQBQSANGDQL-VMBOVVBDSA-N 2 0 326.406 4.155 20 0 EIADRP COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCC[N@@H+]2CCCC[C@H]2C)cc1 ZINC000556589890 1047834870 /nfs/dbraw/zinc/83/48/70/1047834870.db2.gz QPMLMMWPJMIJCC-DEPWHIHDSA-N 2 0 330.516 4.041 20 0 EIADRP CC[C@@H]1C[C@@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CCO1 ZINC000824427273 1047867027 /nfs/dbraw/zinc/86/70/27/1047867027.db2.gz IBKWJSGEUFDBAW-BLNMYQONSA-N 2 0 342.527 4.119 20 0 EIADRP CC[C@@H]1C[C@H]([NH2+]C2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CCO1 ZINC000824427276 1047867980 /nfs/dbraw/zinc/86/79/80/1047867980.db2.gz IBKWJSGEUFDBAW-SPVGOVNVSA-N 2 0 342.527 4.119 20 0 EIADRP Clc1cc(Cl)c2c(c1)CC[C@@H]([NH2+]CCCC[NH+]1CCCC1)C2 ZINC001171064139 1047916403 /nfs/dbraw/zinc/91/64/03/1047916403.db2.gz RALSFKNCSYUTGM-MRXNPFEDSA-N 2 0 341.326 4.316 20 0 EIADRP C[C@@H]1CCCC[C@@H]1[NH+]1CCC([NH2+]C[C@]2(C)CC2(Cl)Cl)CC1 ZINC000824771244 1047924655 /nfs/dbraw/zinc/92/46/55/1047924655.db2.gz AJLTYERRRZYLLC-KBMXLJTQSA-N 2 0 333.347 4.203 20 0 EIADRP C[C@@H]1CCC[C@@H]([NH+]2CCC([NH2+]C[C@]3(C)CC3(Cl)Cl)CC2)C1 ZINC000824773952 1047925708 /nfs/dbraw/zinc/92/57/08/1047925708.db2.gz PJOOTBHUOGUAEB-BMFZPTHFSA-N 2 0 333.347 4.203 20 0 EIADRP CC1(C)[C@@H]2C[C@@H]([NH+]3CCC([NH3+])(Cc4ccccc4Cl)CC3)C[C@@H]21 ZINC001170740186 1047951209 /nfs/dbraw/zinc/95/12/09/1047951209.db2.gz VGDSYHAFEBHYAQ-OSYLJGHBSA-N 2 0 332.919 4.110 20 0 EIADRP CC1(C)[C@@H]2C[C@H]([N@H+](Cc3cccc(F)c3)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170739311 1047968402 /nfs/dbraw/zinc/96/84/02/1047968402.db2.gz RXTVZKJUPKXCGS-CCQCEHTISA-N 2 0 330.491 4.332 20 0 EIADRP CC1(C)[C@@H]2C[C@@H]([N@H+](Cc3cccc(F)c3)[C@H]3CC[C@H]([NH3+])CC3)C[C@@H]21 ZINC001170739312 1047969419 /nfs/dbraw/zinc/96/94/19/1047969419.db2.gz RXTVZKJUPKXCGS-DHUDUYKCSA-N 2 0 330.491 4.332 20 0 EIADRP C[N@H+](Cc1ccco1)[C@@H]1CCC12CC[NH+]([C@@H]1C[C@@H]3[C@H](C1)C3(C)C)CC2 ZINC001170752381 1048066138 /nfs/dbraw/zinc/06/61/38/1048066138.db2.gz IMINEGUHDLPFIH-RSPOEFSDSA-N 2 0 342.527 4.391 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)c1ccc(OC(F)(F)F)cc1 ZINC000556857802 1048075810 /nfs/dbraw/zinc/07/58/10/1048075810.db2.gz HMYRKBIAFRQBKG-GUYCJALGSA-N 2 0 342.405 4.110 20 0 EIADRP COc1ccc([C@@H](C)[NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c(C)c1OC ZINC000556871738 1048090316 /nfs/dbraw/zinc/09/03/16/1048090316.db2.gz WSCZTVCTFHVERA-QAPCUYQASA-N 2 0 336.520 4.029 20 0 EIADRP C[C@H](C[NH2+][C@@H]1CC[N@H+](C)[C@@H]2CCC[C@H]21)c1ccc(C(F)(F)F)cc1 ZINC000556890739 1048132391 /nfs/dbraw/zinc/13/23/91/1048132391.db2.gz RQUCCLGEJLYEIC-BVPBIZIASA-N 2 0 340.433 4.271 20 0 EIADRP Cc1cc(C[NH2+][C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)ccc1F ZINC000499153133 1048359724 /nfs/dbraw/zinc/35/97/24/1048359724.db2.gz RATKQDBEPBMDCM-MZADTFQBSA-N 2 0 338.470 4.419 20 0 EIADRP C[NH+]1CCC(C2CC[NH+]([C@@H]3CCc4cc(Cl)ccc4C3)CC2)CC1 ZINC001171128241 1048360027 /nfs/dbraw/zinc/36/00/27/1048360027.db2.gz FXHUOHWAZRTLEP-OAQYLSRUSA-N 2 0 346.946 4.251 20 0 EIADRP C[NH+](C)Cc1ccc(C[N@H+](C)Cc2cc(F)cc3cccnc32)cc1 ZINC000809738865 1048510090 /nfs/dbraw/zinc/51/00/90/1048510090.db2.gz NFIRKODCCMOSIP-UHFFFAOYSA-N 2 0 337.442 4.068 20 0 EIADRP CC(C)OCc1ccccc1C[NH2+][C@@H](CCC[NH3+])c1ccccc1 ZINC000925479369 1048643509 /nfs/dbraw/zinc/64/35/09/1048643509.db2.gz GQHZQDJNVYCDGY-NRFANRHFSA-N 2 0 326.484 4.181 20 0 EIADRP COCc1ccccc1/C=C(/C)C[N@@H+]1CCCC2(CC[NH+](C)CC2)C1 ZINC000816598702 1048840926 /nfs/dbraw/zinc/84/09/26/1048840926.db2.gz MUNIRBODMVBASH-CYVLTUHYSA-N 2 0 342.527 4.044 20 0 EIADRP [NH3+][C@@H]1CCC[C@H]1[NH2+]CCCN1c2ccccc2Sc2ccccc21 ZINC000817912694 1049057723 /nfs/dbraw/zinc/05/77/23/1049057723.db2.gz RDJXATOOSPLVSU-HZPDHXFCSA-N 2 0 339.508 4.149 20 0 EIADRP c1ccc([C@@H]2CC[C@H]([NH2+][C@@H]3C[C@]4(CC[NH2+]C4)Oc4ccccc43)C2)cc1 ZINC000817913946 1049059427 /nfs/dbraw/zinc/05/94/27/1049059427.db2.gz TWJKWCBTVKPCLY-XZYOPWHXSA-N 2 0 348.490 4.168 20 0 EIADRP [NH3+][C@H]1CCC[C@H]1[NH2+]CCCN1c2ccccc2Sc2ccccc21 ZINC000817912724 1049059730 /nfs/dbraw/zinc/05/97/30/1049059730.db2.gz RDJXATOOSPLVSU-JKSUJKDBSA-N 2 0 339.508 4.149 20 0 EIADRP CC[C@H]([NH2+]Cc1ccc(CC[NH3+])cc1)c1cccc(Br)c1 ZINC000817946902 1049061303 /nfs/dbraw/zinc/06/13/03/1049061303.db2.gz HMUWJBKGNFNQNQ-SFHVURJKSA-N 2 0 347.300 4.191 20 0 EIADRP COc1ccc([C@H](C)[NH2+]Cc2ccc(CC[NH3+])cc2)c2ccccc12 ZINC000817948735 1049064607 /nfs/dbraw/zinc/06/46/07/1049064607.db2.gz KUGVNZLTIGIBAK-INIZCTEOSA-N 2 0 334.463 4.200 20 0 EIADRP Cc1ccc2[nH]c3c(c2c1)CCC[C@@H]3[NH2+]Cc1ccc(CC[NH3+])cc1 ZINC000817950144 1049066110 /nfs/dbraw/zinc/06/61/10/1049066110.db2.gz WVYVIRIHPSGJIH-NRFANRHFSA-N 2 0 333.479 4.145 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc2c(c1)C[NH2+]C2)c1cc(Cl)c(N)c(Cl)c1 ZINC000817969442 1049072704 /nfs/dbraw/zinc/07/27/04/1049072704.db2.gz VAPIJUGWBUXALG-SNVBAGLBSA-N 2 0 336.266 4.030 20 0 EIADRP COc1cc([C@H](C)[NH2+]CCC[C@@H]2CCC[NH2+]2)ccc1SC(F)F ZINC000817980992 1049077137 /nfs/dbraw/zinc/07/71/37/1049077137.db2.gz OSSRBKKESGROKV-GXTWGEPZSA-N 2 0 344.471 4.193 20 0 EIADRP Cc1c([C@@H](C)[NH2+][C@@H](CCC[NH3+])c2ccccc2)cnn1-c1ccccc1 ZINC000817981781 1049077859 /nfs/dbraw/zinc/07/78/59/1049077859.db2.gz NPORQOQAJFWIML-VGSWGCGISA-N 2 0 348.494 4.312 20 0 EIADRP Fc1ccc(CC[NH2+]C2CCC([NH+]3CCCCC3)CC2)c(Cl)c1 ZINC000811483144 1049080606 /nfs/dbraw/zinc/08/06/06/1049080606.db2.gz COSRFMZKCIAEMY-UHFFFAOYSA-N 2 0 338.898 4.408 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]C[C@H](O)c1cccc2ccccc21 ZINC000818959516 1049226125 /nfs/dbraw/zinc/22/61/25/1049226125.db2.gz NCSDLOIGDCRBRU-GCJKJVERSA-N 2 0 340.511 4.117 20 0 EIADRP CC(C)CCn1cccc1C[NH2+]Cc1ccc(C[NH+](C)C)c(F)c1 ZINC000136065668 1049318556 /nfs/dbraw/zinc/31/85/56/1049318556.db2.gz SDAGRNQRVKSFEP-UHFFFAOYSA-N 2 0 331.479 4.025 20 0 EIADRP CCCC[NH+]1CCC([N@H+](C)[C@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170942978 1049424182 /nfs/dbraw/zinc/42/41/82/1049424182.db2.gz IJJMCQILPDLKFN-SFHVURJKSA-N 2 0 334.935 4.394 20 0 EIADRP CCCC[NH+]1CCC([N@H+](C)[C@@H]2CCc3cccc(Cl)c3C2)CC1 ZINC001170942977 1049424906 /nfs/dbraw/zinc/42/49/06/1049424906.db2.gz IJJMCQILPDLKFN-GOSISDBHSA-N 2 0 334.935 4.394 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@H]2CCc3cc(F)cc(F)c3C2)CC1 ZINC001170679991 1049509984 /nfs/dbraw/zinc/50/99/84/1049509984.db2.gz FLRMGJBJUPAUKA-WDSOQIARSA-N 2 0 348.481 4.337 20 0 EIADRP CC[NH+](CC)[C@H]1CC[C@@H]([NH2+][C@@H]2CCc3c(F)cc(F)cc3C2)CC1 ZINC001171359576 1049510155 /nfs/dbraw/zinc/51/01/55/1049510155.db2.gz FCVAHWPHBHCKKD-KURKYZTESA-N 2 0 336.470 4.065 20 0 EIADRP Cc1cnccc1O[C@@H]1CC[N@@H+]([C@H]2CCc3cccc(Cl)c3C2)C1 ZINC001170948039 1049515949 /nfs/dbraw/zinc/51/59/49/1049515949.db2.gz ZWBPCKOXDXKJEE-DLBZAZTESA-N 2 0 342.870 4.054 20 0 EIADRP c1c2ccccc2oc1C[NH2+]CC1CC[NH+](Cc2ccccc2)CC1 ZINC000195674544 1049530370 /nfs/dbraw/zinc/53/03/70/1049530370.db2.gz NPKFPRBZPMRFKS-UHFFFAOYSA-N 2 0 334.463 4.435 20 0 EIADRP CO[C@@H](C[NH2+][C@H](C)c1cccc(C[NH+](C)C)c1)c1ccccc1Cl ZINC000820820749 1049556682 /nfs/dbraw/zinc/55/66/82/1049556682.db2.gz AZRUDBDXTMPIPS-QRWLVFNGSA-N 2 0 346.902 4.440 20 0 EIADRP Fc1cccc2c1CC[C@@H]([NH2+]C1CC[NH+](C[C@H]3CC=CCC3)CC1)C2 ZINC001171419773 1049656584 /nfs/dbraw/zinc/65/65/84/1049656584.db2.gz UWLNMZPOMAETSC-FXAWDEMLSA-N 2 0 342.502 4.093 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](C2CCCC2)[C@@H]2CCc3cccc(F)c3C2)CC1 ZINC001170970684 1049683690 /nfs/dbraw/zinc/68/36/90/1049683690.db2.gz MGNUUCDWRBRMRU-BHIYHBOVSA-N 2 0 330.491 4.198 20 0 EIADRP C[C@@H](C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)CC(F)(F)F ZINC000716680020 1049701521 /nfs/dbraw/zinc/70/15/21/1049701521.db2.gz PKASZECXGJWRAE-SPUZQDLCSA-N 2 0 340.433 4.218 20 0 EIADRP Fc1cc2c(cc1F)C[C@@H]([NH2+]C1CC[NH+](CC3CCCC3)CC1)CC2 ZINC001171467438 1049724331 /nfs/dbraw/zinc/72/43/31/1049724331.db2.gz VFXTUBGIJGSVBQ-IBGZPJMESA-N 2 0 348.481 4.066 20 0 EIADRP Fc1cccc2c1C[C@H]([NH2+]C1CC[NH+](C[C@H]3CC=CCC3)CC1)CC2 ZINC001170978747 1049737429 /nfs/dbraw/zinc/73/74/29/1049737429.db2.gz ZSNGQTJUJGMKNR-FXAWDEMLSA-N 2 0 342.502 4.093 20 0 EIADRP Cc1cccc2c1CC[C@H]([NH2+]CC1CC[NH+](C3CCCCC3)CC1)C2 ZINC001171554235 1049753963 /nfs/dbraw/zinc/75/39/63/1049753963.db2.gz YSCBYJLXBSTSRK-NRFANRHFSA-N 2 0 340.555 4.487 20 0 EIADRP C[N@@H+]1CCC[C@H]1C[C@@H]1CCCC[NH+]1[C@H]1CCc2cc(F)cc(F)c2C1 ZINC001170706773 1049775487 /nfs/dbraw/zinc/77/54/87/1049775487.db2.gz MACDXJRERGAPMZ-FHWLQOOXSA-N 2 0 348.481 4.161 20 0 EIADRP Cc1ccc(CC[C@H](C)[NH+]2CCC([NH+]3CCC(F)CC3)CC2)cc1 ZINC001171680083 1049777074 /nfs/dbraw/zinc/77/70/74/1049777074.db2.gz PFOJONAANTUGCJ-SFHVURJKSA-N 2 0 332.507 4.214 20 0 EIADRP C[NH+]1C(C)(C)CC([NH+]2CCC3(CC2)OCc2ccccc23)CC1(C)C ZINC001171637392 1049779077 /nfs/dbraw/zinc/77/90/77/1049779077.db2.gz LYMMNLDDKIUDJZ-UHFFFAOYSA-N 2 0 342.527 4.159 20 0 EIADRP C[C@H]1C[C@@H](n2c3ccccc3c3c2CC[NH2+]C3)C[N@@H+]1Cc1ccccc1 ZINC001171758562 1049790293 /nfs/dbraw/zinc/79/02/93/1049790293.db2.gz YFEPCTJRVFZIBL-PKOBYXMFSA-N 2 0 345.490 4.123 20 0 EIADRP C[C@]1(C[NH2+][C@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)CCCS1 ZINC000245686791 1049825666 /nfs/dbraw/zinc/82/56/66/1049825666.db2.gz JQRNVYDRXVKTCH-IYWMVGAKSA-N 2 0 330.541 4.057 20 0 EIADRP CCCC[N@H+](C)CCCN[C@H]1CC[NH+](Cc2ccccc2)C(C)(C)C1 ZINC001171964540 1049826367 /nfs/dbraw/zinc/82/63/67/1049826367.db2.gz GTLKQKJBUPOLHO-NRFANRHFSA-N 2 0 345.575 4.141 20 0 EIADRP C[NH+](C)Cc1cccc(C[NH2+][C@@H]2CCc3c(Cl)cccc3C2)c1 ZINC001171010710 1049829652 /nfs/dbraw/zinc/82/96/52/1049829652.db2.gz BTFQXYCYBQIYRN-GOSISDBHSA-N 2 0 328.887 4.049 20 0 EIADRP CC1(C)C[C@@H]([NH+]2CCC[C@@H](C(F)F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171988793 1049831620 /nfs/dbraw/zinc/83/16/20/1049831620.db2.gz VRFUJMDJBBDNMD-MSOLQXFVSA-N 2 0 336.470 4.407 20 0 EIADRP CC1(C)C[C@@H]([NH+]2CCC[C@H](C(F)F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171988795 1049832043 /nfs/dbraw/zinc/83/20/43/1049832043.db2.gz VRFUJMDJBBDNMD-ROUUACIJSA-N 2 0 336.470 4.407 20 0 EIADRP CC1(C)C[C@H]([NH2+]CCC2(O)CCCCC2)CC[N@@H+]1Cc1ccccc1 ZINC001171969752 1049833980 /nfs/dbraw/zinc/83/39/80/1049833980.db2.gz WHPGEHBALYKVJW-HXUWFJFHSA-N 2 0 344.543 4.105 20 0 EIADRP CN(Cc1cccc(O)c1)[C@@H]1CC[N@H+](Cc2ccccc2)C(C)(C)C1 ZINC001171977941 1049837707 /nfs/dbraw/zinc/83/77/07/1049837707.db2.gz VDCQOBDGOOEIFR-HXUWFJFHSA-N 2 0 338.495 4.267 20 0 EIADRP CC1(C)C[C@@H]([NH+]2C[C@H]3[C@H](CCC3(F)F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171983630 1049838563 /nfs/dbraw/zinc/83/85/63/1049838563.db2.gz ZFXWOYZGPWQWFI-QYZOEREBSA-N 2 0 348.481 4.407 20 0 EIADRP CC1(C)C[C@@H](n2cnc3ccc(C[NH3+])cc32)CC[N@@H+]1Cc1ccccc1 ZINC001171984369 1049840786 /nfs/dbraw/zinc/84/07/86/1049840786.db2.gz VDWURTKYANVWHT-IBGZPJMESA-N 2 0 348.494 4.111 20 0 EIADRP CC1(C)C[C@@H]([NH+]2CC[C@@H](C(F)(F)F)C2)CC[N@@H+]1Cc1ccccc1 ZINC001171987848 1049840960 /nfs/dbraw/zinc/84/09/60/1049840960.db2.gz KOOYREGVYRUNKH-SJORKVTESA-N 2 0 340.433 4.314 20 0 EIADRP C[N@H+]1[C@@H]2CCC[C@H]1C[C@H]([NH2+]CC(c1ccccc1)c1ccccc1)C2 ZINC001172101360 1049849513 /nfs/dbraw/zinc/84/95/13/1049849513.db2.gz ZHQAVWTVTQJPKF-DKUWSORSSA-N 2 0 334.507 4.423 20 0 EIADRP F[C@@H]1CCC[C@H]1C[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172067763 1049851044 /nfs/dbraw/zinc/85/10/44/1049851044.db2.gz NRWYAYXCTPVMCF-ALGQRKQJSA-N 2 0 330.491 4.300 20 0 EIADRP FC1(F)CC[C@@H]([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)C1 ZINC001172068230 1049851438 /nfs/dbraw/zinc/85/14/38/1049851438.db2.gz PSESVDKMJHPNCN-AKHDSKFASA-N 2 0 334.454 4.350 20 0 EIADRP FC1CCC([NH2+][C@H]2C[C@H]3CCC[C@@H](C2)[N@H+]3Cc2ccccc2)CC1 ZINC001172069822 1049852354 /nfs/dbraw/zinc/85/23/54/1049852354.db2.gz XVPIOUWFWIHORO-ZHLPAPNQSA-N 2 0 330.491 4.442 20 0 EIADRP CCCCOCCC[NH2+][C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172069171 1049853344 /nfs/dbraw/zinc/85/33/44/1049853344.db2.gz HEJHANVYWJWKLN-DKUWSORSSA-N 2 0 344.543 4.369 20 0 EIADRP C[N@H+](Cc1cccc(OC(F)(F)F)c1)[C@H]1C[C@H]2CCC[C@@H](C1)[NH+]2C ZINC001172133276 1049854286 /nfs/dbraw/zinc/85/42/86/1049854286.db2.gz QWSRSCYICAQJPO-ZSHCYNCHSA-N 2 0 342.405 4.032 20 0 EIADRP CN1[C@@H]2CCC[C@H]1C[C@H]([NH2+][C@H]1CC[C@@H](OCc3ccccc3)CC1)C2 ZINC001172110374 1049857742 /nfs/dbraw/zinc/85/77/42/1049857742.db2.gz LRLYPNARXJVHFH-YPHBOWRQSA-N 2 0 342.527 4.119 20 0 EIADRP CC(C)C[C@@H]([NH3+])c1nc2ccccc2n1[C@@H]1C[C@H]2CCC[C@@H](C1)[N@H+]2C ZINC001172118826 1049858184 /nfs/dbraw/zinc/85/81/84/1049858184.db2.gz TVWVLNATGRGVMY-XMTFNYHQSA-N 2 0 340.515 4.270 20 0 EIADRP Cc1ccc2c(C[C@@H](C)[NH3+])cn([C@@H]3C[C@H]4CCC[C@@H](C3)[N@H+]4C)c2c1 ZINC001172113281 1049858517 /nfs/dbraw/zinc/85/85/17/1049858517.db2.gz BTLIXCVKTDMHAZ-OQIJWPOYSA-N 2 0 325.500 4.027 20 0 EIADRP c1ccc2c(c1)C[C@@H]([N@H+]1CCCC[C@@H]1CC[NH+]1CCCC1)CS2 ZINC001172203696 1049863578 /nfs/dbraw/zinc/86/35/78/1049863578.db2.gz VDCHGTQUHDFXGG-RTBURBONSA-N 2 0 330.541 4.044 20 0 EIADRP CCC(CC)[NH+]1CCC(C[NH2+][C@@H]2CSc3ccccc3C2)CC1 ZINC001172199290 1049869278 /nfs/dbraw/zinc/86/92/78/1049869278.db2.gz VASSACMKFDZHDJ-SFHVURJKSA-N 2 0 332.557 4.194 20 0 EIADRP CCCCC[C@@H]([NH2+]C1CC[NH+](CCCOC)CC1)c1ccccc1 ZINC001172248593 1049872368 /nfs/dbraw/zinc/87/23/68/1049872368.db2.gz BZLRZZUSMDPRKQ-OAQYLSRUSA-N 2 0 332.532 4.399 20 0 EIADRP CC(C)c1noc([C@@H](C)N2CCC(CC[N@@H+]3CCCC[C@H]3C)CC2)n1 ZINC000246007586 1049890957 /nfs/dbraw/zinc/89/09/57/1049890957.db2.gz KNIWRHUSJMSJET-IAGOWNOFSA-N 2 0 348.535 4.231 20 0 EIADRP CC(C)OCC[C@H](C)[N@H+](Cc1ccc(F)cc1)[C@H]1CC[C@H]([NH3+])CC1 ZINC001172444486 1049913382 /nfs/dbraw/zinc/91/33/82/1049913382.db2.gz LEXHEBVHWJASHY-VDGAXYAQSA-N 2 0 336.495 4.101 20 0 EIADRP CC(C)COCC[C@H](C)[NH2+][C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001172465282 1049918661 /nfs/dbraw/zinc/91/86/61/1049918661.db2.gz UJBSFTWZEPADIM-JKLQHZFJSA-N 2 0 344.543 4.223 20 0 EIADRP [NH3+][C@H]1CC[C@H]([N@H+](Cc2ccccn2)[C@@H]2CC[C@@H](c3ccccc3)C2)CC1 ZINC001172555940 1049931548 /nfs/dbraw/zinc/93/15/48/1049931548.db2.gz KNQQUBWPGKXMBJ-OHUMZHCVSA-N 2 0 349.522 4.490 20 0 EIADRP c1ccc([C@@H]2CC[C@H]([NH2+]CC3CC[NH+](Cc4ccccn4)CC3)C2)cc1 ZINC001172557369 1049932259 /nfs/dbraw/zinc/93/22/59/1049932259.db2.gz PEBRNVKXJKUXFT-YADHBBJMSA-N 2 0 349.522 4.220 20 0 EIADRP C[C@@H](CCc1c(F)cc(Cl)cc1F)[NH2+]CC(C)(C)C[NH+](C)C ZINC001172566416 1049935902 /nfs/dbraw/zinc/93/59/02/1049935902.db2.gz DNTAUVSRVYSHGF-LBPRGKRZSA-N 2 0 332.866 4.117 20 0 EIADRP C[C@H](CCc1c(F)cc(Cl)cc1F)[NH2+]C1CCC(CC[NH3+])CC1 ZINC001172574596 1049941528 /nfs/dbraw/zinc/94/15/28/1049941528.db2.gz FAASKTJWMOYTNN-DNOWBOINSA-N 2 0 344.877 4.437 20 0 EIADRP [NH3+]C1(Cc2ccccn2)CC[NH+]([C@H]2CCC[C@@H](c3ccccc3)C2)CC1 ZINC001172537674 1049944032 /nfs/dbraw/zinc/94/40/32/1049944032.db2.gz UAINSMKTHDSHJZ-IRLDBZIGSA-N 2 0 349.522 4.144 20 0 EIADRP CC[C@H]1CC[C@H](C2CCC([NH+]3CCN(CCCC[NH3+])CC3)CC2)CC1 ZINC001172587474 1049952820 /nfs/dbraw/zinc/95/28/20/1049952820.db2.gz LYQXFBFLTRAMQI-IJDVVPKISA-N 2 0 349.607 4.118 20 0 EIADRP C[N@H+](C[C@@H]1CC[NH+](Cc2ccccc2)C1)C1CC(C)(C)OC(C)(C)C1 ZINC001172658885 1049958266 /nfs/dbraw/zinc/95/82/66/1049958266.db2.gz GKZXFLJVAXQIBF-IBGZPJMESA-N 2 0 344.543 4.177 20 0 EIADRP Clc1ccc2c(c1)C[C@@H]([NH2+]CC1CC[NH+](CC3CCCC3)CC1)C2 ZINC001172717176 1049964249 /nfs/dbraw/zinc/96/42/49/1049964249.db2.gz RAQKFMWIIQTCMY-NRFANRHFSA-N 2 0 346.946 4.299 20 0 EIADRP CCC(CC)[NH+]1CCC(C[NH2+][C@H]2Cc3ccc(Cl)cc3C2)CC1 ZINC001172718382 1049965271 /nfs/dbraw/zinc/96/52/71/1049965271.db2.gz VBFXIXVCUIRATN-IBGZPJMESA-N 2 0 334.935 4.297 20 0 EIADRP Cc1cncc([C@H](C)[NH2+]Cc2ccc(C[N@@H+]3CCC[C@@H](C)C3)cc2)c1 ZINC000248754482 1050076631 /nfs/dbraw/zinc/07/66/31/1050076631.db2.gz UWRVKOANJQPJJY-MJGOQNOKSA-N 2 0 337.511 4.473 20 0 EIADRP C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2-c2ccc(C[NH+](C)C)cc2)CCO1 ZINC001177213748 1050163215 /nfs/dbraw/zinc/16/32/15/1050163215.db2.gz HBLWHYUJLPDJPY-UTKZUKDTSA-N 2 0 338.495 4.072 20 0 EIADRP Cc1ccc2c(c1)C[C@H]([NH2+]CC1CC[NH+](C3CCCCC3)CC1)CC2 ZINC001172837217 1050170888 /nfs/dbraw/zinc/17/08/88/1050170888.db2.gz YZVXFCPOBCPVOV-JOCHJYFZSA-N 2 0 340.555 4.487 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2cccc(C)c2F)cc1 ZINC001177295213 1050179447 /nfs/dbraw/zinc/17/94/47/1050179447.db2.gz ZLZHSNAEEZSLLD-UHFFFAOYSA-N 2 0 344.474 4.145 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1CCCC[NH2+]Cc1c(F)ccc(F)c1Cl ZINC001177299325 1050181001 /nfs/dbraw/zinc/18/10/01/1050181001.db2.gz OWVYYCLFNDFUKD-CYBMUJFWSA-N 2 0 330.850 4.362 20 0 EIADRP C[C@H](Cc1c(F)cccc1Cl)[NH2+]CCc1ccc(C[NH+](C)C)cc1 ZINC001172843403 1050182422 /nfs/dbraw/zinc/18/24/22/1050182422.db2.gz WBJOGSOOEJAEEX-OAHLLOKOSA-N 2 0 348.893 4.304 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+]C/C=C/c1cccc(F)c1 ZINC001177277633 1050185643 /nfs/dbraw/zinc/18/56/43/1050185643.db2.gz MMMMAQVIWXRCNU-VQHVLOKHSA-N 2 0 326.459 4.469 20 0 EIADRP CCc1nc2c(s1)[C@@H]([NH2+]C[C@@H]1CCC[N@H+](CC(C)C)C1)CCC2 ZINC000090586928 1050188076 /nfs/dbraw/zinc/18/80/76/1050188076.db2.gz RQXDKKINSMBAAX-HOTGVXAUSA-N 2 0 335.561 4.041 20 0 EIADRP C[C@@H](Cc1ccc(F)cc1Cl)[NH+]1C(C)(C)CC([NH3+])CC1(C)C ZINC001172860431 1050198950 /nfs/dbraw/zinc/19/89/50/1050198950.db2.gz CVUBMNMWQGUDRV-LBPRGKRZSA-N 2 0 326.887 4.390 20 0 EIADRP C[C@H](CSc1ccc(Cl)cc1)[NH2+][C@H]1CCC[C@H]([NH+](C)C)C1 ZINC001172878125 1050219497 /nfs/dbraw/zinc/21/94/97/1050219497.db2.gz INEYFFBTCPOGGA-KBMXLJTQSA-N 2 0 326.937 4.283 20 0 EIADRP CO[C@@H]1CCC[C@@H]([N@H+](Cc2ccc(C)cc2)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001172927988 1050237984 /nfs/dbraw/zinc/23/79/84/1050237984.db2.gz IETBPSYETATTOD-XRXFAXGQSA-N 2 0 330.516 4.025 20 0 EIADRP COc1ccccc1[C@@H]([NH2+]C[C@@H]1CC[N@@H+](C2CC2)C1)C1CCCC1 ZINC000091284474 1050247279 /nfs/dbraw/zinc/24/72/79/1050247279.db2.gz BSYNNMADZKSCCJ-KKSFZXQISA-N 2 0 328.500 4.000 20 0 EIADRP C([NH2+]C1CCC2(CCOCC2)CC1)C1CC[NH+](C2CCCCC2)CC1 ZINC001173040532 1050268528 /nfs/dbraw/zinc/26/85/28/1050268528.db2.gz GXFILZYHPBPFDR-UHFFFAOYSA-N 2 0 348.575 4.360 20 0 EIADRP CC[C@H](C[NH2+]C[C@H]1CC[N@H+](CCc2ccccc2)C1)c1ccccc1 ZINC001177668757 1050272769 /nfs/dbraw/zinc/27/27/69/1050272769.db2.gz CNHNQGRCNOUQAM-FGZHOGPDSA-N 2 0 336.523 4.334 20 0 EIADRP C(CC[NH2+][C@@H]1CCC[C@@H](C2CCOCC2)C1)CC[NH+]1CCCCC1 ZINC001177678992 1050276387 /nfs/dbraw/zinc/27/63/87/1050276387.db2.gz HYNOZCVLSHWUSY-NHCUHLMSSA-N 2 0 336.564 4.218 20 0 EIADRP CC[NH+](CC)C1CCC(n2c3ccccc3c3c2CC[C@H]([NH3+])C3)CC1 ZINC001173104572 1050304462 /nfs/dbraw/zinc/30/44/62/1050304462.db2.gz SBEFTFDXHOMXBX-AOCRQIFASA-N 2 0 339.527 4.283 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+][C@@H](C)COc2cc(C)cc(C)c2)CC1 ZINC001173102587 1050305894 /nfs/dbraw/zinc/30/58/94/1050305894.db2.gz AMYLZXGRPVMKHL-HDYDNRTBSA-N 2 0 332.532 4.313 20 0 EIADRP CCN(CC[NH2+]C1CCC([NH+](CC)CC)CC1)c1cccc(C)c1 ZINC001173106360 1050306786 /nfs/dbraw/zinc/30/67/86/1050306786.db2.gz UVCOGGZVMXDHTF-UHFFFAOYSA-N 2 0 331.548 4.064 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC(C(=O)c3ccccc3)CC2)CC1 ZINC001173108032 1050307644 /nfs/dbraw/zinc/30/76/44/1050307644.db2.gz BYKMWFIPRBYOHU-UHFFFAOYSA-N 2 0 342.527 4.234 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCc2ccc(F)cc2Cl)CC1 ZINC001173107057 1050307891 /nfs/dbraw/zinc/30/78/91/1050307891.db2.gz IZAGHHQBHGWLOA-UHFFFAOYSA-N 2 0 326.887 4.264 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CC[C@@H](c3ccccc3OC)C2)CC1 ZINC001173109048 1050307980 /nfs/dbraw/zinc/30/79/80/1050307980.db2.gz VZRIYHKIDAVOMO-LMDPOFIKSA-N 2 0 330.516 4.138 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]CCc2ccccc2C(F)(F)F)CC1 ZINC001173107875 1050308025 /nfs/dbraw/zinc/30/80/25/1050308025.db2.gz QMYVBGUUBVKSKO-UHFFFAOYSA-N 2 0 342.449 4.491 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]Cc2ccc(-c3cccnc3)cc2)CC1 ZINC001173108167 1050308373 /nfs/dbraw/zinc/30/83/73/1050308373.db2.gz ZKHBYOHEXUEKNN-UHFFFAOYSA-N 2 0 337.511 4.491 20 0 EIADRP CC[NH+](CC)C1CCC([N@@H+]2CCC[C@@H](Sc3ccncc3)C2)CC1 ZINC001173114700 1050309072 /nfs/dbraw/zinc/30/90/72/1050309072.db2.gz QMJNCKDAZSINCW-AFMYVXGZSA-N 2 0 347.572 4.291 20 0 EIADRP CC[NH+](CC)C1CCC([NH+]2CCC(Sc3ccncc3)CC2)CC1 ZINC001173114891 1050309441 /nfs/dbraw/zinc/30/94/41/1050309441.db2.gz VKDUCXRAQIUJIW-UHFFFAOYSA-N 2 0 347.572 4.291 20 0 EIADRP CC[NH+](CC)C1CCC([NH2+]C(C)(C)Cc2cccc(OC)c2)CC1 ZINC001173111169 1050310856 /nfs/dbraw/zinc/31/08/56/1050310856.db2.gz YHXIUPDLUBREBO-UHFFFAOYSA-N 2 0 332.532 4.259 20 0 EIADRP C[C@]1(C[NH3+])CCC[N@H+](Cc2ccc(Cl)cc2Br)CC1 ZINC001206311596 1050339596 /nfs/dbraw/zinc/33/95/96/1050339596.db2.gz REIWDZMTBZUBTB-HNNXBMFYSA-N 2 0 345.712 4.053 20 0 EIADRP [NH3+]CCC[N@H+](C1CCCCC1)C1CCC(Oc2ccccc2)CC1 ZINC001173197755 1050342240 /nfs/dbraw/zinc/34/22/40/1050342240.db2.gz JADCWDBZXYKMDG-UHFFFAOYSA-N 2 0 330.516 4.360 20 0 EIADRP c1ccc(OC2CCC([NH+]3CCC([NH+]4CCCCC4)CC3)CC2)cc1 ZINC001173201185 1050345517 /nfs/dbraw/zinc/34/55/17/1050345517.db2.gz ZBBOGLKCCKJWMB-UHFFFAOYSA-N 2 0 342.527 4.327 20 0 EIADRP CC[C@H]1CC[C@@H]([N@H+](Cc2ccccc2OC)[C@H]2CC[C@H]([NH3+])CC2)C1 ZINC001173272787 1050392764 /nfs/dbraw/zinc/39/27/64/1050392764.db2.gz WWCPNVZHRMSPLC-FRYIKTPZSA-N 2 0 330.516 4.346 20 0 EIADRP Fc1ccccc1C[NH2+][C@@H]1CCC[C@H]2C[N@H+](Cc3ccccc3)C[C@H]21 ZINC001178285385 1050428409 /nfs/dbraw/zinc/42/84/09/1050428409.db2.gz QAXIYOGTYUTDBU-TUNNFDKTSA-N 2 0 338.470 4.216 20 0 EIADRP CC[N@H+]([C@@H]1CCOC1)C1CC[NH+]([C@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173343033 1050431959 /nfs/dbraw/zinc/43/19/59/1050431959.db2.gz GKYKFAJMGBBABW-LEWJYISDSA-N 2 0 348.575 4.455 20 0 EIADRP C[N@H+](C1CCOCC1)C1CC[NH+]([C@@H]2CCCC3(CCCCC3)C2)CC1 ZINC001173344313 1050434745 /nfs/dbraw/zinc/43/47/45/1050434745.db2.gz VAVLZDUYYSAVCA-OAQYLSRUSA-N 2 0 348.575 4.455 20 0 EIADRP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@H]2CC[NH+](C)C[C@H]2C1 ZINC001173553723 1050481356 /nfs/dbraw/zinc/48/13/56/1050481356.db2.gz XZAUYNIFUIXASL-IMJJTQAJSA-N 2 0 341.326 4.198 20 0 EIADRP C[C@@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 ZINC001173548493 1050486394 /nfs/dbraw/zinc/48/63/94/1050486394.db2.gz CGMKKNLJRZBNCQ-KSSFIOAISA-N 2 0 341.326 4.342 20 0 EIADRP C[C@H](CCc1ccc(Cl)c(Cl)c1)[N@@H+]1C[C@@H]2CCCN(C)[C@@H]2C1 ZINC001173551664 1050487083 /nfs/dbraw/zinc/48/70/83/1050487083.db2.gz UQGOASXYAXMGKB-QIIPPGSGSA-N 2 0 341.326 4.341 20 0 EIADRP C[NH+]1CCC(CC[NH2+]C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173685005 1050537623 /nfs/dbraw/zinc/53/76/23/1050537623.db2.gz ZEOONLCPSRAXCB-UHFFFAOYSA-N 2 0 326.528 4.135 20 0 EIADRP C[NH+](C)C1CCC([NH2+]C2CCC3(CCc4ccccc43)CC2)CC1 ZINC001173688540 1050541163 /nfs/dbraw/zinc/54/11/63/1050541163.db2.gz GULQJLPJBSHHPQ-UHFFFAOYSA-N 2 0 326.528 4.276 20 0 EIADRP Cc1ccc(C[NH2+]Cc2ccccc2C[N@@H+](C)C2CCCCC2)cn1 ZINC000155534651 1050552335 /nfs/dbraw/zinc/55/23/35/1050552335.db2.gz YZWRCLJVANLOLG-UHFFFAOYSA-N 2 0 337.511 4.444 20 0 EIADRP CCC[N@H+](Cc1ccccc1)Cc1ccc(NCc2cncn2C)cc1 ZINC001179044549 1050613294 /nfs/dbraw/zinc/61/32/94/1050613294.db2.gz HZMFALBAWPIMAS-UHFFFAOYSA-N 2 0 348.494 4.444 20 0 EIADRP CC(C)[NH+]1CCC(CC[NH2+]Cc2ccc3ccc(F)c(F)c3n2)CC1 ZINC001179278728 1050671525 /nfs/dbraw/zinc/67/15/25/1050671525.db2.gz YHZGUMVMQRRSMS-UHFFFAOYSA-N 2 0 347.453 4.113 20 0 EIADRP CC[N@H+](C)C[C@H]1CC[NH+](Cc2ccc(-c3ccccc3OC)cc2)C1 ZINC000093770398 1050691792 /nfs/dbraw/zinc/69/17/92/1050691792.db2.gz JYMSEXIYFVGQBO-LJQANCHMSA-N 2 0 338.495 4.136 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C2CC[NH+](C3CCCCC3)CC2)cc1C ZINC001179541496 1050721599 /nfs/dbraw/zinc/72/15/99/1050721599.db2.gz MJEGJBWDUGPVRC-KRWDZBQOSA-N 2 0 330.516 4.451 20 0 EIADRP CC[N@H+](C)Cc1cccc(C[NH2+][C@H](C)c2ccccc2N(C)C)c1 ZINC000093944631 1050727040 /nfs/dbraw/zinc/72/70/40/1050727040.db2.gz FNJFWYRTBHWAKF-QGZVFWFLSA-N 2 0 325.500 4.055 20 0 EIADRP C[C@@]1(C[N@@H+]2CC[C@@]3(C2)CCC[NH+](Cc2ccccc2)C3)CCCS1 ZINC001179864193 1050808679 /nfs/dbraw/zinc/80/86/79/1050808679.db2.gz UUAYLZCESMAYMU-SFTDATJTSA-N 2 0 344.568 4.260 20 0 EIADRP Cc1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@H](C[NH+]2CCCCC2)C1 ZINC001179877564 1050813211 /nfs/dbraw/zinc/81/32/11/1050813211.db2.gz HHNHJOIRRKERDL-MRXNPFEDSA-N 2 0 340.433 4.322 20 0 EIADRP C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCC[NH+](C[C@H]2CCc3ccccc32)C1 ZINC001180030505 1050860934 /nfs/dbraw/zinc/86/09/34/1050860934.db2.gz NRWHHXKGZPBBNS-SFHLNBCPSA-N 2 0 326.528 4.303 20 0 EIADRP CC[C@H](Cc1ccccc1)[N@H+](CC)Cc1ccnn1-c1cc[nH+]cc1 ZINC001180057674 1050868655 /nfs/dbraw/zinc/86/86/55/1050868655.db2.gz HMSFQHMRQSFYAL-LJQANCHMSA-N 2 0 334.467 4.111 20 0 EIADRP C[C@@H](c1cccc(C(F)(F)F)c1)[N@H+](C[C@H]1CCC[NH2+]C1)C1CC1 ZINC000261895230 1050871579 /nfs/dbraw/zinc/87/15/79/1050871579.db2.gz OFRPEUBQQFGASB-KBPBESRZSA-N 2 0 326.406 4.230 20 0 EIADRP Cc1cc(F)ncc1C[NH+]1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC001180225920 1050921177 /nfs/dbraw/zinc/92/11/77/1050921177.db2.gz XCGUDBPIQJLAAH-KRWDZBQOSA-N 2 0 333.495 4.006 20 0 EIADRP CC[NH+](CC)Cc1cc([C@H](C)[NH2+][C@@H](C)C2CCOCC2)ccc1OC ZINC000183130354 1050987598 /nfs/dbraw/zinc/98/75/98/1050987598.db2.gz HOEWWQAIHPAKRH-IRXDYDNUSA-N 2 0 348.531 4.003 20 0 EIADRP CC[NH+](CC)CCCC1CC[NH+](Cc2cccn2C(F)F)CC1 ZINC001180820467 1051082880 /nfs/dbraw/zinc/08/28/80/1051082880.db2.gz OAFNLXXVMSJQLI-UHFFFAOYSA-N 2 0 327.463 4.217 20 0 EIADRP C[C@H](CCc1cncc2ccccc21)[NH2+]CC[C@H](C)[NH+]1CCCCC1 ZINC001180809151 1051088419 /nfs/dbraw/zinc/08/84/19/1051088419.db2.gz BDMZYUYXTYLOER-MOPGFXCFSA-N 2 0 339.527 4.410 20 0 EIADRP COc1ccc([C@H](C)[NH2+]C[C@H](C)SC)cc1C[NH+]1CCCCC1 ZINC000183378173 1051102943 /nfs/dbraw/zinc/10/29/43/1051102943.db2.gz WTMDLUBOAOHFFD-HOTGVXAUSA-N 2 0 336.545 4.083 20 0 EIADRP CC[NH+](CC)CC1CC[NH+](Cc2cccc(OC(C)(C)C)c2)CC1 ZINC001190348657 1051160246 /nfs/dbraw/zinc/16/02/46/1051160246.db2.gz NMLQKFSGBIIRLX-UHFFFAOYSA-N 2 0 332.532 4.418 20 0 EIADRP C[C@@H](CC[NH+](C)C)[NH2+][C@H]1CCCc2cc(SC(F)F)ccc21 ZINC000775380435 1051174103 /nfs/dbraw/zinc/17/41/03/1051174103.db2.gz IPQFGRPCLISZLH-LRDDRELGSA-N 2 0 328.472 4.309 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]Cc2ccoc2C)ccc1OC ZINC000775381223 1051174448 /nfs/dbraw/zinc/17/44/48/1051174448.db2.gz BLSCKCGNQQZFPT-OAHLLOKOSA-N 2 0 330.472 4.289 20 0 EIADRP COc1ccc([C@@H](C)[NH2+]C[C@@H](OC)C(C)C)cc1C[NH+]1CCCCC1 ZINC000775396030 1051218255 /nfs/dbraw/zinc/21/82/55/1051218255.db2.gz OWYVVHMMDCBTCK-DYESRHJHSA-N 2 0 348.531 4.003 20 0 EIADRP CC1CC[NH+](C[C@@H]2CCC[N@H+](CC3([C@H]4CCCCO4)CCC3)C2)CC1 ZINC001190651125 1051244215 /nfs/dbraw/zinc/24/42/15/1051244215.db2.gz JFEXTMCRUHUJDX-LEWJYISDSA-N 2 0 348.575 4.170 20 0 EIADRP C[NH+]1CCC([C@H]2CC[N@H+](Cc3ccc(-c4ccc(F)cc4)o3)C2)CC1 ZINC001181514242 1051245728 /nfs/dbraw/zinc/24/57/28/1051245728.db2.gz BXLBHPKMTJJIQN-SFHVURJKSA-N 2 0 342.458 4.249 20 0 EIADRP CC1CC[NH+](C[C@H]2CCC[N@H+](CC3([C@@H]4CCCCO4)CCC3)C2)CC1 ZINC001190651127 1051245946 /nfs/dbraw/zinc/24/59/46/1051245946.db2.gz JFEXTMCRUHUJDX-RTWAWAEBSA-N 2 0 348.575 4.170 20 0 EIADRP C[C@@H](C[NH2+][C@@H]1C[C@H]2C[C@@H](C1)[N@H+](Cc1ccccc1)C2)c1ccccc1 ZINC000716654492 1051276832 /nfs/dbraw/zinc/27/68/32/1051276832.db2.gz HYVSFXPFRWMOLX-MHADKKCISA-N 2 0 334.507 4.433 20 0 EIADRP C([C@H]1CCCC12CCOCC2)[N@@H+]1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC001190827420 1051286718 /nfs/dbraw/zinc/28/67/18/1051286718.db2.gz PJTAUJRJEHNSQW-LEWJYISDSA-N 2 0 348.575 4.171 20 0 EIADRP CC(C)[N@H+](C)Cc1ccccc1C[NH2+][C@@H](C)c1ccc2c(c1)OCO2 ZINC000154845840 1051342083 /nfs/dbraw/zinc/34/20/83/1051342083.db2.gz WYHFSPUZYREFKQ-INIZCTEOSA-N 2 0 340.467 4.106 20 0 EIADRP COc1ccccc1[C@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C(C)C ZINC000154856311 1051343510 /nfs/dbraw/zinc/34/35/10/1051343510.db2.gz DEXWLNLGMTVGHE-KRWDZBQOSA-N 2 0 326.484 4.386 20 0 EIADRP FC(F)c1ccc(C[NH2+]C[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000310070910 1051372091 /nfs/dbraw/zinc/37/20/91/1051372091.db2.gz DFNSNYOZLBPBBD-GOSISDBHSA-N 2 0 330.422 4.236 20 0 EIADRP C[C@H](CCc1ccccc1)[N@H+](C)C[C@@H]1CC[NH+](Cc2ccccc2)C1 ZINC001191233029 1051405053 /nfs/dbraw/zinc/40/50/53/1051405053.db2.gz KEEDDUCXBREVGG-OFNKIYASSA-N 2 0 336.523 4.462 20 0 EIADRP CCC[N@H+](C)C[C@@H]1CC[NH+](CCCOc2cccc3ccccc32)C1 ZINC001191367697 1051444424 /nfs/dbraw/zinc/44/44/24/1051444424.db2.gz TYJIEXNRAVVIMV-IBGZPJMESA-N 2 0 340.511 4.272 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](CC)C1)c1ccc2cc(OC)ccc2c1 ZINC000163255643 1051559510 /nfs/dbraw/zinc/55/95/10/1051559510.db2.gz FLZBKIBHOAJHLJ-KKSFZXQISA-N 2 0 326.484 4.231 20 0 EIADRP c1ccc(C[N@H+]2CC=C(Nc3ccccc3C[NH+]3CCCC3)CC2)cc1 ZINC001175506243 1051640480 /nfs/dbraw/zinc/64/04/80/1051640480.db2.gz QGUHEEKADQJWRI-UHFFFAOYSA-N 2 0 347.506 4.484 20 0 EIADRP CC(C)C[N@@H+](Cc1cc(-c2ccccc2)no1)CC1CC[NH+](C)CC1 ZINC001175601878 1051666981 /nfs/dbraw/zinc/66/69/81/1051666981.db2.gz WJESCJWBKTWTFC-UHFFFAOYSA-N 2 0 341.499 4.141 20 0 EIADRP C[C@H]1[C@@H](c2ccccc2)c2ccccc2CC[N@@H+]1CCCn1ccnc1 ZINC001192334056 1051692570 /nfs/dbraw/zinc/69/25/70/1051692570.db2.gz GKCQQYDYDSECCJ-CVDCTZTESA-N 2 0 345.490 4.352 20 0 EIADRP Cc1ccc(CC[NH2+][C@H]2C[C@H]3C[C@@H](C2)[N@H+](Cc2ccccc2)C3)cc1C ZINC001182817341 1051718090 /nfs/dbraw/zinc/71/80/90/1051718090.db2.gz SKGSCOPHILUZSF-HJOGWXRNSA-N 2 0 348.534 4.489 20 0 EIADRP c1ccc(SC2CC([NH2+]C[C@@H]3CCN3C3CCCCC3)C2)cc1 ZINC001182919169 1051730536 /nfs/dbraw/zinc/73/05/36/1051730536.db2.gz VYCFDMQRHYGCFT-IPCDKGFNSA-N 2 0 330.541 4.306 20 0 EIADRP C[C@H]1C[N@H+](CCC[NH+]2CCC(Cc3ccccc3)CC2)C(C)(C)C1 ZINC001175758306 1051770822 /nfs/dbraw/zinc/77/08/22/1051770822.db2.gz LYVRIKXKJOFTSK-LJQANCHMSA-N 2 0 328.544 4.452 20 0 EIADRP C[NH+]1CCC(C[NH2+][C@@H]2CCC[C@H](C3CC3)C2)(c2ccccc2)CC1 ZINC001183355476 1051826420 /nfs/dbraw/zinc/82/64/20/1051826420.db2.gz QQMYHONBMKCULH-PZJWPPBQSA-N 2 0 326.528 4.208 20 0 EIADRP CC(C)(C)SCCC[N@@H+]1C[C@H]2C[NH+](Cc3ccccc3)C[C@@]2(C)C1 ZINC001175973080 1051854979 /nfs/dbraw/zinc/85/49/79/1051854979.db2.gz ISJVETGHNNRGLE-PZJWPPBQSA-N 2 0 346.584 4.362 20 0 EIADRP C[C@H]1C[NH+](Cc2ccccc2)C[C@H](C)C1[NH2+]Cc1ccc2cc[nH]c2c1 ZINC001193091737 1051873810 /nfs/dbraw/zinc/87/38/10/1051873810.db2.gz BHDIIDPAQQWFPA-ROUUACIJSA-N 2 0 347.506 4.414 20 0 EIADRP Cc1cc(C[NH2+]C2[C@H](C)C[NH+](Cc3ccccc3)C[C@H]2C)cs1 ZINC001193092682 1051876568 /nfs/dbraw/zinc/87/65/68/1051876568.db2.gz FYZBLEDBKOURSW-HZPDHXFCSA-N 2 0 328.525 4.303 20 0 EIADRP CCCOc1cccc(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c1 ZINC001193251616 1051891711 /nfs/dbraw/zinc/89/17/11/1051891711.db2.gz VFFRQDNUKCHGGU-IEBWSBKVSA-N 2 0 330.516 4.218 20 0 EIADRP C[C@]1(c2ccccc2)CC[C@H]([NH2+]C2CCC(C)([NH+]3CCC3)CC2)C1 ZINC001184135537 1051952189 /nfs/dbraw/zinc/95/21/89/1051952189.db2.gz RMDCHYCIIHSBON-INAZGPRKSA-N 2 0 326.528 4.493 20 0 EIADRP C[C@]1(c2ccccc2)CC[C@@H]([NH2+]C2CCC(C)([NH+]3CCC3)CC2)C1 ZINC001184135539 1051952414 /nfs/dbraw/zinc/95/24/14/1051952414.db2.gz RMDCHYCIIHSBON-QSRFUDQGSA-N 2 0 326.528 4.493 20 0 EIADRP CC1([NH+]2CCC2)CCC([NH2+][C@H]2CCC[C@H]2Cc2ccccc2)CC1 ZINC001184135356 1051952573 /nfs/dbraw/zinc/95/25/73/1051952573.db2.gz OYSOAFKRABOLOK-NUTQKKSESA-N 2 0 326.528 4.394 20 0 EIADRP Cc1cc(C[N@H+]2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@H]3C2)ccc1C(F)(F)F ZINC001184301176 1051982629 /nfs/dbraw/zinc/98/26/29/1051982629.db2.gz GARQDWZFRRPWTE-YESZJQIVSA-N 2 0 340.433 4.176 20 0 EIADRP C[C@@H]1CCCC[C@H]1C[N@H+]1C[C@@H]2C[NH+](Cc3ccccc3)CC[C@@H]2C1 ZINC001176263198 1051987202 /nfs/dbraw/zinc/98/72/02/1051987202.db2.gz QYJJLQWTRJERCO-ZDFPQIBNSA-N 2 0 326.528 4.267 20 0 EIADRP CC[NH+](CC)Cc1cccc(C[NH2+][C@@H]2CCc3ccc(OC)cc32)c1 ZINC000163549352 1051994943 /nfs/dbraw/zinc/99/49/43/1051994943.db2.gz XOMGXDCUJPLZOT-JOCHJYFZSA-N 2 0 338.495 4.314 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(OCCC[NH+](C)C)cc1)c1cc(F)cc(F)c1 ZINC000165183089 1052055479 /nfs/dbraw/zinc/05/54/79/1052055479.db2.gz RIBAYDYPFLRETF-OAHLLOKOSA-N 2 0 348.437 4.146 20 0 EIADRP Cc1ccc(C[NH+]2CC[C@H](C[N@@H+](C)Cc3ccccc3CF)C2)s1 ZINC001194153712 1052089978 /nfs/dbraw/zinc/08/99/78/1052089978.db2.gz QRCAJGXSCGYJAW-QGZVFWFLSA-N 2 0 346.515 4.480 20 0 EIADRP C[C@H]1CCCC[N@@H+]1Cc1ccc(CN[C@H]2CC[NH+](C)C(C)(C)C2)cc1 ZINC000623357195 1052634682 /nfs/dbraw/zinc/63/46/82/1052634682.db2.gz BZJDZANHKHMQGR-RXVVDRJESA-N 3 0 343.559 4.023 20 0 EIADRP C[C@@H](Cc1ccc(C(F)(F)F)cc1)[NH2+][C@@H]1CC[N@H+](C)C(C)(C)C1 ZINC000623382631 1052640487 /nfs/dbraw/zinc/64/04/87/1052640487.db2.gz NQGYSOUHKZLTGJ-XJKSGUPXSA-N 2 0 328.422 4.099 20 0 EIADRP C[C@H]([NH2+]C1(CN[C@H]2CC[N@H+](C)C(C)(C)C2)CCCC1)c1ccccc1 ZINC000623427614 1052654883 /nfs/dbraw/zinc/65/48/83/1052654883.db2.gz FTQLKYLPBODQAX-ICSRJNTNSA-N 2 0 343.559 4.112 20 0 EIADRP C[C@@H]([NH2+]Cc1ccc(Cl)s1)c1ccc(OCC[NH+](C)C)cc1 ZINC000177860665 1052693102 /nfs/dbraw/zinc/69/31/02/1052693102.db2.gz XCIOSVLSBNLMNX-CYBMUJFWSA-N 2 0 338.904 4.193 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1cccc(OCC[NH+](C)C)c1 ZINC000178087748 1052697721 /nfs/dbraw/zinc/69/77/21/1052697721.db2.gz FSEGMWQZFVOECQ-QVKFZJNVSA-N 2 0 342.458 4.104 20 0 EIADRP C[C@@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1ccc(OCC[NH+](C)C)cc1 ZINC000178087260 1052698234 /nfs/dbraw/zinc/69/82/34/1052698234.db2.gz FTPJJTSEJRMVEO-QVKFZJNVSA-N 2 0 342.458 4.104 20 0 EIADRP C[C@H]([NH2+]Cc1ccc(C[NH+]2CCCC2)cc1)c1ccccc1N(C)C ZINC000179398987 1052733659 /nfs/dbraw/zinc/73/36/59/1052733659.db2.gz BDLWQMDMRASILX-SFHVURJKSA-N 2 0 337.511 4.199 20 0 EIADRP C[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3c4cc(Cl)ccc4[nH]c32)CC[N@@H+]1C ZINC000623898299 1052832504 /nfs/dbraw/zinc/83/25/04/1052832504.db2.gz FAOWKUYTOFTHMU-RVZJWNSFSA-N 2 0 331.891 4.271 20 0 EIADRP CCC[C@H]([NH2+]C1CC[NH+](CCCOC)CC1)c1cc(C)sc1C ZINC000623884929 1052833454 /nfs/dbraw/zinc/83/34/54/1052833454.db2.gz MWCUOCCPTNLJRC-IBGZPJMESA-N 2 0 338.561 4.297 20 0 EIADRP C[C@@H]([NH2+]CC[C@H]1CCC[N@H+](C)C1)c1ccc(F)cc1C(F)(F)F ZINC000623999524 1052849990 /nfs/dbraw/zinc/84/99/90/1052849990.db2.gz SXFVBWIXIZANPC-CHWSQXEVSA-N 2 0 332.385 4.227 20 0 EIADRP Cc1ccc(C(C)(C)C[NH2+]C2CC[NH+]([C@@H]3CCC[C@H](C)C3)CC2)nc1 ZINC000624112845 1052866006 /nfs/dbraw/zinc/86/60/06/1052866006.db2.gz NHDFNVCOWVQAJD-FXAWDEMLSA-N 2 0 343.559 4.300 20 0 EIADRP COc1ccc(C2CCC([NH2+]C[C@@H]3CCCC[N@H+](C)C3)CC2)cc1 ZINC000624121875 1052867633 /nfs/dbraw/zinc/86/76/33/1052867633.db2.gz FCTUWUIVOPKRLN-ZJRDLVKKSA-N 2 0 330.516 4.043 20 0 EIADRP C[C@@H]([NH2+]C[C@H]1CCCC[N@H+](C)C1)[C@@H]1C[C@H]1c1ccc(Cl)s1 ZINC000624124050 1052868419 /nfs/dbraw/zinc/86/84/19/1052868419.db2.gz VZJICWSWENQDBP-APIJFGDWSA-N 2 0 326.937 4.215 20 0 EIADRP C[C@@H]([NH2+]C[C@@H]1CCCC[N@H+](C)C1)c1ccc(F)cc1C(F)(F)F ZINC000624125006 1052868442 /nfs/dbraw/zinc/86/84/42/1052868442.db2.gz QUOXXPWTDWFLTH-OLZOCXBDSA-N 2 0 332.385 4.227 20 0 EIADRP Cc1cc(C[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c2ccccc2n1 ZINC000185694718 1053020081 /nfs/dbraw/zinc/02/00/81/1053020081.db2.gz MEMZAHOUNBGOPK-QZTJIDSGSA-N 2 0 337.511 4.286 20 0 EIADRP CSc1ccc(OCC[NH2+][C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cc1 ZINC000185763787 1053021654 /nfs/dbraw/zinc/02/16/54/1053021654.db2.gz FCLCYPLZUYMXKA-IAGOWNOFSA-N 2 0 348.556 4.030 20 0 EIADRP C[C@@H]([NH2+]Cc1cc(Cl)cs1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000382062849 1053137815 /nfs/dbraw/zinc/13/78/15/1053137815.db2.gz PYXCHVBJSWHZOZ-GDBMZVCRSA-N 2 0 334.916 4.402 20 0 EIADRP CO[C@H](C)C[N@@H+]1CCCCC[C@H]1C1CC[NH+](Cc2ccccc2)CC1 ZINC001194940898 1053192420 /nfs/dbraw/zinc/19/24/20/1053192420.db2.gz CZCUHPVLRNEPBN-KNQAVFIVSA-N 2 0 344.543 4.178 20 0 EIADRP C[N@H+](CCC[NH+]1CCC(Cc2ccccc2)CC1)C1CC(C)(C)C1 ZINC001194994382 1053221399 /nfs/dbraw/zinc/22/13/99/1053221399.db2.gz WGBWSISCEUDVBK-UHFFFAOYSA-N 2 0 328.544 4.452 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+]CCc2ccoc2)ccc1OC ZINC000850532321 1053292359 /nfs/dbraw/zinc/29/23/59/1053292359.db2.gz SJCDDAPECJLKGG-MRXNPFEDSA-N 2 0 330.472 4.023 20 0 EIADRP CC[C@H]([NH2+]C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1F ZINC000383365056 1053328204 /nfs/dbraw/zinc/32/82/04/1053328204.db2.gz UXUUVOAWPQDXLT-RXVVDRJESA-N 2 0 326.459 4.389 20 0 EIADRP Cc1ccc(C[NH2+][C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000383428559 1053338084 /nfs/dbraw/zinc/33/80/84/1053338084.db2.gz BIUMWIXIEPRFTR-FXAWDEMLSA-N 2 0 326.459 4.134 20 0 EIADRP Cc1ccc(C[NH2+][C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1F ZINC000383428565 1053338289 /nfs/dbraw/zinc/33/82/89/1053338289.db2.gz BIUMWIXIEPRFTR-XLIONFOSSA-N 2 0 326.459 4.134 20 0 EIADRP CSc1ccc(C[NH2+][C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1 ZINC000383677414 1053373401 /nfs/dbraw/zinc/37/34/01/1053373401.db2.gz NSCKIMJFFTYGOC-YLJYHZDGSA-N 2 0 340.536 4.409 20 0 EIADRP C[C@H]([NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1)c1ccc2c(c1)CCO2 ZINC000764973527 1053395693 /nfs/dbraw/zinc/39/56/93/1053395693.db2.gz QSHIXLAIBUKJAC-KSZLIROESA-N 2 0 330.516 4.030 20 0 EIADRP C[C@H](CSC(C)(C)C)[NH2+]C[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000765450261 1053550944 /nfs/dbraw/zinc/55/09/44/1053550944.db2.gz PBYNWNYEOWEPQC-MJGOQNOKSA-N 2 0 334.573 4.408 20 0 EIADRP COCC1([NH2+]Cc2cccc(C[NH+]3CCCCC3)c2)CCCCC1 ZINC001196442252 1053661079 /nfs/dbraw/zinc/66/10/79/1053661079.db2.gz PYNDSEGQAUPHHK-UHFFFAOYSA-N 2 0 330.516 4.111 20 0 EIADRP C[NH+]1CCC(C)(C[NH2+][C@H](CCc2ccccc2)c2ccccn2)CC1 ZINC000866337086 1053695675 /nfs/dbraw/zinc/69/56/75/1053695675.db2.gz OHNSAHKMNGSWAG-OAQYLSRUSA-N 2 0 337.511 4.077 20 0 EIADRP COCc1cc([C@H](C)[NH2+]CCC2CC[NH+](C(C)C)CC2)ccc1OC ZINC000866467822 1053740563 /nfs/dbraw/zinc/74/05/63/1053740563.db2.gz RIORCJJDCQLGQY-KRWDZBQOSA-N 2 0 348.531 4.003 20 0 EIADRP COCCC[C@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1ccc(F)cc1 ZINC000866517578 1053763905 /nfs/dbraw/zinc/76/39/05/1053763905.db2.gz IWRRGHLGPGCEMA-GPJFCIFZSA-N 2 0 336.495 4.146 20 0 EIADRP C[C@@H]([NH2+]C1CCC(C)([NH+](C)C)CC1)c1cc2c(ccnc2Cl)o1 ZINC000866517796 1053764439 /nfs/dbraw/zinc/76/44/39/1053764439.db2.gz MXORFCJXTLDRBZ-WHENESEISA-N 2 0 335.879 4.395 20 0 EIADRP COc1cc([C@@H](C)[NH2+]CC[C@@H]([NH3+])C(C)C)ccc1SC(F)F ZINC000854230010 1053785277 /nfs/dbraw/zinc/78/52/77/1053785277.db2.gz CWGOSWBTTUFBDF-DGCLKSJQSA-N 2 0 332.460 4.034 20 0 EIADRP C[C@H](Cc1ccccc1F)[NH2+][C@@H](C)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000386797876 1053829695 /nfs/dbraw/zinc/82/96/95/1053829695.db2.gz MFGQFWZLYGCAFY-LVCYWYKZSA-N 2 0 340.486 4.257 20 0 EIADRP CC(C)[N@H+](C)Cc1cc(O[C@@H]2CC[NH+](C[C@@H](C)C(C)(C)C)C2)ccn1 ZINC000856558424 1054084119 /nfs/dbraw/zinc/08/41/19/1054084119.db2.gz IGNGOVBHKKLAIH-YLJYHZDGSA-N 2 0 347.547 4.057 20 0 EIADRP CCC1([NH2+]Cc2ccc(OCC[NH+]3CCCC3)cc2)CCCCC1 ZINC001202496124 1054098051 /nfs/dbraw/zinc/09/80/51/1054098051.db2.gz VTSDBCLJGLEIEQ-UHFFFAOYSA-N 2 0 330.516 4.364 20 0 EIADRP CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1N ZINC001198952644 1054311028 /nfs/dbraw/zinc/31/10/28/1054311028.db2.gz QPGKTESPSARZMF-GFCCVEGCSA-N 2 0 332.319 4.176 20 0 EIADRP CS[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(C[NH+]3CCCCC3)cc2)C1 ZINC001199021172 1054321546 /nfs/dbraw/zinc/32/15/46/1054321546.db2.gz CSFHVULXEFLRER-WOJBJXKFSA-N 2 0 332.557 4.436 20 0 EIADRP CC(C)[C@@H](C[NH2+][C@@H]1CCCc2ccccc2C1)[NH+]1CCCCCC1 ZINC001199161234 1054354935 /nfs/dbraw/zinc/35/49/35/1054354935.db2.gz IQAZKFGQPGSSJO-FGZHOGPDSA-N 2 0 328.544 4.424 20 0 EIADRP CCO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCCC[C@@H]2C)C1 ZINC001199265879 1054375929 /nfs/dbraw/zinc/37/59/29/1054375929.db2.gz FANKTOINVGYHLA-YUXAGFNASA-N 2 0 344.543 4.498 20 0 EIADRP CO[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)CC1 ZINC001199265540 1054376053 /nfs/dbraw/zinc/37/60/53/1054376053.db2.gz BJYQTINGSNXSEQ-BVYCBKJFSA-N 2 0 344.543 4.356 20 0 EIADRP CO[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2C[N@@H+]2CCC[C@@H](C)C2)CC1 ZINC001199265541 1054377245 /nfs/dbraw/zinc/37/72/45/1054377245.db2.gz BJYQTINGSNXSEQ-STZQEDGTSA-N 2 0 344.543 4.356 20 0 EIADRP CC[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C[N@H+]2C[C@H](C)C[C@H](C)C2)CCO1 ZINC001199310372 1054387034 /nfs/dbraw/zinc/38/70/34/1054387034.db2.gz TZUJWHJDPWKWHF-GKJHBJHPSA-N 2 0 344.543 4.212 20 0 EIADRP COCC(C)(C)CC[NH2+]C1CCC([N@H+](C)Cc2ccccc2)CC1 ZINC000872104451 1054389329 /nfs/dbraw/zinc/38/93/29/1054389329.db2.gz FYHBJJCDVKOSIX-UHFFFAOYSA-N 2 0 332.532 4.082 20 0 EIADRP Cc1nn(C(C)(C)C)c(C)c1C[NH2+]CCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001199321419 1054391919 /nfs/dbraw/zinc/39/19/19/1054391919.db2.gz XXEXTFHVJZQEAW-CALCHBBNSA-N 2 0 348.579 4.103 20 0 EIADRP C[C@H](C[NH2+]C[C@@H](C)Cc1ccc(C(C)(C)C)cc1)C[NH+]1CCCC1 ZINC001199403021 1054406949 /nfs/dbraw/zinc/40/69/49/1054406949.db2.gz CPARZYLOOUFSPJ-RBUKOAKNSA-N 2 0 330.560 4.484 20 0 EIADRP CC(C)(C)[C@@H](Cn1ccnc1)[NH2+]Cc1cnc(-c2cccs2)s1 ZINC001199608069 1054432127 /nfs/dbraw/zinc/43/21/27/1054432127.db2.gz BRSJLMLPPUVCPI-OAHLLOKOSA-N 2 0 346.525 4.273 20 0 EIADRP c1csc(-c2ncc(C[NH2+][C@H]3CCCCC34CC[NH2+]CC4)s2)c1 ZINC000873232987 1054508722 /nfs/dbraw/zinc/50/87/22/1054508722.db2.gz VGVDYBMQIFXAFS-INIZCTEOSA-N 2 0 347.553 4.274 20 0 EIADRP C[C@H]([NH2+]C[C@H]1C[C@@H]([NH3+])C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000873254606 1054513674 /nfs/dbraw/zinc/51/36/74/1054513674.db2.gz YECMPUKVKKLMOO-MWODSPESSA-N 2 0 340.311 4.112 20 0 EIADRP Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)[NH2+]C[C@H]1C[C@@H]([NH3+])C1 ZINC000873253903 1054514267 /nfs/dbraw/zinc/51/42/67/1054514267.db2.gz GXVSPYBEHLZRHW-HCKVZZMMSA-N 2 0 335.904 4.160 20 0 EIADRP CC[NH+](CC)Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccns2)ccc1OC ZINC000858577437 1054526351 /nfs/dbraw/zinc/52/63/51/1054526351.db2.gz PWPNVXZKHVHODR-HUUCEWRRSA-N 2 0 347.528 4.405 20 0 EIADRP CC(C)[N@@H+]1CC[C@@H](C[NH2+]Cc2ccc(OCc3ccccc3)cc2)C1 ZINC000058060969 1054552200 /nfs/dbraw/zinc/55/22/00/1054552200.db2.gz PJOOXZBTHHVZNZ-NRFANRHFSA-N 2 0 338.495 4.086 20 0 EIADRP CC1(C)Cc2cccc(C[NH2+]C3CCC([NH+]4CCCCC4)CC3)c2O1 ZINC001200881022 1054565331 /nfs/dbraw/zinc/56/53/31/1054565331.db2.gz YLNGWJVKOCFGFP-UHFFFAOYSA-N 2 0 342.527 4.287 20 0 EIADRP CC[NH+](CC)CCOc1ccc(C[NH2+]Cc2ccc(C)c(C)c2)cc1 ZINC000061051396 1054738307 /nfs/dbraw/zinc/73/83/07/1054738307.db2.gz VYMSXNICFIUOFQ-UHFFFAOYSA-N 2 0 340.511 4.314 20 0 EIADRP C[N@H+](CCC[NH2+]Cc1ccccc1C(F)(F)F)Cc1ccccc1 ZINC000061556860 1054761302 /nfs/dbraw/zinc/76/13/02/1054761302.db2.gz WTNXTQJYDIUPKO-UHFFFAOYSA-N 2 0 336.401 4.317 20 0 EIADRP c1csc(C[N@H+]2CCC3(C2)CC[NH+](C[C@@H]2CC=CCC2)CC3)c1 ZINC001201410362 1054804017 /nfs/dbraw/zinc/80/40/17/1054804017.db2.gz JPGPYHYPAQMQPE-GOSISDBHSA-N 2 0 330.541 4.392 20 0 EIADRP CCCCCC[N@@H+]1CC[C@@]2(C[NH+](CC3CC3)C[C@H]2COCC2CC2)C1 ZINC001201747064 1054894947 /nfs/dbraw/zinc/89/49/47/1054894947.db2.gz TVSDQUVIXNUKTE-VXKWHMMOSA-N 2 0 348.575 4.027 20 0 EIADRP CC[N@H+]([C@H]1CCOC1)C1CC[NH+](CC[C@H](C)CCC=C(C)C)CC1 ZINC001201981661 1054958912 /nfs/dbraw/zinc/95/89/12/1054958912.db2.gz QLDWCFNTVMZDNC-CTNGQTDRSA-N 2 0 336.564 4.334 20 0 EIADRP CC[N@H+]([C@H]1CCOC1)C1CC[NH+](CC[C@@H](C)CCC=C(C)C)CC1 ZINC001201981663 1054959497 /nfs/dbraw/zinc/95/94/97/1054959497.db2.gz QLDWCFNTVMZDNC-FPOVZHCZSA-N 2 0 336.564 4.334 20 0 EIADRP Cc1c(C[NH2+]Cc2ccccc2C[N@H+]2CCC[C@@H](C)C2)ccnc1F ZINC000862270940 1055041894 /nfs/dbraw/zinc/04/18/94/1055041894.db2.gz AMSVKXUJQVLLHH-MRXNPFEDSA-N 2 0 341.474 4.051 20 0 EIADRP Cc1cc(N2CC[NH+](CCCC(F)(F)F)CC2)c2ccccc2[nH+]1 ZINC001202377539 1055156389 /nfs/dbraw/zinc/15/63/89/1055156389.db2.gz IUVZTGGIZLTMBN-UHFFFAOYSA-N 2 0 337.389 4.008 20 0 EIADRP C[C@@H](C[NH2+][C@@H](C)c1cccc(OCC[NH+](C)C)c1)c1ccccc1 ZINC000542680027 1055820470 /nfs/dbraw/zinc/82/04/70/1055820470.db2.gz DTZQLBBGMFSIKY-ROUUACIJSA-N 2 0 326.484 4.081 20 0 EIADRP C[C@@H]([NH2+]CCCc1cccs1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000542818643 1056119763 /nfs/dbraw/zinc/11/97/63/1056119763.db2.gz XZRXJUXHEZVART-MJGOQNOKSA-N 2 0 328.525 4.181 20 0 EIADRP Cc1n[nH]cc1[C@@H](C)[NH2+]Cc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000180187121 1058422060 /nfs/dbraw/zinc/42/20/60/1058422060.db2.gz ZOFQLQLXSOWFLR-MRXNPFEDSA-N 2 0 340.515 4.333 20 0 EIADRP FC(F)(F)c1cccc(C2([NH2+][C@@H]3CC[N@@H+]4CCC[C@@H]4C3)CCC2)c1 ZINC000182331403 1059811712 /nfs/dbraw/zinc/81/17/12/1059811712.db2.gz SCHWLBLEPDEOJM-IAGOWNOFSA-N 2 0 338.417 4.301 20 0 EIADRP C[N@@H+](Cc1cccc2cnccc21)C[C@H]1CC[NH+](Cc2ccccc2)C1 ZINC000183295007 1059980238 /nfs/dbraw/zinc/98/02/38/1059980238.db2.gz CYYNSBRIAXXUFC-HXUWFJFHSA-N 2 0 345.490 4.189 20 0 EIADRP Cc1cc(C[NH2+]CCCCCCC[NH+](C)C)ccc1Br ZINC000746054967 1059995035 /nfs/dbraw/zinc/99/50/35/1059995035.db2.gz MTSRIQYNNGWXMX-UHFFFAOYSA-N 2 0 341.337 4.359 20 0 EIADRP CC(C)[PH+](CC[NH2+][C@H]1C[C@@H](C)N(C(=O)OC(C)(C)C)C1)C(C)C ZINC001168840864 1060452162 /nfs/dbraw/zinc/45/21/62/1060452162.db2.gz WGEDFIZHXMPYHB-CVEARBPZSA-N 2 0 344.480 4.273 20 0 EIADRP COc1cc(C)ccc1[C@H](C)[NH2+]C1CCC([NH+]2CCCCC2)CC1 ZINC000766511582 1060481693 /nfs/dbraw/zinc/48/16/93/1060481693.db2.gz DYULIPWVODWCMS-VIQWUECVSA-N 2 0 330.516 4.451 20 0 EIADRP Cc1nc2c(s1)[C@@H]([NH2+]C1CCC([NH+]3CCCCC3)CC1)CCC2 ZINC000766513304 1060482590 /nfs/dbraw/zinc/48/25/90/1060482590.db2.gz PZCKLBYFCRTQOH-HTWSVDAQSA-N 2 0 333.545 4.216 20 0 EIADRP C[C@@H]1C[N@H+](Cc2cccc(C(F)(F)F)c2Cl)CCC[C@@H]1C[NH3+] ZINC001205995742 1060512017 /nfs/dbraw/zinc/51/20/17/1060512017.db2.gz PTMFGELENJHKPF-VXGBXAGGSA-N 2 0 334.813 4.166 20 0 EIADRP Cc1ccc(CC[NH2+][C@H]2[C@H](C)C[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC001168993193 1060567697 /nfs/dbraw/zinc/56/76/97/1060567697.db2.gz IRYYHKDZFJPNFV-NPHXMPSESA-N 2 0 336.523 4.284 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH2+]C1(Cc3ccccc3)CCC(F)(F)CC1)C2 ZINC001169117139 1060647177 /nfs/dbraw/zinc/64/71/77/1060647177.db2.gz WKNUQGUQEBLWMZ-LDLYASANSA-N 2 0 348.481 4.392 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+]C(C)(C)Cc1ccc(C(F)(F)F)cc1)C2 ZINC001169118327 1060647353 /nfs/dbraw/zinc/64/73/53/1060647353.db2.gz HNYZGPHUNWKEKH-BJWYYQGGSA-N 2 0 340.433 4.241 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@@H]([NH2+][C@H]1C[C@@H]1c1ccc(-c3cccc(O)c3)cc1)C2 ZINC001169109085 1060658601 /nfs/dbraw/zinc/65/86/01/1060658601.db2.gz YBGVCJQYRYJDQB-PMNYKWLYSA-N 2 0 348.490 4.130 20 0 EIADRP C[N@H+]1[C@@H]2CC[C@H]1C[C@H]([NH+]1CC[C@H](c3ccc(OC(C)(C)C)cc3)C1)C2 ZINC001169160426 1060674301 /nfs/dbraw/zinc/67/43/01/1060674301.db2.gz FBUZOQODHKRDRY-HAGHYFMRSA-N 2 0 342.527 4.278 20 0 EIADRP C[C@H]1C[N@H+](Cc2cc(Cl)cc(C(F)(F)F)c2)CCC[C@H]1C[NH3+] ZINC001206011909 1060819024 /nfs/dbraw/zinc/81/90/24/1060819024.db2.gz HANOUXUPGYBENU-AAEUAGOBSA-N 2 0 334.813 4.166 20 0 EIADRP CC(C)[PH+](CC[NH2+][C@H]1CCCN(C(=O)c2ccccc2)C1)C(C)C ZINC001169752610 1060930637 /nfs/dbraw/zinc/93/06/37/1060930637.db2.gz VNCYDZVDFOMVIC-IBGZPJMESA-N 2 0 348.471 4.180 20 0 EIADRP CCC[C@@]1(COC)CCC[N@@H+]1Cc1cccc(C[NH+]2CCCCC2)c1 ZINC001169780630 1060967839 /nfs/dbraw/zinc/96/78/39/1060967839.db2.gz OKHLTRJELCJOND-QFIPXVFZSA-N 2 0 344.543 4.454 20 0 EIADRP CC[C@H](c1ccc(F)cc1)[NH+]1CCC(C[NH+]2C[C@@H](C)O[C@H](C)C2)CC1 ZINC000078847313 217134156 /nfs/dbraw/zinc/13/41/56/217134156.db2.gz RMNSWSDTZCVFLZ-CBGDNZLLSA-N 2 0 348.506 4.098 20 0 EIADRP